data_r7r0ysf
# 
_audit.revision_id     1_0 
_audit.creation_date   2022-11-23 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      7r0y 
_cell.length_a      79.288 
_cell.length_b      79.288 
_cell.length_c      138.015 
_cell.angle_alpha   90.000 
_cell.angle_beta    90.000 
_cell.angle_gamma   120.000 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.976 
# 
_entry.id   7r0y 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               7r0y 
_symmetry.space_group_name_H-M   "P 65 2 2" 
_symmetry.Int_Tables_number      179 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.pdbx_r_free_flag 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.pdbx_I_plus 
_refln.pdbx_I_plus_sigma 
_refln.pdbx_I_minus 
_refln.pdbx_I_minus_sigma 
_refln.pdbx_FWT 
_refln.pdbx_PHWT 
_refln.pdbx_DELFWT 
_refln.pdbx_DELPHWT 
1 1 1 0  0  1  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  2  x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  3  x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  4  x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  5  x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  6  x 11 ?       ?       ?           ?        ?           ?        1645.01    180         0           0           
1 1 1 0  0  7  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  8  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  9  x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  10 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  11 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  12 x 6  ?       ?       ?           ?        ?           ?        2845.52    180         0           0           
1 1 1 0  0  13 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  14 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  15 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  16 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  17 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  18 o 7  462.869 10.5677 3808.69     244.552  3808.69     244.552  28.0408    360         493.692     180         
1 1 1 0  0  19 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  20 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  21 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  22 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  23 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  24 o 17 35.1516 6.39961 25.7984     9.74272  25.7984     9.74272  420.673    8.10967e-06 846.105     8.10967e-06 
1 1 1 0  0  25 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  26 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  27 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  28 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  29 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  30 o 11 931.288 15.4191 15396.5     718.728  15396.5     718.728  746.711    180         188.684     180         
1 1 1 0  0  31 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  32 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  33 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  34 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  35 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  36 o 9  2412.69 40.394  103539      4877.84  103539      4877.84  1703.9     180         63.741      180         
1 1 1 0  0  37 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  38 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  39 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  40 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  41 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  42 o 7  72.8735 5.59399 97.3798     19.8195  97.3798     19.8195  90.0793    360         188.52      360         
1 1 1 0  0  43 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  44 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  45 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  46 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  47 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  48 o 5  149.803 5.82927 401.272     43.4566  401.272     43.4566  11.064     180         44.2019     180         
1 1 1 0  0  49 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  50 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  51 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  52 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  53 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  54 o 5  641.568 14.2533 7325.74     457.241  7325.74     457.241  470.179    9.23712e-06 90.0613     9.23712e-06 
1 1 1 0  0  55 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  56 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  57 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  58 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  59 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  60 o 8  824.899 17.7313 12130.5     731.461  12130.5     731.461  559.134    4.49829e-07 45.4681     4.49829e-07 
1 1 1 0  0  61 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  62 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  63 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  64 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  65 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  66 f 0  412.568 9.89164 3031.86     203.981  3031.86     203.981  229.31     360         0           0           
1 1 1 0  0  67 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  68 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  69 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  70 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  71 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  72 o 3  181.816 5.96441 590.408     54.0776  590.408     54.0776  103.609    1.0422e-05  16.7932     180         
1 1 1 0  0  73 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  74 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  75 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  76 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  77 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  78 o 11 315.002 8.24222 1776.1      129.707  1776.1      129.707  186.087    180         10.313      8.65054e-06 
1 1 1 0  0  79 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  80 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  81 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  82 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  83 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  84 o 7  144.269 6.19896 374.928     44.4351  374.928     44.4351  65.9685    180         38.5964     8.64897e-06 
1 1 1 0  0  85 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  86 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  87 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  88 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  89 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  90 x 5  ?       ?       ?           ?        ?           ?        38.4867    3.8634e-05  0           0           
1 1 1 0  0  91 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  92 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  93 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  94 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  95 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 0  0  96 x 12 ?       ?       ?           ?        ?           ?        32.4162    180         0           0           
1 1 1 0  0  97 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 1  0  0  x 8  ?       ?       ?           ?        ?           ?        632.414    180         0           0           
1 1 1 1  0  1  o 2  4.14508 1.83318 0.166687    0.782741 0.166687    0.782741 212.851    240         425.801     240         
1 1 1 1  0  2  o 18 119.428 3.79892 254.272     22.6316  254.272     22.6316  119.989    300         309.814     300         
1 1 1 1  0  3  o 2  505.323 16.4374 4562.38     414.246  4562.38     414.246  269.103    360         187.38      180         
1 1 1 1  0  4  o 15 489.195 11.2224 4257.62     274.466  4257.62     274.466  465.677    240         250.059     240         
1 1 1 1  0  5  o 16 138.529 2.88748 340.921     20.0062  340.921     20.0062  97.444     120         295.488     120         
1 1 1 1  0  6  o 11 359.72  4.11976 2294.79     74.2232  2294.79     74.2232  80.0772    1.56836e-05 354.572     180         
1 1 1 1  0  7  o 11 297.749 3.63889 1572.35     54.2608  1572.35     54.2608  77.0968    240         261.578     60.0001     
1 1 1 1  0  8  o 4  91.3188 1.83721 148.115     8.39234  148.115     8.39234  231.833    300         534.503     300         
1 1 1 1  0  9  o 4  559.305 5.26657 5546.74     147.559  5546.74     147.559  604.542    180         424.428     180         
1 1 1 1  0  10 o 16 251.778 3.1493  1124.32     39.7086  1124.32     39.7086  67.7089    60          0.0894792   240.001     
1 1 1 1  0  11 o 19 610.693 5.47791 6612.59     167.587  6612.59     167.587  577.373    300         280.652     300         
1 1 1 1  0  12 x 9  ?       ?       ?           ?        ?           ?        977.813    360         0           0           
1 1 1 1  0  13 o 11 223.261 2.58631 883.92      28.9196  883.92      28.9196  62.0068    240         129.282     60          
1 1 1 1  0  14 f 0  940     8.39275 15672.1     395.218  15672.1     395.218  412.606    120         0           0           
1 1 1 1  0  15 x 9  ?       ?       ?           ?        ?           ?        2336.48    180         0           0           
1 1 1 1  0  16 o 3  507.498 4.31889 4566.12     109.806  4566.12     109.806  480.037    60          237.636     60          
1 1 1 1  0  17 o 18 623.338 4.99634 6888.74     156.031  6888.74     156.031  538.078    300         187.783     300         
1 1 1 1  0  18 o 8  412.769 3.40322 3020.4      70.3761  3020.4      70.3761  187.571    180         212.507     360         
1 1 1 1  0  19 o 18 55.6341 1.88497 55.2193     5.22778  55.2193     5.22778  156.33     59.9999     336.618     59.9999     
1 1 1 1  0  20 o 3  878.282 6.75331 13681.1     297.163  13681.1     297.163  821.462    120         395.036     120         
1 1 1 1  0  21 o 7  1265.76 10.4083 28444.8     660.02   28444.8     660.02   1058.54    180         320.682     180         
1 1 1 1  0  22 o 10 804.079 6.01057 11465.8     242.139  11465.8     242.139  502.22     60          135.369     240         
1 1 1 1  0  23 o 11 238.817 2.5071  1011.28     29.9903  1011.28     29.9903  144.584    300         0.612361    300         
1 1 1 1  0  24 o 18 166.933 2.06774 494.228     17.2861  494.228     17.2861  0.900555   0.000415778 0.815658    180         
1 1 1 1  0  25 o 17 206.501 2.26243 756.14      23.4004  756.14      23.4004  24.9877    240         234.217     60          
1 1 1 1  0  26 o 8  144.744 1.97546 371.638     14.3174  371.638     14.3174  3.30512    300         159.254     300         
1 1 1 1  0  27 o 5  1227.78 9.07838 26739.7     558.45   26739.7     558.45   1028.02    360         327.366     360         
1 1 1 1  0  28 o 11 726.77  5.53495 9364.32     201.538  9364.32     201.538  443.348    240         135.019     60          
1 1 1 1  0  29 o 2  288.055 2.66612 1471.01     38.4723  1471.01     38.4723  217.258    300         33.7628     300         
1 1 1 1  0  30 o 4  375.452 3.15511 2498.85     59.3461  2498.85     59.3461  298.268    9.20197e-06 70.5161     9.20198e-06 
1 1 1 1  0  31 o 19 15.6673 2.96352 5.18113     2.01041  5.18113     2.01041  51.3635    240         103.724     240         
1 1 1 1  0  32 o 19 995.553 7.12258 17572.5     355.273  17572.5     355.273  675.076    300         40.1731     120         
1 1 1 1  0  33 o 11 962.664 6.82442 16430.2     329.157  16430.2     329.157  838.508    4.39444e-06 335.035     4.39444e-06 
1 1 1 1  0  34 o 8  573.809 4.36822 5836.66     125.58   5836.66     125.58   370.302    240         57.8235     60          
1 1 1 1  0  35 f 0  147.293 1.89659 384.791     13.9891  384.791     13.9891  59.3115    300         0           0           
1 1 1 1  0  36 o 14 1001.75 7.19793 17793.1     361.265  17793.1     361.265  673.753    360         40.9952     180         
1 1 1 1  0  37 o 9  76.1147 1.85284 103.016     7.04849  103.016     7.04849  2.78433    240.001     7.92675     240.001     
1 1 1 1  0  38 o 14 954.477 7.13849 16154.7     341.368  16154.7     341.368  804.01     120         290.442     120         
1 1 1 1  0  39 o 12 473.759 3.753   3978.83     89.0788  3978.83     89.0788  301.977    3.2662e-07  48.6413     180         
1 1 1 1  0  40 o 6  208.538 2.24229 771.1       23.4213  771.1       23.4213  40.2707    60.0003     22.5148     60.0003     
1 1 1 1  0  41 o 17 189.24  2.22056 635.08      21.0459  635.08      21.0459  94.8913    300         54.8757     120         
1 1 1 1  0  42 o 11 95.9217 1.94571 163.434     9.3357   163.434     9.3357   19.4313    180         111.943     180         
1 1 1 1  0  43 o 4  430.053 3.563   3278.88     76.7652  3278.88     76.7652  365.274    60          143.502     60          
1 1 1 1  0  44 o 13 49.3722 2.08941 43.6554     5.1269   43.6554     5.1269   87.318     120         208.735     120         
1 1 1 1  0  45 o 3  201.786 2.10063 721.969     21.2319  721.969     21.2319  74.4186    360         125.129     180         
1 1 1 1  0  46 o 19 789.667 5.90662 11060.9     233.687  11060.9     233.687  499.113    240         71.7864     60          
1 1 1 1  0  47 o 9  8.01718 3.46582 0.950256    2.64788  0.950256    2.64788  59.8153    300         120.295     300         
1 1 1 1  0  48 f 0  56.5337 1.94234 57.0341     5.47318  57.0341     5.47318  4.34686    180         0           0           
1 1 1 1  0  49 f 0  240.228 2.52551 1023.38     30.3889  1023.38     30.3889  70.2945    240         0           0           
1 1 1 1  0  50 o 19 220.677 2.61021 863.766     28.8482  863.766     28.8482  219.632    300         154.81      300         
1 1 1 1  0  51 o 19 120.976 2.78669 260.205     16.8539  260.205     16.8539  30.0619    180         97.7796     8.65351e-06 
1 1 1 1  0  52 o 4  22.8414 4.10778 10.8603     4.065    10.8603     4.065    27.6819    240         58.9469     240         
1 1 1 1  0  53 o 19 236.9   2.70082 995.451     32.0455  995.451     32.0455  189.23     120         63.5505     120         
1 1 1 1  0  54 o 8  227.688 2.57096 919.517     29.3188  919.517     29.3188  134.024    180         33.726      8.64976e-06 
1 1 1 1  0  55 o 17 38.43   2.46293 26.8138     4.64922  26.8138     4.64922  44.7221    60          121.023     60          
1 1 1 1  0  56 o 3  21.5814 4.06383 9.82287     3.79734  9.82287     3.79734  49.408     120         107.297     120         
1 1 1 1  0  57 o 7  426.689 3.90813 3230.17     83.5364  3230.17     83.5364  393.766    360         227.185     360         
1 1 1 1  0  58 o 7  739.249 6.23411 9708.97     230.88   9708.97     230.88   544.231    240         120.727     240         
1 1 1 1  0  59 o 12 332.061 3.39461 1956.28     56.4629  1956.28     56.4629  186.469    120         60.3521     300         
1 1 1 1  0  60 o 16 248.962 2.88369 1099.68     35.9567  1099.68     35.9567  176.375    180         28.9586     180         
1 1 1 1  0  61 f 0  38.3666 3.01477 27.0481     5.61362  27.0481     5.61362  14.4849    60.0003     0           0           
1 1 1 1  0  62 o 18 593.267 5.36163 6252.27     159.349  6252.27     159.349  426.422    300         86.4463     300         
1 1 1 1  0  63 o 2  224.594 2.73853 895.07      30.8024  895.07      30.8024  120.685    1.96404e-06 47.766      180         
1 1 1 1  0  64 o 15 89.9785 2.3482  144.104     10.5557  144.104     10.5557  47.7624    60          15.854      240         
1 1 1 1  0  65 o 1  42.6294 2.97786 33.1587     6.20895  33.1587     6.20895  14.1916    120         69.5215     120         
1 1 1 1  0  66 o 6  28.6761 4.31967 16.4264     5.45548  16.4264     5.45548  4.5506     4.92044e-05 13.698      4.92044e-05 
1 1 1 1  0  67 o 15 141.259 2.37561 354.418     16.7957  354.418     16.7957  76.3541    60          26.5501     240         
1 1 1 1  0  68 o 14 72.0991 2.47951 92.8414     8.91039  92.8414     8.91039  2.6426     300.006     1.62855     300.006     
1 1 1 1  0  69 o 17 32.8354 3.8352  20.6398     5.79386  20.6398     5.79386  11.5798    180         48.7864     180         
1 1 1 1  0  70 o 10 66.2811 2.528   78.6161     8.34087  78.6161     8.34087  41.575     240         13.3045     240         
1 1 1 1  0  71 o 13 15.7406 5.5071  6.50305     5.22153  6.50305     5.22153  11.213     120         25.4757     120         
1 1 1 1  0  72 o 7  69.7619 2.57026 87.0821     8.92977  87.0821     8.92977  35.7665    180         14.1902     360         
1 1 1 1  0  73 o 9  10.4894 4.64211 1.10181     5.02811  1.10181     5.02811  19.8825    240         41.9673     240         
1 1 1 1  0  74 o 2  115.636 2.45485 238.038     14.1968  238.038     14.1968  77.1094    300         11.4257     300         
1 1 1 1  0  75 o 5  32.7044 4.16537 20.7971     6.16917  20.7971     6.16917  1.66054    180         40.9724     180         
1 1 1 1  0  76 o 8  29.981  4.64411 18.148      6.10912  18.148      6.10912  6.85085    240         16.1384     59.9999     
1 1 1 1  0  77 o 9  11.8727 5.08909 2.39719     5.60457  2.39719     5.60457  7.23732    120         17.4754     120         
1 1 1 1  0  78 o 9  81.2299 2.57128 118.029     10.4192  118.029     10.4192  32.1537    1.20591e-05 34.3283     180         
1 1 1 1  0  79 o 1  37.9592 3.92294 27.3242     6.9972   27.3242     6.9972   17.7018    240         8.77842     60.0002     
1 1 1 1  0  80 o 3  71.7351 2.88909 92.5478     10.3084  92.5478     10.3084  35.2827    120         15.7835     300         
1 1 1 1  0  81 o 11 84.3886 2.61012 127.489     10.9902  127.489     10.9902  49.9337    180         1.26172     2.16067e-05 
1 1 1 1  0  82 o 13 26.7885 5.81817 16.0825     6.82858  16.0825     6.82858  4.56016    240         19.7804     60          
1 1 1 1  0  83 o 3  11.2897 5.06619 0.898272    6.22329  0.898272    6.22329  1.055      300.001     2.81468     300.001     
1 1 1 1  0  84 o 19 57.1147 3.1569  59.354      8.90532  59.354      8.90532  26.733     360         14.0489     180         
1 1 1 1  0  85 o 16 13.4103 5.6879  3.54162     6.85242  3.54162     6.85242  0.514864   59.9977     2.14134     59.9977     
1 1 1 1  0  86 o 6  38.0207 4.4368  28.0989     7.76248  28.0989     7.76248  22.093     120         0.0962147   300         
1 1 1 1  0  87 o 19 33.9806 7.25904 26.3685     10.7789  26.3685     10.7789  0.810268   8.73078e-06 41.2117     8.73074e-06 
1 1 1 1  0  88 x 0  ?       ?       ?           ?        ?           ?        25.1064    240         0           0           
1 1 1 1  0  89 x 16 ?       ?       ?           ?        ?           ?        21.035     120         0           0           
1 1 1 1  0  90 x 11 ?       ?       ?           ?        ?           ?        19.1421    180         0           0           
1 1 1 1  0  91 x 17 ?       ?       ?           ?        ?           ?        1.71244    59.9993     0           0           
1 1 1 1  0  92 x 13 ?       ?       ?           ?        ?           ?        11.2716    300         0           0           
1 1 1 1  0  93 x 6  ?       ?       ?           ?        ?           ?        67.0228    1.09184e-05 0           0           
1 1 1 1  0  94 x 19 ?       ?       ?           ?        ?           ?        25.098     240         0           0           
1 1 1 1  0  95 x 13 ?       ?       ?           ?        ?           ?        8.99847    300         0           0           
1 1 1 1  0  96 x 6  ?       ?       ?           ?        ?           ?        9.40712    1.76467e-05 0           0           
1 1 1 1  0  97 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 1  1  0  x 19 ?       ?       ?           ?        ?           ?        75.3594    359.999     0           0           
1 1 1 1  1  1  o 3  183.292 4.99656 598.021     45.7409  598.021     45.7409  218.986    210         682.615     210         
1 1 1 1  1  2  o 4  320.465 4.0854  1821.61     65.5627  1821.61     65.5627  166.525    240         93.6854     60.0001     
1 1 1 1  1  3  o 13 142.251 2.73971 359.351     19.4981  359.351     19.4981  168.369    270         481.886     270         
1 1 1 1  1  4  o 11 628.852 8.78199 7019.06     276.515  7019.06     276.515  28.5889    300.007     25.8648     300.007     
1 1 1 1  1  5  o 5  146.506 2.58704 381.033     18.9674  381.033     18.9674  41.2105    330         148.5       330         
1 1 1 1  1  6  o 6  79.3918 1.47901 111.912     5.87524  111.912     5.87524  54.6902    360         122.253     360         
1 1 1 1  1  7  o 2  727.212 7.88633 9381.09     287.254  9381.09     287.254  359.168    30          325.052     210         
1 1 1 1  1  8  o 18 354.282 3.8572  2225.73     68.4464  2225.73     68.4464  151.882    240         96.9399     240         
1 1 1 1  1  9  x 11 ?       ?       ?           ?        ?           ?        557.648    270         0           0           
1 1 1 1  1  10 o 18 1045.92 22.3179 19509.9     1167.39  19509.9     1167.39  969.524    120         440.497     120         
1 1 1 1  1  11 o 4  959.993 10.8672 16356.1     522.51   16356.1     522.51   1026.13    150         677.628     150         
1 1 1 1  1  12 o 3  1061.38 22.6299 20092.8     1201.21  20092.8     1201.21  827.162    180         135.473     180         
1 1 1 1  1  13 o 9  641.92  6.00637 7306.82     193.145  7306.82     193.145  651.645    30          385.625     30          
1 1 1 1  1  14 o 3  118.856 2.19197 250.819     13.0361  250.819     13.0361  59.7645    240         181.237     240         
1 1 1 1  1  15 o 16 515.422 4.21731 4709.6      108.9    4709.6      108.9    375.564    90          15.2593     90          
1 1 1 1  1  16 f 0  938.194 7.55037 15610       354.891  15610       354.891  689.264    120         0           0           
1 1 1 1  1  17 o 11 280.469 2.82217 1394.71     39.6488  1394.71     39.6488  163.402    150         48.9429     330         
1 1 1 1  1  18 o 16 887.726 7.37083 13977.3     327.809  13977.3     327.809  528.185    360         207.675     180         
1 1 1 1  1  19 o 7  185.45  2.50592 610.072     23.2701  610.072     23.2701  98.8251    210         453.089     210         
1 1 1 1  1  20 o 16 329.369 3.16756 1923.47     52.262   1923.47     52.262   93.1128    240         281.489     60          
1 1 1 1  1  21 f 0  92.8181 1.94593 153.056     9.03347  153.056     9.03347  33.1963    89.9995     0           0           
1 1 1 1  1  22 o 18 39.1445 2.38573 27.7517     4.59682  27.7517     4.59682  86.1561    120         179.481     120         
1 1 1 1  1  23 o 6  184.259 2.38388 602.207     21.9961  602.207     21.9961  19.953     330         5.95231     150         
1 1 1 1  1  24 o 4  516.281 4.4475  4726.08     115.032  4726.08     115.032  396.384    2.33339e-07 62.7335     2.33339e-07 
1 1 1 1  1  25 o 10 645.818 5.5355  7396        179.095  7396        179.095  528.031    30          144.091     30          
1 1 1 1  1  26 o 6  1112.49 9.19331 21958.1     512.385  21958.1     512.385  811.842    240         54.9269     240         
1 1 1 1  1  27 o 11 73.2834 2.09722 95.6248     7.67338  95.6248     7.67338  12.7989    270         32.3559     270         
1 1 1 1  1  28 o 6  752.057 6.27629 10028.7     236.471  10028.7     236.471  420.913    120         215.511     300         
1 1 1 1  1  29 o 6  115.918 2.01424 238.516     11.685   238.516     11.685   0.242165   150         9.96945     150         
1 1 1 1  1  30 o 9  645.598 5.27928 7389.28     170.752  7389.28     170.752  352.433    180         199.892     5.34151e-06 
1 1 1 1  1  31 o 14 64.2895 1.98009 73.6491     6.35186  73.6491     6.35186  113.483    30          273.602     30          
1 1 1 1  1  32 f 0  1061.67 8.44922 19988.3     449.408  19988.3     449.408  749.575    60          0           0           
1 1 1 1  1  33 o 3  528.713 4.46741 4955.71     118.331  4955.71     118.331  357.569    270         21.9554     90          
1 1 1 1  1  34 o 5  498.135 4.26622 4399.08     106.465  4399.08     106.465  426.399    300         159.62      300         
1 1 1 1  1  35 o 10 318.479 2.90631 1798.13     46.3682  1798.13     46.3682  170.078    150         102.161     330         
1 1 1 1  1  36 o 7  111.184 1.97167 219.447     10.9703  219.447     10.9703  0.208084   360         34.9697     180         
1 1 1 1  1  37 o 1  476.285 3.90036 4021.45     93.0683  4021.45     93.0683  494.302    30          329.898     30          
1 1 1 1  1  38 o 18 316.094 3.00267 1771.41     47.5453  1771.41     47.5453  144.678    240         146.978     60          
1 1 1 1  1  39 o 1  363.942 3.17366 2348.13     57.8635  2348.13     57.8635  206.649    270         88.0462     90          
1 1 1 1  1  40 o 1  158.18  2.03552 443.784     16.1236  443.784     16.1236  17.0066    300         1.66283     120         
1 1 1 1  1  41 o 1  83.2283 1.9836  123.156     8.25209  123.156     8.25209  11.9318    330         41.2685     330         
1 1 1 1  1  42 o 1  578.415 4.85528 5932.28     140.694  5932.28     140.694  324.55     180         142.379     360         
1 1 1 1  1  43 o 11 727.4   5.69881 9383.11     207.682  9383.11     207.682  585.555    210         178.101     210         
1 1 1 1  1  44 o 13 87.442  2.02515 135.919     8.85279  135.919     8.85279  1.56294    240         35.6537     240         
1 1 1 1  1  45 o 10 16.6089 4.16171 6.43325     3.15071  6.43325     3.15071  28.8023    270         58.7602     270         
1 1 1 1  1  46 o 12 519.931 4.26353 4793.61     111.057  4793.61     111.057  457.687    120         210.809     120         
1 1 1 1  1  47 o 6  187.032 2.27226 620.422     21.2836  620.422     21.2836  109.774    150         32.7017     330         
1 1 1 1  1  48 o 8  235.754 2.61082 985.684     30.8287  985.684     30.8287  120.953    360         75.9073     180         
1 1 1 1  1  49 o 8  854.985 6.58691 12974.5     282.153  12974.5     282.153  637.375    30          125.241     30          
1 1 1 1  1  50 o 3  253.037 3.39845 1136.14     43.0598  1136.14     43.0598  221.066    240         103.043     240         
1 1 1 1  1  51 o 3  61.9249 2.59095 68.6713     7.9755   68.6713     7.9755   2.41672    90.0004     11.6996     90.0004     
1 1 1 1  1  52 o 12 482.905 4.67794 4137.74     113.16   4137.74     113.16   349.785    300         55.7292     300         
1 1 1 1  1  53 f 0  346.935 3.14715 2134.57     54.6972  2134.57     54.6972  192.112    330         0           0           
1 1 1 1  1  54 o 11 373.782 3.24246 2477.77     60.7164  2477.77     60.7164  200.422    360         94.597      180         
1 1 1 1  1  55 o 18 79.4465 1.97634 112.268     7.84646  112.268     7.84646  6.81788    210         115.815     210         
1 1 1 1  1  56 o 13 182.923 2.19084 593.517     20.0705  593.517     20.0705  187.846    240         142.916     240         
1 1 1 1  1  57 o 4  381.513 3.45234 2581.89     65.9818  2581.89     65.9818  343.432    90          185.809     90          
1 1 1 1  1  58 o 1  216.658 2.46537 832.64      26.7525  832.64      26.7525  120.303    120         43.0348     300         
1 1 1 1  1  59 o 10 437.98  3.89065 3403.58     85.3656  3403.58     85.3656  315.462    330         59.3868     330         
1 1 1 1  1  60 o 5  199.151 2.45902 703.634     24.5248  703.634     24.5248  121.954    3.39057e-06 15.1179     180         
1 1 1 1  1  61 o 1  317.668 3.28485 1790.43     52.2684  1790.43     52.2684  198.762    210         14.2741     30.0001     
1 1 1 1  1  62 o 8  387.118 3.78446 2659.54     73.3874  2659.54     73.3874  292.608    60          85.0919     60          
1 1 1 1  1  63 o 7  62.3865 2.65103 69.7426     8.2191   69.7426     8.2191   6.40309    89.9999     6.23553     270         
1 1 1 1  1  64 o 14 195.726 2.70756 679.989     26.5346  679.989     26.5346  84.8655    120         81.3759     300         
1 1 1 1  1  65 o 2  91.3183 2.39639 148.448     10.9324  148.448     10.9324  28.1083    330         19.7325     330         
1 1 1 1  1  66 o 19 306.547 3.3914  1668.44     52.071   1668.44     52.071   187.664    180         15.1404     8.65126e-06 
1 1 1 1  1  67 o 19 9.58685 4.36001 0.0479221   4.8015   0.0479221   4.8015   20.2506    30          41.7887     30          
1 1 1 1  1  68 o 5  17.0008 5.62209 7.52056     5.35005  7.52056     5.35005  54.6731    240         121.159     240         
1 1 1 1  1  69 o 16 31.8881 4.27944 19.8922     6.12236  19.8922     6.12236  4.7396     270         22.5996     270         
1 1 1 1  1  70 o 6  144.566 2.60881 371.534     18.8725  371.534     18.8725  104.012    120         26.6304     120         
1 1 1 1  1  71 o 17 36.5513 3.72995 25.1746     6.419    25.1746     6.419    27.7488    150         98.8717     150         
1 1 1 1  1  72 o 3  39.8701 3.48553 29.5177     6.67843  29.5177     6.67843  5.55814    180         19.9136     360         
1 1 1 1  1  73 o 18 73.5574 2.64675 96.8127     9.69866  96.8127     9.69866  27.939     210         35.1487     30.0001     
1 1 1 1  1  74 o 17 165.189 2.53018 485.208     20.9235  485.208     20.9235  97.8968    60          8.20497     240         
1 1 1 1  1  75 o 3  10.3595 4.61109 0.916419    5.03835  0.916419    5.03835  7.15276    90.0001     15.8517     90.0001     
1 1 1 1  1  76 o 13 16.962  5.68625 7.5666      5.48836  7.5666      5.48836  4.03939    120         13.2927     120         
1 1 1 1  1  77 o 2  80.1518 2.4786  114.818     9.91244  114.818     9.91244  62.3437    330         26.9447     330         
1 1 1 1  1  78 o 12 36.1216 4.13288 25.0431     6.89407  25.0431     6.89407  3.23251    360         50.168      360         
1 1 1 1  1  79 o 14 100.143 2.47504 178.998     12.3867  178.998     12.3867  55.2618    30          10.5596     210         
1 1 1 1  1  80 o 7  33.5978 4.72079 22.4408     7.06043  22.4408     7.06043  16.0691    240         3.31827     60          
1 1 1 1  1  81 o 12 11.1493 4.94227 1.28776     5.72425  1.28776     5.72425  2.24423    270.001     5.57855     270.001     
1 1 1 1  1  82 o 19 68.8441 2.91706 85.3961     9.98048  85.3961     9.98048  41.6919    300         1.24823     300         
1 1 1 1  1  83 o 16 46.4942 3.97801 40.4018     8.90843  40.4018     8.90843  31.2073    330         7.47492     330         
1 1 1 1  1  84 o 11 70.8934 2.96079 90.6731     10.4342  90.6731     10.4342  47.8213    180         11.8344     180         
1 1 1 1  1  85 o 18 33.6433 5.62236 23.5983     8.23145  23.5983     8.23145  3.26725    30          33.0239     210         
1 1 1 1  1  86 o 4  36.5855 5.44457 27.257      8.78804  27.257      8.78804  10.4519    60          21.9172     240         
1 1 1 1  1  87 o 5  35.0276 8.30418 29.4861     13.0055  29.4861     13.0055  6.51672    270         27.7466     90          
1 1 1 1  1  88 x 3  ?       ?       ?           ?        ?           ?        0.328342   119.999     0           0           
1 1 1 1  1  89 x 13 ?       ?       ?           ?        ?           ?        6.86252    330         0           0           
1 1 1 1  1  90 x 16 ?       ?       ?           ?        ?           ?        47.7878    1.58159e-05 0           0           
1 1 1 1  1  91 x 6  ?       ?       ?           ?        ?           ?        0.0876247  209.978     0           0           
1 1 1 1  1  92 x 7  ?       ?       ?           ?        ?           ?        4.14221    240         0           0           
1 1 1 1  1  93 x 9  ?       ?       ?           ?        ?           ?        5.26862    270         0           0           
1 1 1 1  1  94 x 17 ?       ?       ?           ?        ?           ?        7.10603    120         0           0           
1 1 1 1  1  95 x 11 ?       ?       ?           ?        ?           ?        29.5083    150         0           0           
1 1 1 1  1  96 x 14 ?       ?       ?           ?        ?           ?        2.52886    180         0           0           
1 1 1 1  1  97 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 2  0  0  o 5  374.746 5.41071 2491.62     101.518  2491.62     101.518  134.195    359.999     52.8537     179.999     
1 1 1 2  0  1  x 0  ?       ?       ?           ?        ?           ?        785.42     240         0           0           
1 1 1 2  0  2  o 16 282.539 3.56278 1415.89     50.41    1415.89     50.41    56.189     120.001     10.4613     120.001     
1 1 1 2  0  3  o 1  748.136 13.3012 9949.29     497.979  9949.29     497.979  766.562    360         697.344     360         
1 1 1 2  0  4  o 11 331.797 3.31847 1951.9      55.1536  1951.9      55.1536  209.477    60.0001     13.5833     240         
1 1 1 2  0  5  o 7  509.643 4.68924 4605.13     119.719  4605.13     119.719  426.919    300         124.459     300         
1 1 1 2  0  6  o 2  894.653 27.4122 14343.2     1223.76  14343.2     1223.76  853.036    180         421.939     180         
1 1 1 2  0  7  o 6  543.184 4.95444 5231.3      134.815  5231.3      134.815  337.77     240         103.79      60          
1 1 1 2  0  8  o 6  685.595 21.43   8406.28     733.009  8406.28     733.009  190.122    300         603.06      120         
1 1 1 2  0  9  o 9  151.735 1.96564 408.354     14.9355  408.354     14.9355  57.5619    8.65655e-05 234.118     8.65655e-05 
1 1 1 2  0  10 o 19 41.4089 1.60616 30.6551     3.30998  30.6551     3.30998  46.702     59.9999     96.2693     59.9999     
1 1 1 2  0  11 o 14 671.872 6.23469 8004.67     209.843  8004.67     209.843  683.883    300         405.89      300         
1 1 1 2  0  12 o 16 49.0746 1.90795 43.0577     4.65963  43.0577     4.65963  147.169    1.8318e-05  307.975     1.8318e-05  
1 1 1 2  0  13 o 19 387.705 3.96432 2665.29     76.9887  2665.29     76.9887  346.073    240         217.957     240         
1 1 1 2  0  14 o 2  883.697 7.57716 13849.1     335.449  13849.1     335.449  766.451    300         270.091     300         
1 1 1 2  0  15 o 19 1501.97 45.6406 40924.3     3420.91  40924.3     3420.91  1099       360         53.3857     360         
1 1 1 2  0  16 o 19 827.047 6.93751 12129.9     287.446  12129.9     287.446  531.112    240         117.676     60          
1 1 1 2  0  17 o 18 648.826 5.38019 7464.19     174.885  7464.19     174.885  662.108    120         399.504     120         
1 1 1 2  0  18 o 19 76.7535 1.91787 104.774     7.35603  104.774     7.35603  7.02083    0.000327187 16.4435     0.000327187 
1 1 1 2  0  19 o 17 466.207 4.05765 3853.57     94.7688  3853.57     94.7688  379.673    240         96.4819     240         
1 1 1 2  0  20 o 10 315.963 3.00499 1770.03     47.5623  1770.03     47.5623  183.374    300         125.483     300         
1 1 1 2  0  21 o 19 567.575 4.73935 5712.07     134.762  5712.07     134.762  485.019    360         164.446     360         
1 1 1 2  0  22 o 1  602.864 5.02878 6444.77     151.882  6444.77     151.882  411.615    240         31.4388     60          
1 1 1 2  0  23 o 19 107.005 2.25089 203.428     12.0462  203.428     12.0462  131.723    300         377.81      300         
1 1 1 2  0  24 o 9  534.283 4.4447  5061.25     118.97   5061.25     118.97   465.836    180         176.162     180         
1 1 1 2  0  25 o 5  835.899 7.03543 12393.1     294.623  12393.1     294.623  824.435    240         468.441     240         
1 1 1 2  0  26 o 9  923.216 7.42225 15116.6     343.299  15116.6     343.299  861.767    120         421.635     120         
1 1 1 2  0  27 o 11 354.278 3.25132 2225.19     57.7031  2225.19     57.7031  328.751    180         163.16      180         
1 1 1 2  0  28 o 3  692.148 5.67398 8493.89     196.75   8493.89     196.75   451.855    60          69.4326     240         
1 1 1 2  0  29 f 0  189.22  2.31381 634.976     21.9262  634.976     21.9262  200.362    120         0           0           
1 1 1 2  0  30 o 2  469.391 4.06805 3906        95.6608  3906        95.6608  184.991    1.62132e-06 287.857     180         
1 1 1 2  0  31 o 5  120.917 2.05668 259.51      12.4465  259.51      12.4465  3.7279     240         24.9165     60.0004     
1 1 1 2  0  32 o 17 360.87  3.3163  2308.71     59.9514  2308.71     59.9514  225.432    300         53.1472     120         
1 1 1 2  0  33 o 11 131.867 2.13332 308.593     14.0812  308.593     14.0812  19.0925    180         28.2033     360         
1 1 1 2  0  34 o 10 1278.34 10.0997 28987.4     646.832  28987.4     646.832  858.701    60          61.5233     240         
1 1 1 2  0  35 o 8  244.775 2.72559 1062.42     33.4152  1062.42     33.4152  111.09     120         82.6685     120         
1 1 1 2  0  36 o 2  1363.14 10.7455 32966.1     733.843  32966.1     733.843  886.04     180         117.525     9.09486e-06 
1 1 1 2  0  37 o 16 89.6408 1.97917 142.794     8.87134  142.794     8.87134  28.4022    59.9999     100.265     59.9999     
1 1 1 2  0  38 o 16 1244.34 9.84655 27469.6     613.847  27469.6     613.847  950.478    300         183.072     300         
1 1 1 2  0  39 o 11 730.904 5.95213 9472.54     217.953  9472.54     217.953  622.031    180         237.15      180         
1 1 1 2  0  40 o 15 177.184 2.24589 556.809     19.9277  556.809     19.9277  77.7206    60          6.55329     60          
1 1 1 2  0  41 f 0  473.906 4.09969 3981.86     97.3323  3981.86     97.3323  362.82     120         0           0           
1 1 1 2  0  42 o 13 699.538 5.70886 8677.84     200.074  8677.84     200.074  367.876    6.91622e-07 221.5       180         
1 1 1 2  0  43 o 15 134.632 1.96951 321.583     13.2753  321.583     13.2753  27.0784    60.0001     0.622848    60          
1 1 1 2  0  44 o 9  235.148 2.43109 980.443     28.6348  980.443     28.6348  140.737    300         38.5534     120         
1 1 1 2  0  45 o 17 124.966 1.96592 277.127     12.298   277.127     12.298   48.3115    180         5.21663     8.90098e-06 
1 1 1 2  0  46 o 6  383.064 3.30133 2601.71     63.3542  2601.71     63.3542  285.063    60          51.0138     60          
1 1 1 2  0  47 o 1  398.094 3.43103 2810.04     68.4267  2810.04     68.4267  247.428    300         43.2407     120         
1 1 1 2  0  48 o 9  418.486 3.57892 3105.48     75.0327  3105.48     75.0327  250.137    180         63.9021     8.65068e-06 
1 1 1 2  0  49 o 8  635.052 4.99087 7153.92     158.791  7153.92     158.791  367.554    240         118.735     60          
1 1 1 2  0  50 o 9  440.467 4.55919 3442.22     100.589  3442.22     100.589  315.703    120         40.806      120         
1 1 1 2  0  51 o 1  439.324 4.50506 3424.47     99.138   3424.47     99.138   421.653    1.7317e-09  255.879     1.7317e-09  
1 1 1 2  0  52 o 14 258.746 3.04966 1187.64     39.5196  1187.64     39.5196  164.499    60          15.9913     240         
1 1 1 2  0  53 o 4  99.1372 2.06708 174.622     10.2494  174.622     10.2494  50.179     120         1.8039      120         
1 1 1 2  0  54 o 19 232.142 2.37614 955.669     27.6299  955.669     27.6299  179.198    180         50.6879     180         
1 1 1 2  0  55 o 16 71.6248 2.10246 91.3844     7.51697  91.3844     7.51697  17.8594    60          27.2719     240         
1 1 1 2  0  56 o 11 377.46  3.57132 2527.45     67.5282  2527.45     67.5282  276.28     120         55.2598     120         
1 1 1 2  0  57 o 9  44.9413 2.48302 36.4487     5.51153  36.4487     5.51153  16.4375    180         58.3126     180         
1 1 1 2  0  58 o 16 350.681 3.23229 2181.37     56.7828  2181.37     56.7828  301.885    60          144.654     60          
1 1 1 2  0  59 o 4  35.6467 2.84258 23.3707     4.91199  23.3707     4.91199  47.1891    120         121.508     120         
1 1 1 2  0  60 f 0  149.102 2.20487 394.539     16.4588  394.539     16.4588  155.1      180         0           0           
1 1 1 2  0  61 o 5  353.161 3.38723 2212.79     59.9238  2212.79     59.9238  198.383    60          61.0589     240         
1 1 1 2  0  62 o 2  208.121 2.5557  768.507     26.6373  768.507     26.6373  161.29     120         53.6973     120         
1 1 1 2  0  63 o 12 353.833 3.72372 2222.21     65.9962  2222.21     65.9962  207.318    180         40.9257     8.72588e-06 
1 1 1 2  0  64 o 13 160.436 2.54178 457.013     20.4131  457.013     20.4131  106.27     240         6.70546     240         
1 1 1 2  0  65 o 19 337.181 3.78652 2018.89     63.9464  2018.89     63.9464  240.416    120         49.7705     120         
1 1 1 2  0  66 o 6  194.312 2.84822 670.478     27.7084  670.478     27.7084  126.204    4.45354e-08 4.89224     4.45353e-08 
1 1 1 2  0  67 o 14 283.128 3.38424 1423.75     47.9871  1423.75     47.9871  211.239    240         63.1507     240         
1 1 1 2  0  68 o 16 82.2835 2.57079 120.785     10.5536  120.785     10.5536  26.552     300         50.7514     120         
1 1 1 2  0  69 o 10 127.563 2.5737  289.356     16.4226  289.356     16.4226  69.6722    180         21.337      8.71574e-06 
1 1 1 2  0  70 o 19 9.73416 4.39017 0.371308    4.74328  0.371308    4.74328  2.57439    60.0002     5.36572     60.0002     
1 1 1 2  0  71 o 8  49.9353 2.91789 45.166      7.1832   45.166      7.1832   30.1517    300         122.531     300         
1 1 1 2  0  72 o 15 228.281 2.83216 926.212     32.3777  926.212     32.3777  155.106    360         26.0042     360         
1 1 1 2  0  73 o 16 106.578 2.41823 202.236     12.8857  202.236     12.8857  87.3459    60          42.7556     60          
1 1 1 2  0  74 o 18 8.47352 4.01223 -1.7462     4.73706  -1.7462     4.73706  13.6844    120         28.6378     120         
1 1 1 2  0  75 o 3  69.2892 2.60695 86.0026     8.99341  86.0026     8.99341  17.7942    180         49.6305     8.6511e-06  
1 1 1 2  0  76 o 10 70.083  2.57629 87.9757     8.99217  87.9757     8.99217  31.5673    60          22.7015     240         
1 1 1 2  0  77 o 16 93.0282 2.58788 154.548     12.0223  154.548     12.0223  49.6815    120         14.0957     300         
1 1 1 2  0  78 o 9  12.354  5.02137 3.48027     4.96512  3.48027     4.96512  0.899474   180         2.26518     180         
1 1 1 2  0  79 o 2  57.909  2.92078 60.621      8.37529  60.621      8.37529  21.3331    240         27.3523     60          
1 1 1 2  0  80 o 12 64.7435 2.78924 75.4649     8.97211  75.4649     8.97211  23.6657    300         30.6095     120         
1 1 1 2  0  81 o 9  68.2896 2.91983 84.0104     9.90796  84.0104     9.90796  42.9545    360         4.06496     360         
1 1 1 2  0  82 o 5  121.268 2.52898 262.471     15.339   262.471     15.339   58.7451    60          27.1963     240         
1 1 1 2  0  83 o 13 37.8194 4.77231 28.0154     8.18736  28.0154     8.18736  13.6132    120         17.5321     300         
1 1 1 2  0  84 o 2  39.7698 4.39468 30.4217     8.121    30.4217     8.121    8.09264    360         6.41741     360         
1 1 1 2  0  85 o 2  52.2184 4.52621 51.3851     11.3687  51.3851     11.3687  22.6951    240         16.0551     60          
1 1 1 2  0  86 o 11 78.2459 3.04318 110.599     11.8499  110.599     11.8499  37.9711    300         15.696      120         
1 1 1 2  0  87 f 0  8.8629  4.51115 -16.6362    9.88799  -16.6362    9.88799  12.3116    3.07992e-05 0           0           
1 1 1 2  0  88 o 5  24.0599 11.1983 4.3417      34.359   4.3417      34.359   0.568975   60          24.9601     240         
1 1 1 2  0  89 x 10 ?       ?       ?           ?        ?           ?        51.4889    300         0           0           
1 1 1 2  0  90 x 5  ?       ?       ?           ?        ?           ?        37.8396    180         0           0           
1 1 1 2  0  91 x 4  ?       ?       ?           ?        ?           ?        4.75823    240         0           0           
1 1 1 2  0  92 x 2  ?       ?       ?           ?        ?           ?        21.0336    120         0           0           
1 1 1 2  0  93 x 17 ?       ?       ?           ?        ?           ?        18.657     180         0           0           
1 1 1 2  0  94 x 0  ?       ?       ?           ?        ?           ?        13.247     60          0           0           
1 1 1 2  0  95 x 10 ?       ?       ?           ?        ?           ?        25.6826    300         0           0           
1 1 1 2  0  96 x 3  ?       ?       ?           ?        ?           ?        0.128421   180         0           0           
1 1 1 2  0  97 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 2  1  0  o 17 221.647 2.95601 871.425     32.808   871.425     32.808   37.2266    0.000162086 86.9011     180         
1 1 1 2  1  1  f 0  483.472 5.36943 4038.72     126.268  4249.36     133.94   663.631    111.512     0           0           
1 1 1 2  1  2  o 13 343.468 3.82259 2070.77     65.7937  2110.67     65.7953  10.9324    111.264     429.837     291.264     
1 1 1 2  1  3  o 5  174.254 2.42826 522.585     21.1975  553.733     21.1991  108.812    38.3486     394.849     38.3486     
1 1 1 2  1  4  o 15 726.498 9.5534  9347.21     363.266  9382.42     331.584  697.048    124.962     412.976     124.962     
1 1 1 2  1  5  o 1  694.652 7.34656 8552.56     263.158  8561.16     248.108  550.71     130.544     146.537     130.544     
1 1 1 2  1  6  o 15 460.158 4.48422 3826.58     103.397  3679.91     103.39   354.404    72.1557     125.743     72.1557     
1 1 1 2  1  7  o 6  965.519 18.9517 16820.6     818.388  16414.1     1002.34  913.921    170.592     480.504     170.592     
1 1 1 2  1  8  o 3  549.557 5.13724 5485.47     144.575  5222.66     138.41   97.2875    130.488     569.692     310.488     
1 1 1 2  1  9  o 11 393.621 3.88032 2798.66     78.2137  2693.49     74.879   258.173    40.6582     22.5557     40.6582     
1 1 1 2  1  10 o 8  954.874 10.8936 15954.8     521.255  16416.2     521.24   742.382    272.533     141.72      272.533     
1 1 1 2  1  11 o 19 995.503 10.5729 17652.2     527.472  17526.7     527.461  824.996    88.8999     249.954     88.8999     
1 1 1 2  1  12 o 8  586.965 5.52232 6088.68     162.437  6125.82     162.442  276.472    338.584     260.313     158.584     
1 1 1 2  1  13 o 2  445.828 4.3924  3477.92     102.431  3567.93     93.5129  258.962    113.822     77.3651     293.822     
1 1 1 2  1  14 o 8  1121.85 12.2844 22405.7     667.171  22307.8     713.227  918.027    161.608     252.988     161.608     
1 1 1 2  1  15 o 1  1143.15 10.7941 23180.4     618.37   23225.9     618.378  853.186    202.029     90.9864     202.029     
1 1 1 2  1  16 o 6  728.938 6.57168 9448.59     245.244  9396.53     234.798  553.995    324.974     95.4933     324.974     
1 1 1 2  1  17 o 10 159.119 2.34627 445.012     19.1073  452.316     18.2952  90.1393    244.47      353.509     244.47      
1 1 1 2  1  18 o 18 357.418 3.53569 2215.46     63.3162  2313.31     63.3222  152.908    148.536     165.277     328.536     
1 1 1 2  1  19 o 12 368.716 3.61037 2345.29     66.6896  2474.89     66.6987  284.644    28.0931     117.685     28.0931     
1 1 1 2  1  20 o 18 394.277 3.83479 2781.65     72.5169  2729.58     78.8289  331.671    101.286     180.14      101.286     
1 1 1 2  1  21 o 3  68.8878 1.91308 79.1423     6.45585  89.4573     6.72222  91.1219    32.611      208.641     32.611      
1 1 1 2  1  22 o 7  439.169 4.0239  3296.59     86.7871  3543.6      90.3394  233.881    35.8455     127.08      215.846     
1 1 1 2  1  23 o 14 191.178 2.3805  615.64      22.7824  680.545     22.7887  17.0363    77.9275     262.492     77.9275     
1 1 1 2  1  24 o 18 488.18  4.43983 4181.19     106.443  4268.71     110.788  216.958    84.6937     236.526     264.694     
1 1 1 2  1  25 o 6  284.227 2.89892 1430.85     40.5213  1432.44     42.0486  179.536    81.6112     13.3287     81.6112     
1 1 1 2  1  26 o 16 483.463 4.14635 4067.35     100.443  4219.08     100.451  295.307    10.1722     68.8341     190.172     
1 1 1 2  1  27 o 6  373.088 3.52944 2440.5      65.9811  2493.29     65.9931  232.277    269.174     31.2704     89.174      
1 1 1 2  1  28 o 17 620.553 5.28832 6721.92     164.436  6931.16     164.453  348.4      299.018     161.701     119.018     
1 1 1 2  1  29 o 2  165.442 2.18971 485.707     18.4843  484.286     17.8203  36.7609    242.103     101.252     62.1033     
1 1 1 2  1  30 o 10 345.442 3.28849 2121.67     60.0175  2107.6      53.6844  266.286    93.9311     85.7593     93.9311     
1 1 1 2  1  31 o 9  572.45  5.03281 5825.29     152.822  5791.24     135.466  326.133    304.516     135.147     124.516     
1 1 1 2  1  32 o 14 652.615 5.58705 7492.44     189.559  7606.96     175.507  382.969    204.356     134.033     24.3562     
1 1 1 2  1  33 o 7  534.846 4.77426 4997.26     130.446  5143.53     125.342  372.325    96.5184     15.0735     96.5185     
1 1 1 2  1  34 o 19 1351.32 11.114  32348.2     780.976  32485.2     723.064  933.203    223.128     8.41761     43.1278     
1 1 1 2  1  35 o 11 1233.78 10.1685 26715.6     652.115  27316.7     603.78   850.798    58.3236     5.63265     238.324     
1 1 1 2  1  36 o 8  304.207 3.06159 1632.36     48.4244  1647.49     44.8377  246.785    73.3727     122.816     73.3727     
1 1 1 2  1  37 o 12 223.988 2.55055 873.847     29.1393  904.332     28.0862  132.896    203.579     63.4654     203.579     
1 1 1 2  1  38 o 4  972.742 7.70769 16537       375.706  17033.6     375.704  768.218    79.0276     204.834     79.0276     
1 1 1 2  1  39 f 0  1032.68 8.18756 18609.2     423.674  19236.2     423.684  624.249    9.94445     0           0           
1 1 1 2  1  40 o 2  119     2.09275 252.417     12.7154  249.607     12.2326  3.0743     203.447     37.0236     23.4465     
1 1 1 2  1  41 o 6  607.859 4.98359 6444.71     151.792  6657.74     151.802  384.929    276.939     51.648      96.9385     
1 1 1 2  1  42 o 9  281.027 2.80479 1381.17     39.5006  1418.19     39.4963  102.235    140.827     162.141     320.827     
1 1 1 2  1  43 o 14 523.233 4.49503 4865.32     115.662  4842.54     120.019  359.637    349.885     16.5391     349.885     
1 1 1 2  1  44 o 12 201.752 2.4024  718.083     24.2899  724.622     24.2894  52.8358    104.093     151         284.093     
1 1 1 2  1  45 o 6  178.693 2.2738  558.102     20.362   573.716     20.3592  90.3592    281.739     34.1973     101.739     
1 1 1 2  1  46 o 2  444.132 3.83719 3485        85.4046  3509.71     85.4059  335.464    254.783     80.5403     254.783     
1 1 1 2  1  47 o 17 515.769 4.27399 4717.53     112.35   4718.11     108.559  368.456    71.8362     47.8088     71.8362     
1 1 1 2  1  48 o 18 59.7488 2.01643 63.6883     6.0194   63.1344     6.02108  18.8937    107.02      66.1835     107.02      
1 1 1 2  1  49 o 6  291.556 3.0488  1489.77     43.648   1524.4      45.4427  181.012    153.158     17.3017     333.158     
1 1 1 2  1  50 o 16 159.093 2.3953  457.136     18.272   440.215     19.8546  83.1341    1.56814     22.3327     181.568     
1 1 1 2  1  51 o 8  238.582 2.65107 1010.23     34.7187  1007.93     28.3629  204.2      208.729     116.394     208.729     
1 1 1 2  1  52 o 17 362.195 3.67997 2351.19     62.2598  2302.73     70.9508  238.114    157.972     1.53147     157.972     
1 1 1 2  1  53 o 1  160.887 2.21512 456.746     17.858   460.902     17.8617  107.039    128.563     19.5764     128.563     
1 1 1 2  1  54 o 6  197.882 2.41126 696.174     23.4566  692.162     24.3556  102.335    191.748     48.7023     11.7477     
1 1 1 2  1  55 o 13 152.484 2.23584 407.726     17.0766  416.642     17.0928  97.576     300.84      9.41437     300.84      
1 1 1 2  1  56 o 4  264.257 2.95105 1235.72     39.0796  1241.14     39.0819  179.279    293.875     18.8121     293.875     
1 1 1 2  1  57 o 17 385.715 3.80621 2656.18     75.1571  2624.51     71.972   287.909    206.891     75.5502     206.891     
1 1 1 2  1  58 o 1  88.7691 2.20019 134.006     9.73124  145.858     9.80346  26.6137    315.598     40.6313     135.598     
1 1 1 2  1  59 o 5  133.37  2.28355 320.196     15.2351  310.571     15.2866  70.5294    136.452     17.551      316.452     
1 1 1 2  1  60 o 16 132.099 2.3005  302.276     15.51    316.806     14.9086  70.7795    48.761      14.6561     228.761     
1 1 1 2  1  61 o 9  92.8994 2.15667 146.818     10.1368  159.666     9.8916   41.6104    311.507     10.5256     131.507     
1 1 1 2  1  62 o 2  206.355 2.66546 757.228     29.285   753.311     25.7379  153.004    264.005     50.5935     264.005     
1 1 1 2  1  63 o 5  282.912 3.28254 1429.06     43.0969  1412.23     49.7049  178.758    346.451     0.969956    166.451     
1 1 1 2  1  64 o 14 102.926 2.30983 192.023     11.6725  184.172     12.1086  6.62902    258.586     111.04      78.5862     
1 1 1 2  1  65 o 14 244.817 2.86997 1067.16     34.4566  1060.39     35.9448  149.567    291.173     9.18241     111.173     
1 1 1 2  1  66 o 2  338.099 3.40112 2032.3      55.1953  2029.6      59.956   219.485    61.1468     11.4052     61.1468     
1 1 1 2  1  67 o 12 124.017 2.3308  284.984     14.2225  261.322     14.6889  94.7347    124.491     44.877      124.491     
1 1 1 2  1  68 o 9  43.5952 2.98896 30.3484     6.40134  38.0392     6.42379  4.76493    309.83      49.2642     309.83      
1 1 1 2  1  69 o 1  184.186 2.64698 632.137     23.8692  573.767     24.8919  102.32     334.91      23.1883     154.91      
1 1 1 2  1  70 o 19 110.216 2.4561  212.143     12.6102  219.871     14.4541  68.1815    354.51      5.90295     354.51      
1 1 1 2  1  71 o 7  44.8803 3.0455  36.1918     6.48174  36.155      7.03603  0.938729   188.758     42.3367     8.75786     
1 1 1 2  1  72 o 1  63.1932 2.68304 79.1344     8.38241  63.8572     8.44747  20.472     137.237     28.2203     317.237     
1 1 1 2  1  73 o 5  174.798 2.56982 555.039     21.3699  532.232     23.5457  128.257    308.068     44.7036     308.068     
1 1 1 2  1  74 o 1  95.6049 2.47456 171.156     12.0283  154.739     11.6374  47.7027    221.316     17.8041     41.3158     
1 1 1 2  1  75 o 19 19.1098 4.74498 5.24471     5.0229   6.49145     6.22627  20.2587    204.987     56.6573     204.987     
1 1 1 2  1  76 o 15 46.6024 3.24452 40.6961     8.12928  37.7296     6.80799  18.2036    207.152     14.7241     27.1515     
1 1 1 2  1  77 o 10 34.752  3.66471 21.184      6.17081  23.1116     6.19538  12.4806    77.5722     6.42865     257.572     
1 1 1 2  1  78 o 17 17.848  4.67789 6.48191     6.33568  2.78382     4.83139  4.34362    209.657     16.7719     209.657     
1 1 1 2  1  79 o 19 25.3245 4.76202 1.66756     7.17283  20.839      7.15982  3.42908    127.717     7.63551     307.717     
1 1 1 2  1  80 o 10 82.9868 2.92384 131.186     11.7997  116.409     12.3655  35.7633    138.443     26.058      318.443     
1 1 1 2  1  81 o 5  28.1673 5.71551 24.239      9.26458  2.78555     10.2818  5.9417     334.151     1.1353      154.151     
1 1 1 2  1  82 o 10 87.9014 2.79249 134.225     11.6333  143.379     12.9046  45.1166    203.932     12.4709     23.9322     
1 1 1 2  1  83 o 8  18.864  5.2039  8.84282     7.85551  -3.22979    7.49812  8.17572    229.769     33.4009     229.769     
1 1 1 2  1  84 o 15 26.4579 4.61422 25.6636     7.47847  -2.98564    8.23477  5.74147    91.504      14.3611     271.504     
1 1 1 2  1  85 o 4  38.0179 5.00484 31.7381     9.62759  23.8699     8.74537  10.5217    260.87      20.5803     80.8695     
1 1 1 2  1  86 o 5  35.1565 5.64879 21.8029     9.7592   26.913      9.72629  18.0367    226.492     0.58308     226.492     
1 1 1 2  1  87 o 19 34.3318 7.08421 20.5115     12.0876  28.2175     13.8784  5.03962    92.5925     26.6725     272.593     
1 1 1 2  1  88 o 2  28.2256 7.9991  15.7001     14.6537  5.26388     21.1686  10.0416    195.192     1.25489     15.1916     
1 1 1 2  1  89 x 19 ?       ?       ?           ?        ?           ?        40.4842    126.185     0           0           
1 1 1 2  1  90 x 8  ?       ?       ?           ?        ?           ?        21.2921    238.19      0           0           
1 1 1 2  1  91 x 13 ?       ?       ?           ?        ?           ?        5.3803     87.9685     0           0           
1 1 1 2  1  92 x 5  ?       ?       ?           ?        ?           ?        29.3775    313.747     0           0           
1 1 1 2  1  93 x 3  ?       ?       ?           ?        ?           ?        10.3712    130.863     0           0           
1 1 1 2  1  94 x 2  ?       ?       ?           ?        ?           ?        2.18401    251.685     0           0           
1 1 1 2  1  95 x 11 ?       ?       ?           ?        ?           ?        7.38183    39.2267     0           0           
1 1 1 2  1  96 x 6  ?       ?       ?           ?        ?           ?        4.73882    214.698     0           0           
1 1 1 2  1  97 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 2  2  0  o 16 442.691 6.47346 3477.31     143.476  3477.31     143.476  239.59     180         85.3048     180         
1 1 1 2  2  1  o 11 566.659 5.65486 5694.11     160.512  5694.11     160.512  597.365    210         486.72      210         
1 1 1 2  2  2  o 1  132.564 2.42547 312.002     16.0888  312.002     16.0888  69.3812    60          211.512     60          
1 1 1 2  2  3  o 8  45.7589 2.13462 37.5829     4.84545  37.5829     4.84545  88.208     90.0001     182.511     90.0001     
1 1 1 2  2  4  o 5  258.884 2.91067 1188.46     37.7408  1188.46     37.7408  20.3516    120.001     1.71242     120.001     
1 1 1 2  2  5  o 13 1088.31 33.0861 21278.6     1796.9   21278.6     1796.9   760.935    330         41.1351     150         
1 1 1 2  2  6  o 11 104.313 2.12425 193.279     11.0838  193.279     11.0838  99.4243    180         249.599     180         
1 1 1 2  2  7  o 12 1127.8  16.9521 22617       957.14   22617       957.14   908.331    30          198.012     30          
1 1 1 2  2  8  o 13 288.784 3.10473 1478.75     44.9088  1478.75     44.9088  124.531    60          662.794     60          
1 1 1 2  2  9  o 16 848.86  8.15112 12780.6     346.604  12780.6     346.604  890.639    270         564.058     270         
1 1 1 2  2  10 o 1  648.87  6.07328 7465.92     197.411  7465.92     197.411  447.874    120         34.2122     300         
1 1 1 2  2  11 o 13 310.182 3.16292 1705.89     49.143   1705.89     49.143   78.4988    330         45.8395     330         
1 1 1 2  2  12 o 13 356.034 3.54219 2247.51     63.1728  2247.51     63.1728  264.588    360         169.346     360         
1 1 1 2  2  13 o 4  1087.94 10.282  21001.4     560.365  21001.4     560.365  872.404    30          188.537     30          
1 1 1 2  2  14 o 13 368.907 3.58273 2412.94     66.2076  2412.94     66.2076  42.3888    240         612.085     240         
1 1 1 2  2  15 o 17 96.3534 1.98683 164.919     9.57529  164.919     9.57529  103.874    270         264.612     270         
1 1 1 2  2  16 o 6  275.91  3.07347 1349.94     42.473   1349.94     42.473   174.171    300         55.9503     300         
1 1 1 2  2  17 o 2  130.59  2.30383 302.742     15.056   302.742     15.056   3.68543    150         17.6974     150         
1 1 1 2  2  18 o 13 49.3539 2.09932 43.6269     5.14886  43.6269     5.14886  83.7621    3.87621e-05 177.702     3.87621e-05 
1 1 1 2  2  19 o 17 233.365 2.93714 965.945     34.325   965.945     34.325   104.348    210         91.274      30          
1 1 1 2  2  20 o 5  31.8627 2.13288 18.4679     3.33137  18.4679     3.33137  166.531    60          341.534     60          
1 1 1 2  2  21 o 4  50.0825 2.17798 44.947      5.41851  44.947      5.41851  94.6838    270         202.826     270         
1 1 1 2  2  22 o 7  88.5811 2.32627 139.612     10.2943  139.612     10.2943  58.6637    120         156.053     120         
1 1 1 2  2  23 o 7  115.255 2.27223 235.926     13.1011  235.926     13.1011  63.3403    150         229.348     150         
1 1 1 2  2  24 o 15 513.523 4.91018 4676.4      126.31   4676.4      126.31   497.781    180         269.306     180         
1 1 1 2  2  25 o 10 140.976 2.35073 352.741     16.5868  352.741     16.5868  8.04433    29.9999     40.9053     210         
1 1 1 2  2  26 o 16 523.84  4.81201 4865.58     126.276  4865.58     126.276  451.8      60          164.691     60          
1 1 1 2  2  27 o 19 564.608 5.13122 5652.31     145.133  5652.31     145.133  392.046    90          11.158      270         
1 1 1 2  2  28 o 15 619.034 5.80828 6795.03     180.115  6795.03     180.115  588.805    300         307.025     300         
1 1 1 2  2  29 o 11 410.548 4.14501 2988.57     85.2413  2988.57     85.2413  314.852    330         53.2477     330         
1 1 1 2  2  30 o 14 242.724 2.78002 1044.73     33.7959  1044.73     33.7959  186.554    180         50.2685     180         
1 1 1 2  2  31 o 12 107.576 2.40281 205.665     12.9244  205.665     12.9244  10.015     30.0001     84.5687     30.0001     
1 1 1 2  2  32 o 18 558.136 5.30873 5523.57     148.427  5523.57     148.427  330.303    60          119.147     240         
1 1 1 2  2  33 o 9  1323.6  11.7782 31087.7     780.982  31087.7     780.982  980.14     90          114.447     90          
1 1 1 2  2  34 o 6  731.808 6.40692 9496.21     234.886  9496.21     234.886  493.107    300         32.4464     120         
1 1 1 2  2  35 o 18 470.941 4.29114 3932.15     101.236  3932.15     101.236  221.661    330         210.969     150         
1 1 1 2  2  36 o 10 59.5469 2.10006 63.2952     6.23116  63.2952     6.23116  38.8307    180         93.0461     180         
1 1 1 2  2  37 o 19 646.745 5.46805 7416.26     177.168  7416.26     177.168  336.857    210         221.255     30          
1 1 1 2  2  38 o 7  939.907 7.74875 15668.1     364.875  15668.1     364.875  685.003    240         72.0502     240         
1 1 1 2  2  39 o 1  30.5406 2.66354 17.2669     3.91028  17.2669     3.91028  32.0384    90          66.418      90          
1 1 1 2  2  40 o 7  189.588 2.41336 637.509     22.9126  637.509     22.9126  8.91806    299.999     4.26265     299.999     
1 1 1 2  2  41 o 9  764.179 6.31759 10356.4     241.865  10356.4     241.865  668.067    150         287.736     150         
1 1 1 2  2  42 o 6  36.216  2.47108 23.8834     4.38267  23.8834     4.38267  47.76      180         103.055     180         
1 1 1 2  2  43 o 2  106.051 2.18108 199.793     11.5695  199.793     11.5695  10.3233    210         20.1772     29.9999     
1 1 1 2  2  44 o 19 483.398 4.42835 4143.86     107.237  4143.86     107.237  273.503    240         111.522     60          
1 1 1 2  2  45 o 2  638.714 5.14618 7235.05     164.674  7235.05     164.674  500.245    90          132.514     90          
1 1 1 2  2  46 o 7  536.651 4.41895 5107.15     118.806  5107.15     118.806  455.59     120         183.733     120         
1 1 1 2  2  47 o 5  517.87  4.29523 4756.1      111.438  4756.1      111.438  415.547    330         130.907     330         
1 1 1 2  2  48 o 5  64.5947 2.19479 74.4496     7.06723  74.4496     7.06723  10.3607    180         48.4382     180         
1 1 1 2  2  49 o 2  17.6655 4.8228  7.54522     4.04916  7.54522     4.04916  44.1596    210         90.9817     210         
1 1 1 2  2  50 o 10 121.818 2.50286 263.656     15.2503  263.656     15.2503  64.7326    240         7.97847     240         
1 1 1 2  2  51 o 16 608.15  5.50074 6563.85     167.584  6563.85     167.584  440.068    90          66.7468     90          
1 1 1 2  2  52 o 10 271.662 3.40942 1309.46     46.3833  1309.46     46.3833  128.017    300         106.276     120         
1 1 1 2  2  53 o 14 47.6049 2.35947 40.7515     5.56428  40.7515     5.56428  10.2438    330         37.9603     330         
1 1 1 2  2  54 o 2  297.057 3.35729 1565.53     49.9505  1565.53     49.9505  214.264    1.33712e-07 34.6633     1.33712e-07 
1 1 1 2  2  55 o 11 322.869 3.19885 1849.05     51.7355  1849.05     51.7355  233.338    210         39.8752     210         
1 1 1 2  2  56 o 17 702.947 5.68838 8773.79     200.329  8773.79     200.329  414.488    60          97.4026     240         
1 1 1 2  2  57 o 8  96.9501 2.07098 167.033     10.0412  167.033     10.0412  18.3724    90          89.1171     270         
1 1 1 2  2  58 o 9  15.7304 4.70426 6.21405     3.74824  6.21405     3.74824  13.1383    120         27.4278     120         
1 1 1 2  2  59 o 3  23.4236 3.86431 11.1743     3.94357  11.1743     3.94357  30.6812    150         68.0182     150         
1 1 1 2  2  60 o 10 329.436 3.02582 1925.04     49.9354  1925.04     49.9354  244.877    180         61.1394     180         
1 1 1 2  2  61 o 3  63.6845 2.58841 72.6021     8.19794  72.6021     8.19794  16.9131    30          110.323     30          
1 1 1 2  2  62 o 6  62.0104 2.2439  68.6903     6.93125  68.6903     6.93125  4.02737    60          55.1758     240         
1 1 1 2  2  63 o 15 32.0902 3.47024 19.4962     5.19372  19.4962     5.19372  25.1886    270         67.102      270         
1 1 1 2  2  64 o 14 333.359 3.42889 1972.43     57.2558  1972.43     57.2558  285.925    300         144.034     300         
1 1 1 2  2  65 o 19 199.356 2.50749 705.305     25.0333  705.305     25.0333  111.608    150         31.7162     330         
1 1 1 2  2  66 o 3  63.646  2.45386 72.4629     7.77322  72.4629     7.77322  23.7625    180         27.3223     360         
1 1 1 2  2  67 o 5  50.798  2.88008 46.6484     7.22006  46.6484     7.22006  43.033     210         150.132     210         
1 1 1 2  2  68 o 14 256.409 3.21475 1167.92     41.2794  1167.92     41.2794  156.607    240         11.0803     60          
1 1 1 2  2  69 o 17 156.426 2.92797 435.142     22.9165  435.142     22.9165  111.808    90          26.522      90          
1 1 1 2  2  70 o 18 33.4774 4.87997 22.286      7.22992  22.286      7.22992  20.4579    120         76.6337     120         
1 1 1 2  2  71 o 18 173.735 2.96196 536.889     25.7547  536.889     25.7547  95.425     330         26.3642     150         
1 1 1 2  2  72 o 1  10.7986 4.86182 0.556611    5.78705  0.556611    5.78705  25.1785    360         53.2648     360         
1 1 1 2  2  73 o 17 17.184  6.08459 7.78038     6.40953  7.78038     6.40953  15.2016    210         36.2018     210         
1 1 1 2  2  74 o 19 14.9887 5.82032 5.61389     6.29483  5.61389     6.29483  15.1487    240         36.0009     240         
1 1 1 2  2  75 o 19 41.6005 4.40136 32.8563     8.57088  32.8563     8.57088  20.6814    270         8.66977     270         
1 1 1 2  2  76 o 5  9.31919 4.41574 -2.12847    5.75579  -2.12847    5.75579  16.8743    120         37.2726     120         
1 1 1 2  2  77 o 10 10.0775 4.7401  -1.8247     6.42341  -1.8247     6.42341  7.30535    330         16.635      330         
1 1 1 2  2  78 f 0  27.6433 6.6467  17.7959     8.25138  17.7959     8.25138  11.0025    180         0           0           
1 1 1 2  2  79 o 19 9.41822 4.52461 -3.41477    6.45749  -3.41477    6.45749  6.53854    30          14.8431     30          
1 1 1 2  2  80 o 17 27.5723 6.73267 17.8713     8.38015  17.8713     8.38015  4.52736    60          20.4636     240         
1 1 1 2  2  81 o 8  51.848  4.07024 49.8847     10.2428  49.8847     10.2428  29.7368    90          2.61861     270         
1 1 1 2  2  82 o 17 18.6608 7.03988 9.25519     8.95431  9.25519     8.95431  9.85898    120         38.5813     120         
1 1 1 2  2  83 o 7  48.9495 4.37636 45.0596     10.2692  45.0596     10.2692  38.6412    150         19.8085     150         
1 1 1 2  2  84 o 16 32.7313 5.41827 22.2168     7.72416  22.2168     7.72416  20.6127    360         6.79676     360         
1 1 1 2  2  85 o 11 81.8404 3.79222 121.958     15.3979  121.958     15.3979  58.4419    30          20.5552     30          
1 1 1 2  2  86 o 3  17.6366 7.10287 7.88727     9.8044   7.88727     9.8044   1.49615    59.9999     18.7774     60          
1 1 1 2  2  87 o 14 24.233  9.06947 16.959      14.7621  16.959      14.7621  4.90855    90          37.6118     90          
1 1 1 2  2  88 o 15 19.5659 8.58947 7.14922     16.8642  7.14922     16.8642  0.661002   120         15.1606     300         
1 1 1 2  2  89 x 17 ?       ?       ?           ?        ?           ?        47.7305    330         0           0           
1 1 1 2  2  90 x 7  ?       ?       ?           ?        ?           ?        17.1322    1.09212e-05 0           0           
1 1 1 2  2  91 x 9  ?       ?       ?           ?        ?           ?        15.6566    210         0           0           
1 1 1 2  2  92 x 13 ?       ?       ?           ?        ?           ?        39.9394    60          0           0           
1 1 1 2  2  93 x 10 ?       ?       ?           ?        ?           ?        20.6904    270         0           0           
1 1 1 2  2  94 x 18 ?       ?       ?           ?        ?           ?        1.30025    119.999     0           0           
1 1 1 2  2  95 x 5  ?       ?       ?           ?        ?           ?        5.00731    150         0           0           
1 1 1 2  2  96 x 8  ?       ?       ?           ?        ?           ?        0.778015   360         0           0           
1 1 1 2  2  97 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 3  0  0  o 3  449.927 5.02035 3589.77     113.134  3589.77     113.134  217.679    180         179.912     1.51191e-05 
1 1 1 3  0  1  o 5  412.833 3.55471 3021.34     73.518   3021.34     73.518   320.921    59.9999     214.811     59.9999     
1 1 1 3  0  2  o 2  300.508 3.05745 1601.14     46.0228  1601.14     46.0228  135.254    300         131.925     120         
1 1 1 3  0  3  o 14 257.431 2.87442 1175.14     37.0619  1175.14     37.0619  92.6546    180         111.875     1.7114e-05  
1 1 1 3  0  4  o 15 325.972 2.91279 1883.7      47.5657  1883.7      47.5657  0.619525   240.001     465.553     60          
1 1 1 3  0  5  o 18 831.115 8.87066 12254.6     369.279  12254.6     369.279  680.419    300         167.334     300         
1 1 1 3  0  6  x 13 ?       ?       ?           ?        ?           ?        1090.62    360         0           0           
1 1 1 3  0  7  o 9  110.935 2.07592 218.513     11.5226  218.513     11.5226  147.837    60          378.519     60          
1 1 1 3  0  8  o 11 1040.55 31.6815 19438.6     1645.09  19438.6     1645.09  968.026    300         443.402     300         
1 1 1 3  0  9  o 8  946.122 10.833  15887.1     513.334  15887.1     513.334  648.44     5.07641e-06 59.6743     180         
1 1 1 3  0  10 x 19 ?       ?       ?           ?        ?           ?        818.307    60          0           0           
1 1 1 3  0  11 o 17 906.393 7.91584 14569.9     359.439  14569.9     359.439  746.023    300         193.89      300         
1 1 1 3  0  12 o 17 675.956 6.0007  8101.79     203.201  8101.79     203.201  344.264    180         278.977     8.55419e-06 
1 1 1 3  0  13 o 1  247.626 2.81156 1087.36     34.87    1087.36     34.87    83.8979    240         156.943     60          
1 1 1 3  0  14 o 19 535.216 4.84842 5078.97     129.996  5078.97     129.996  511.983    300         260.027     300         
1 1 1 3  0  15 o 3  613.316 5.71077 6670.24     175.457  6670.24     175.457  625.652    1.16217e-05 375.751     1.16217e-05 
1 1 1 3  0  16 o 8  390.959 3.91301 2710.23     76.6314  2710.23     76.6314  217.92     60          121.498     240         
1 1 1 3  0  17 o 14 402.456 4.06309 2872.09     81.9099  2872.09     81.9099  241.222    300         90.9095     120         
1 1 1 3  0  18 o 2  472.82  4.55294 3964.25     107.837  3964.25     107.837  268.275    180         136.835     7.35489e-06 
1 1 1 3  0  19 o 9  108.623 2.06819 209.52      11.2398  209.52      11.2398  47.1016    240         145.387     240         
1 1 1 3  0  20 o 15 252.492 2.82244 1130.54     35.6934  1130.54     35.6934  144.872    120         48.7602     120         
1 1 1 3  0  21 o 16 298.218 3.1325  1577.02     46.7918  1577.02     46.7918  93.3217    360         64.9173     360         
1 1 1 3  0  22 o 7  53.2151 1.85917 50.544      4.93035  50.544      4.93035  86.9146    60          188.52      60          
1 1 1 3  0  23 o 3  486.729 4.19639 4200.46     102.324  4200.46     102.324  384.929    120         80.5881     120         
1 1 1 3  0  24 o 1  166.8   2.19125 493.498     18.3025  493.498     18.3025  31.9582    360         34.7595     180         
1 1 1 3  0  25 o 15 85.098  1.82366 128.666     7.76103  128.666     7.76103  7.82927    59.9999     21.5752     59.9999     
1 1 1 3  0  26 o 15 636.789 5.28051 7189.73     168.46   7189.73     168.46   581.45     300         264.76      300         
1 1 1 3  0  27 o 19 418.136 3.71523 3099.64     77.8232  3099.64     77.8232  340.641    180         92.4669     180         
1 1 1 3  0  28 o 18 487.052 4.0186  4205.34     98.0568  4205.34     98.0568  436.59     240         188.286     240         
1 1 1 3  0  29 o 6  277.724 2.70108 1367.46     37.5774  1367.46     37.5774  196.515    120         6.07685     120         
1 1 1 3  0  30 o 19 265.693 2.62899 1251.56     34.9895  1251.56     34.9895  220.755    360         82.2799     360         
1 1 1 3  0  31 o 6  561.203 4.55234 5583.29     127.993  5583.29     127.993  202.003    60          381.316     240         
1 1 1 3  0  32 o 15 573.02  4.8072  5821.18     138.002  5821.18     138.002  378.085    120         44.2927     300         
1 1 1 3  0  33 o 10 463.648 4.02987 3811.03     93.6035  3811.03     93.6035  424.468    360         202.423     360         
1 1 1 3  0  34 o 17 355.39  3.17011 2239.07     56.4398  2239.07     56.4398  346.653    60          199.885     60          
1 1 1 3  0  35 o 19 1523.52 12.0246 41189.2     917.82   41189.2     917.82   1155.98    300         195.499     300         
1 1 1 3  0  36 o 4  1233.31 9.73868 26981.8     601.745  26981.8     601.745  968.599    360         227.258     360         
1 1 1 3  0  37 o 13 201.633 2.34347 720.962     23.6656  720.962     23.6656  80.2543    59.9999     39.0281     59.9999     
1 1 1 3  0  38 o 1  303.634 2.9675  1634.57     45.1351  1634.57     45.1351  114.497    120         190.222     300         
1 1 1 3  0  39 o 7  700.681 5.55149 8704.81     194.88   8704.81     194.88   456.577    180         52.2892     8.36909e-06 
1 1 1 3  0  40 o 7  162.771 2.20808 469.973     17.9967  469.973     17.9967  64.2632    240         22.6379     60          
1 1 1 3  0  41 o 14 633.041 5.17888 7105.64     164.247  7105.64     164.247  521.149    120         173.902     120         
1 1 1 3  0  42 o 17 61.1964 2.06999 66.8127     6.31501  66.8127     6.31501  35.6341    180         92.6687     180         
1 1 1 3  0  43 o 10 281.928 2.92724 1409.4      41.3376  1409.4      41.3376  212.794    60          40.7916     60          
1 1 1 3  0  44 o 13 22.5634 3.56354 10.2601     3.51945  10.2601     3.51945  31.6526    120         65.568      120         
1 1 1 3  0  45 o 11 242.508 2.71578 1042.94     32.9864  1042.94     32.9864  178.55     360         27.864      360         
1 1 1 3  0  46 o 4  191.454 2.29651 650.09      22.0197  650.09      22.0197  79.8651    60          99.605      240         
1 1 1 3  0  47 o 2  96.6045 2.02872 165.807     9.80192  165.807     9.80192  1.87576    120         122.789     120         
1 1 1 3  0  48 o 14 385.458 3.44177 2634.69     66.4605  2634.69     66.4605  251.969    1.62188e-06 15.8008     180         
1 1 1 3  0  49 o 2  309.099 3.10498 1694.38     48.075   1694.38     48.075   250.544    60          85.4261     60          
1 1 1 3  0  50 o 14 478.462 4.1973  4060.55     100.607  4060.55     100.607  319.456    300         2.74496     120         
1 1 1 3  0  51 o 18 396.833 4.45099 2794.39     88.4664  2794.39     88.4664  305.285    180         79.8678     180         
1 1 1 3  0  52 o 14 66.2119 2.30216 78.2549     7.5966   78.2549     7.5966   0.158482   60          14.7539     240         
1 1 1 3  0  53 o 7  493.469 4.68403 4321.01     115.788  4321.01     115.788  391.835    300         127.515     300         
1 1 1 3  0  54 o 18 452.738 3.92629 3635.97     89.0519  3635.97     89.0519  358.327    4.54138e-07 116.436     4.54138e-07 
1 1 1 3  0  55 o 1  241.138 2.78235 1031.48     33.6029  1031.48     33.6029  91.7879    240         135.152     60          
1 1 1 3  0  56 o 17 266.613 2.94343 1260.95     39.3059  1260.95     39.3059  202.573    120         53.8255     120         
1 1 1 3  0  57 o 9  172.589 2.54345 528.649     21.9772  528.649     21.9772  107.445    1.47175e-07 11.8054     180         
1 1 1 3  0  58 o 2  100.005 2.26151 177.795     11.3077  177.795     11.3077  50.6419    240         23.2183     60          
1 1 1 3  0  59 o 12 60.3998 2.33158 65.2356     7.00902  65.2356     7.00902  3.46741    300         32.2925     120         
1 1 1 3  0  60 o 4  112.787 2.20281 225.976     12.4293  225.976     12.4293  39.4958    4.722e-06   67.146      180         
1 1 1 3  0  61 o 2  33.3594 3.19831 20.79       5.06971  20.79       5.06971  58.0095    60          144.375     60          
1 1 1 3  0  62 o 1  33.9251 3.1903  21.4621     5.15614  21.4621     5.15614  3.67331    300         10.1091     300         
1 1 1 3  0  63 o 11 48.2979 2.63665 42.088      6.29196  42.088      6.29196  0.611762   180         10.6467     180         
1 1 1 3  0  64 o 2  130.666 2.20219 303.164     14.4019  303.164     14.4019  50.267     60          67.1341     240         
1 1 1 3  0  65 o 1  12.746  4.86242 4.09058     4.31521  4.09058     4.31521  13.0975    300         27.4979     300         
1 1 1 3  0  66 o 1  208.627 2.62083 772.545     27.3816  772.545     27.3816  169.544    180         73.2928     180         
1 1 1 3  0  67 f 0  179.383 2.35931 571.174     21.1928  571.174     21.1928  168.702    60          0           0           
1 1 1 3  0  68 o 5  91.7911 2.14479 149.882     9.84169  149.882     9.84169  66.3074    300         18.1842     300         
1 1 1 3  0  69 o 7  90.6258 2.34031 146.245     10.5966  146.245     10.5966  47.7346    180         18.552      8.62966e-06 
1 1 1 3  0  70 o 9  75.6861 2.27892 102.157     8.6081   102.157     8.6081   17.8241    240         59.2601     60          
1 1 1 3  0  71 o 10 27.6053 4.18936 15.2681     5.08809  15.2681     5.08809  30.3636    120         88.8026     120         
1 1 1 3  0  72 o 3  137.243 2.10891 334.616     14.4892  334.616     14.4892  92.0677    180         13.2407     180         
1 1 1 3  0  73 o 5  54.199  2.53195 52.8275     6.80727  52.8275     6.80727  22.3316    60          7.28967     60          
1 1 1 3  0  74 o 14 25.5153 5.89654 14.8104     6.67913  14.8104     6.67913  0.832053   120         4.8885      120         
1 1 1 3  0  75 o 4  101.307 2.60051 183.033     13.163   183.033     13.163   79.6538    9.12383e-06 34.689      9.12383e-06 
1 1 1 3  0  76 o 16 87.7002 2.73172 137.512     11.9528  137.512     11.9528  44.8781    240         17.6761     60          
1 1 1 3  0  77 o 19 114.754 2.40747 234.608     13.8173  234.608     13.8173  66.9441    300         6.09163     120         
1 1 1 3  0  78 o 3  11.0406 5.00957 0.307636    6.29234  0.307636    6.29234  9.74846    360         23.0745     360         
1 1 1 3  0  79 o 5  7.94777 3.97645 -8.08263    6.50179  -8.08263    6.50179  0.780896   240         1.7025      240         
1 1 1 3  0  80 o 17 10.2515 4.84493 -2.23811    6.84966  -2.23811    6.84966  0.493529   120         1.16622     120         
1 1 1 3  0  81 o 11 97.2374 3.2634  169.888     15.8205  169.888     15.8205  62.2571    180         7.95537     180         
1 1 1 3  0  82 o 1  24.9628 6.28389 14.8278     7.16353  14.8278     7.16353  7.47034    60          43.8861     60          
1 1 1 3  0  83 o 8  15.1955 6.48302 4.38598     9.00755  4.38598     9.00755  7.14562    120         25.7775     120         
1 1 1 3  0  84 o 15 17.7591 7.24731 7.60465     10.4052  7.60465     10.4052  5.83103    180         29.55       180         
1 1 1 3  0  85 o 19 130.507 3.34224 306.462     21.7939  306.462     21.7939  73.2173    60          7.16014     240         
1 1 1 3  0  86 o 10 74.6551 3.83194 101.95      14.1592  101.95      14.1592  18.6616    120         50.1247     300         
1 1 1 3  0  87 o 14 19.0141 7.8491  8.95041     12.4284  8.95041     12.4284  0.947948   360         2.07012     180         
1 1 1 3  0  88 o 8  21.7388 9.35769 10.8352     19.1226  10.8352     19.1226  0.432557   240         21.3725     60          
1 1 1 3  0  89 x 4  ?       ?       ?           ?        ?           ?        1.6833     120         0           0           
1 1 1 3  0  90 x 1  ?       ?       ?           ?        ?           ?        41.687     360         0           0           
1 1 1 3  0  91 x 19 ?       ?       ?           ?        ?           ?        3.76725    240         0           0           
1 1 1 3  0  92 x 5  ?       ?       ?           ?        ?           ?        29.0524    120         0           0           
1 1 1 3  0  93 x 0  ?       ?       ?           ?        ?           ?        19.7355    1.86486e-05 0           0           
1 1 1 3  0  94 x 3  ?       ?       ?           ?        ?           ?        3.85491    240         0           0           
1 1 1 3  0  95 x 9  ?       ?       ?           ?        ?           ?        14.5604    120         0           0           
1 1 1 3  0  96 x 6  ?       ?       ?           ?        ?           ?        4.33166    2.76606e-11 0           0           
1 1 1 3  0  97 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 3  1  0  o 16 444.931 4.41131 3510.12     98.3168  3510.12     98.3168  421.138    180         255.986     180         
1 1 1 3  1  1  o 1  584.19  5.72776 6010.27     179.17   6089.58     155.18   388.048    291.295     21.3052     111.295     
1 1 1 3  1  2  o 8  595.889 6.09017 6148.34     167.163  6443.44     196.025  545.319    273.855     308.509     273.855     
1 1 1 3  1  3  o 18 455.101 4.60773 3689.51     107.573  3652.36     102.568  170.763    92.0209     273.936     272.021     
1 1 1 3  1  4  o 9  398.685 3.75984 2881.46     73.5577  2753.06     76.5562  122.348    336.896     286.36      156.896     
1 1 1 3  1  5  o 17 870.034 9.37407 13302       382.535  13559       433.752  605.832    201.691     11.4381     21.6906     
1 1 1 3  1  6  o 19 1173.93 50.6058 24945.8     2100.23  0           0        788.372    182.137     89.1016     2.13686     
1 1 1 3  1  7  o 14 1047.3  27.9605 20272.2     1188.36  19125.9     1680.83  792.654    32.2255     105.522     32.2255     
1 1 1 3  1  8  o 12 560.496 4.82359 5569.64     132.952  5566.83     137.977  518.765    156.281     310.826     156.281     
1 1 1 3  1  9  o 13 718.866 6.13585 9183.1      212.348  9139.83     229.374  393.052    178.537     220.193     358.537     
1 1 1 3  1  10 o 12 479.146 4.24232 4218.11     101.822  3922.29     101.811  382.191    276.884     141.132     276.884     
1 1 1 3  1  11 o 4  355.571 3.40702 2247.37     60.7098  2233.67     60.7101  11.2093    3.44368     455.619     183.444     
1 1 1 3  1  12 o 5  714.993 6.45562 9048.88     236.278  9078.81     226.221  448.748    168.935     100.665     348.935     
1 1 1 3  1  13 o 10 952.698 8.46517 16165.1     395.239  16037.4     412.811  684.345    216.218     26.3166     216.218     
1 1 1 3  1  14 o 4  540.858 5.00502 5177.78     132.679  5192.94     138.583  316.17     336.006     109.738     156.006     
1 1 1 3  1  15 o 7  1006.02 9.32199 18096.2     458.554  17828.8     480.939  756.562    29.2977     95.3644     29.2977     
1 1 1 3  1  16 o 13 869.51  7.90664 13470.7     344.528  13356.5     344.527  646.291    144.738     73.0943     144.738     
1 1 1 3  1  17 o 2  456.503 4.44041 3749.59     101.578  3638.94     101.574  404.223    4.90489     228.935     4.90489     
1 1 1 3  1  18 o 2  267.591 2.99849 1243.22     41.9509  1295.05     38.2991  49.0221    150.702     449.814     150.702     
1 1 1 3  1  19 o 4  546.986 5.07792 5267.49     142.16   5342.89     136.115  369.81     232.634     9.50677     52.6339     
1 1 1 3  1  20 o 14 562.324 5.20803 5687.21     149.957  5527.85     143.571  477.435    18.5332     193.225     18.5332     
1 1 1 3  1  21 o 5  177.944 2.43525 562.041     21.2375  560.214     22.1833  13.1781    196.031     9.52296     16.031      
1 1 1 3  1  22 o 7  106.315 2.07363 187.242     11.0144  214.094     11.0236  40.1242    218.002     131.158     218.002     
1 1 1 3  1  23 o 10 286.776 3.11674 1446.37     43.8116  1468.77     45.7649  198.205    323.967     91.6042     323.967     
1 1 1 3  1  24 o 16 505.455 4.64479 4441.99     117.633  4617.32     117.643  351.889    268.498     15.1124     268.498     
1 1 1 3  1  25 o 19 355.317 3.46708 2226.42     62.951   2248.65     60.4835  217.175    145.567     33.4043     325.567     
1 1 1 3  1  26 o 19 383.535 3.66002 2578.1      68.9348  2636.09     71.7571  228.927    190.698     54.8821     10.6983     
1 1 1 3  1  27 o 18 661.052 5.6461  7674.01     187.036  7820.26     187.041  466.446    351.505     18.3669     351.505     
1 1 1 3  1  28 o 4  1032.73 8.39083 18629       426.218  19209.5     442.329  817.211    127.919     193.15      127.919     
1 1 1 3  1  29 o 12 220.258 2.48119 837.428     26.8764  882.149     27.9017  84.5169    0.47497     102         180.475     
1 1 1 3  1  30 o 11 52.3812 1.87663 45.6418     4.91427  51.9445     4.88822  84.1776    203.436     189.776     203.436     
1 1 1 3  1  31 o 19 599.038 5.06284 6275.09     149.17   6446.2      154.809  437.264    96.0096     52.1908     96.0096     
1 1 1 3  1  32 o 16 183.343 2.25176 607.841     20.2865  583.542     21.0626  64.9182    5.44964     22.719      5.44964     
1 1 1 3  1  33 o 7  1559.39 12.8036 42602.5     1000.48  43785.3     1000.52  1053.76    268.42      62.1076     88.4201     
1 1 1 3  1  34 o 8  881.259 7.26838 13644.9     320.981  13899       320.993  568.453    124.866     81.4382     304.866     
1 1 1 3  1  35 o 2  713.112 6.15163 8849.1      224.068  9183.79     215.307  462.093    177.64      55.5222     357.64      
1 1 1 3  1  36 o 5  253.25  2.87782 1126.75     37.9876  1146.33     34.9693  178.954    38.3319     65.5434     38.3319     
1 1 1 3  1  37 o 19 697.647 6.16321 8518.63     215.456  8741.2      215.474  533.496    54.0563     116.636     54.0563     
1 1 1 3  1  38 o 8  451.489 4.02201 3485.95     90.9387  3741.98     90.9808  388.967    300.315     187.661     300.315     
1 1 1 3  1  39 o 11 274.579 2.97838 1374.9      40.9777  1297.81     40.9637  203.047    178.755     121.516     178.755     
1 1 1 3  1  40 o 7  300.987 3.0099  1581.83     45.3882  1629.31     45.4057  227.771    66.1125     84.7554     66.1125     
1 1 1 3  1  41 o 12 622.064 5.27578 6856.75     164.464  6865.78     164.473  550.471    309.366     265.685     309.366     
1 1 1 3  1  42 o 7  460.713 4.01898 3770.99     94.4358  3754.18     91.1237  367.361    29.6166     122.527     29.6166     
1 1 1 3  1  43 o 2  986.005 7.87187 16907.4     395.855  17619.8     381.533  733.417    225.878     126.644     225.878     
1 1 1 3  1  44 o 16 330.049 3.05008 1922.73     50.4564  1938.8      50.4403  234.077    24.7168     36.4751     24.7169     
1 1 1 3  1  45 o 6  313.516 2.99034 1730.71     46.1196  1753.76     47.8407  164.569    167.282     84.0565     347.282     
1 1 1 3  1  46 f 0  53.5263 2.13458 52.73       5.63563  49.1732     5.75897  114.505    338.761     0           0           
1 1 1 3  1  47 o 15 339.904 3.26335 2030.67     53.3329  2065.87     57.7886  227.769    207.238     7.7726      207.238     
1 1 1 3  1  48 o 15 381.712 3.77197 2606.73     70.2739  2560.98     73.9515  216.894    144.22      72.1806     324.22      
1 1 1 3  1  49 o 10 389.294 4.8403  2654.21     105.395  2724.76     81.6299  262.652    331.269     11.6825     331.269     
1 1 1 3  1  50 o 3  204.374 3.18706 749.659     27.3509  732.074     37.0496  72.713     152.919     115.501     332.919     
1 1 1 3  1  51 o 12 383.689 4.08509 2594.39     85.924   2629.23     70.2824  253.159    298.195     1.91227     298.195     
1 1 1 3  1  52 o 17 290.047 3.5108  1459.26     48.0919  1525.28     53.9138  212.206    258.417     49.1804     258.417     
1 1 1 3  1  53 o 15 257.519 3.06286 1131.34     41.295   1221.45     37.4771  209.856    118.692     90.3885     118.692     
1 1 1 3  1  54 o 1  226.437 2.57802 889.945     29.2092  928.353     29.292   168.742    225.526     48.5239     225.526     
1 1 1 3  1  55 o 7  299.353 3.15904 1611.21     46.3245  1567.65     48.4     156.923    52.4162     76.1082     232.416     
1 1 1 3  1  56 o 10 611.02  5.29571 6651.18     152.091  6618.88     171.584  436.109    247.499     70.6525     247.499     
1 1 1 3  1  57 o 19 76.5814 2.11476 107.431     7.81658  100.866     8.35182  6.06898    173.096     0.837852    353.096     
1 1 1 3  1  58 o 19 19.1594 3.79894 7.11879     3.62249  6.22586     3.99033  86.7736    315.119     184.09      315.119     
1 1 1 3  1  59 o 15 112.171 2.26922 217.937     11.7209  228.653     13.7281  23.9536    170.192     86.2588     350.192     
1 1 1 3  1  60 o 2  344.327 3.19187 2150.04     53.97    2057.46     56.0979  250.786    270.233     60.1957     270.233     
1 1 1 3  1  61 o 14 114.256 2.25264 229.301     11.7941  233.998     13.9099  46.363     321.725     41.1728     141.725     
1 1 1 3  1  62 o 19 119.185 2.37059 239.96      13.3871  264.534     14.9111  80.7335    337.367     34.4065     337.367     
1 1 1 3  1  63 o 13 78.1682 2.20657 111.899     8.5366   105.198     8.7039   30.5063    147.665     8.47858     327.665     
1 1 1 3  1  64 o 2  319.731 3.18909 1797.71     50.3655  1831.96     51.8321  239.974    90.416      74.8484     90.416      
1 1 1 3  1  65 o 4  109.597 2.31884 218.367     13.1916  208.203     12.2511  58.6437    103.161     12.4313     283.161     
1 1 1 3  1  66 o 14 164.318 2.35204 457.911     19.0529  500.652     19.6773  99.5164    252.033     4.02671     72.0328     
1 1 1 3  1  67 o 3  84.6409 2.45675 120.167     9.92287  134.774     10.8817  3.52576    252.081     94.0161     72.0815     
1 1 1 3  1  68 o 7  168.644 2.50096 519.93      21.0557  490.154     21.1993  100.452    66.1743     7.10898     246.174     
1 1 1 3  1  69 o 16 90.3085 2.50246 135.784     10.4917  154.642     12.1267  30.857     88.7397     45.0792     268.74      
1 1 1 3  1  70 o 17 112.637 2.23337 206.017     12.0012  245.76      13.1906  59.8389    125.801     15.3621     305.801     
1 1 1 3  1  71 o 4  72.4978 2.84719 95.4274     11.2558  92.1557     9.28492  31.3016    131.659     18.6358     311.659     
1 1 1 3  1  72 o 10 119.101 2.50187 258.753     14.8988  246.213     14.9258  74.319     23.9396     6.78832     23.9396     
1 1 1 3  1  73 o 3  90.7179 2.6816  148.918     12.8659  144.552     11.4389  46.131     130.108     13.4268     310.108     
1 1 1 3  1  74 o 7  106.135 2.398   203.276     11.9828  197.928     13.4299  62.5011    48.4783     1.38763     228.478     
1 1 1 3  1  75 o 8  77.2041 2.68833 105.688     10.59    107.235     10.1393  44.4817    219.847     1.57417     39.8471     
1 1 1 3  1  76 o 13 67.1466 3.4222  86.9555     12.8915  75.5066     9.95412  26.15      68.341      26.4035     248.341     
1 1 1 3  1  77 o 7  35.5105 5.05055 27.5463     10.04    20.122      7.36035  13.1635    243.28      1.85079     243.28      
1 1 1 3  1  78 o 18 22.1887 5.54104 6.59832     9.07449  8.86141     6.54104  1.12947    248.277     15.8785     248.277     
1 1 1 3  1  79 o 3  27.3294 5.89775 13.1557     9.76946  14.4941     7.97299  2.84906    42.0356     18.2892     222.036     
1 1 1 3  1  80 o 3  32.9585 5.56719 25.4738     10.2272  16.5566     8.0057   0.193381   280.53      34.7151     100.53      
1 1 1 3  1  81 o 11 51.6429 3.95356 54.9427     11.8192  43.0581     8.31245  29.0874    303.279     1.38648     303.279     
1 1 1 3  1  82 f 0  54.9504 4.39246 50.4944     12.6634  61.0929     10.6267  53.0767    61.822      0           0           
1 1 1 3  1  83 o 3  60.3956 3.87369 72.6379     13.2098  61.0819     9.9581   28.1138    257.618     12.833      77.6175     
1 1 1 3  1  84 o 1  23.2878 6.06098 12.5939     10.3266  4.61738     8.54179  5.13765    257.4       7.30072     77.4003     
1 1 1 3  1  85 o 14 35.1822 6.17681 17.3941     11.6871  31.6172     10.6115  11.9633    230.794     13.4367     50.7935     
1 1 1 3  1  86 o 14 34.2878 6.49483 28.0714     13.1725  19.7375     9.64149  7.16965    19.1906     22.4837     199.191     
1 1 1 3  1  87 o 4  39.8666 7.05514 19.1128     17.4792  45.0995     12.9105  20.367     289.099     0.735845    109.099     
1 1 1 3  1  88 o 6  37.7792 9.45557 36.1495     28.5981  27.2757     16.7411  12.2056    328.451     14.8947     148.451     
1 1 1 3  1  89 x 0  ?       ?       ?           ?        ?           ?        12.8041    292.875     0           0           
1 1 1 3  1  90 x 3  ?       ?       ?           ?        ?           ?        15.2291    162.798     0           0           
1 1 1 3  1  91 x 2  ?       ?       ?           ?        ?           ?        16.776     52.6094     0           0           
1 1 1 3  1  92 x 17 ?       ?       ?           ?        ?           ?        28.1768    226.614     0           0           
1 1 1 3  1  93 x 10 ?       ?       ?           ?        ?           ?        17.3505    185.508     0           0           
1 1 1 3  1  94 x 10 ?       ?       ?           ?        ?           ?        5.56341    285.741     0           0           
1 1 1 3  1  95 x 13 ?       ?       ?           ?        ?           ?        12.7222    279.728     0           0           
1 1 1 3  1  96 x 16 ?       ?       ?           ?        ?           ?        5.149      309.356     0           0           
1 1 1 3  1  97 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 3  2  0  o 15 294.102 3.26935 1533.81     48.1591  1533.81     48.1591  40.9763    180         17.5327     180         
1 1 1 3  2  1  o 18 645.578 6.24936 7403.7      216.169  7374        187.214  483.049    299.364     78.9489     299.364     
1 1 1 3  2  2  o 12 567.842 5.57841 5720.7      146.963  5711        169.69   546.433    255.334     384.38      255.334     
1 1 1 3  2  3  o 8  723.047 7.04745 9258.25     267.809  9281.95     242.243  700.205    299.204     419.864     299.204     
1 1 1 3  2  4  o 2  753.393 6.94142 10123.2     262.077  10005.6     262.072  720.371    57.2416     410.375     57.2416     
1 1 1 3  2  5  o 11 679.915 6.04136 8170.82     205.847  8220.07     205.851  624.106    121.615     325.043     121.615     
1 1 1 3  2  6  o 14 507.885 4.68915 4518.07     119.339  4626.01     119.347  312.354    346.011     62.5616     166.011     
1 1 1 3  2  7  f 0  1277.08 38.9929 30140.7     2489.21  29122.6     2489.49  925.332    202.403     0           0           
1 1 1 3  2  8  o 18 746.021 6.60073 9914.05     246.776  9821.27     246.773  398.624    71.5246     250.31      251.525     
1 1 1 3  2  9  x 3  ?       ?       ?           ?        ?           ?        895.448    14.6427     0           0           
1 1 1 3  2  10 o 4  984.352 8.72386 17220.5     439.607  17156.2     420.919  869.421    343.947     355.442     343.947     
1 1 1 3  2  11 o 18 272.263 2.98451 1340.61     38.9503  1286.82     42.3395  81.9641    83.3396     164.156     263.34      
1 1 1 3  2  12 o 11 511.732 4.61506 4659.34     115.951  4623.71     120.689  290.398    329.296     118.419     149.296     
1 1 1 3  2  13 o 14 807.508 6.95575 11642.1     275.75   11485       287.015  555.323    133.724     22.0015     313.724     
1 1 1 3  2  14 o 7  1560.43 48.4066 41721.9     3766.5   48730.6     3766.61  1068.09    172.482     82.8274     352.482     
1 1 1 3  2  15 o 2  265.769 2.99252 1263.49     38.9728  1239.98     40.7029  119.862    208.878     63.3183     28.8775     
1 1 1 3  2  16 o 12 858.364 7.86557 13207.6     322.429  12938.9     353.216  613.46     11.2976     21.8865     11.2976     
1 1 1 3  2  17 o 4  367.228 3.75505 2415.85     69.1017  2364.78     69.1033  224.114    84.5559     27.7027     264.556     
1 1 1 3  2  18 f 0  384.435 3.83099 2632.28     72.1743  2607.06     75.3871  193.525    292.265     0           0           
1 1 1 3  2  19 o 1  110.91  2.21134 212.584     11.7149  223.795     12.8394  78.0459    266.1       235.917     266.1       
1 1 1 3  2  20 o 12 205.963 2.7622  774.193     29.1933  729.728     27.833   69.9595    250.939     28.6362     70.9394     
1 1 1 3  2  21 o 19 182.332 2.53889 587.074     23.1977  591.238     23.1999  38.306     162.967     29.2733     342.967     
1 1 1 3  2  22 o 1  512.575 4.92083 4647.68     126.402  4669.31     126.403  374.151    169.333     50.7342     169.333     
1 1 1 3  2  23 o 5  343.8   3.60956 2091.2      62.1897  2098.78     62.1902  131.639    98.9682     195.724     278.968     
1 1 1 3  2  24 o 5  538.352 5.12011 5105.64     138.131  5171.26     138.136  365.278    24.5725     8.05325     204.573     
1 1 1 3  2  25 o 3  408.241 4.0862  2960.79     83.5986  2947.15     83.5975  297.166    158.179     51.2652     158.179     
1 1 1 3  2  26 o 11 572.207 5.35773 5826.97     153.635  5781.9      153.637  537.944    175.952     301.42      175.952     
1 1 1 3  2  27 o 2  237.522 2.89454 995.453     34.454   1004.02     34.4542  97.0555    88.1394     101.876     268.139     
1 1 1 3  2  28 o 4  269.079 3.17768 1283.25     41.8198  1282.84     43.8555  120.681    38.8321     105.958     218.832     
1 1 1 3  2  29 o 1  367.236 3.88992 2379.01     69.8737  2401.06     73.2784  225.986    138.166     38.5643     318.166     
1 1 1 3  2  30 o 11 1205.75 10.5924 25863.4     625.94   25736.6     653.773  824.839    275.667     33.6582     95.6674     
1 1 1 3  2  31 o 9  385.835 3.78159 2603.1      71.5294  2673.52     74.7086  307.668    290.479     105.997     290.479     
1 1 1 3  2  32 o 16 1397.61 12.2443 34362.2     838.88   35009.9     876.183  984.071    160.467     21.1925     160.468     
1 1 1 3  2  33 o 4  478.028 4.46088 4014.36     106.859  4085.81     106.864  198.793    41.1004     256.969     221.1       
1 1 1 3  2  34 o 18 575.663 5.27911 5955.77     155.607  5793.11     148.983  377.487    147.817     32.9656     327.817     
1 1 1 3  2  35 f 0  900.625 7.97209 14495.5     367.602  14278       351.956  751.918    224.872     0           0           
1 1 1 3  2  36 o 4  733.779 6.63083 9591.21     249.098  9503.47     238.499  524.03     243.406     43.0388     243.405     
1 1 1 3  2  37 o 16 551.191 5.08237 5347.13     143.373  5424.09     137.287  321.94     307.11      104.054     127.11      
1 1 1 3  2  38 o 17 223.414 2.83631 876.092     33.1423  892.99      30.2753  91.7738    172.698     84.4257     352.698     
1 1 1 3  2  39 o 16 875.854 7.78162 13553.9     348.858  13666       334.026  603.537    353.94      10.4872     353.94      
1 1 1 3  2  40 o 7  894.385 8.11121 14004       379.43   14388.8     346.428  661.357    223.356     102.729     223.356     
1 1 1 3  2  41 o 17 274.224 3.12818 1367.61     42.9706  1298.31     42.9854  198.344    67.8529     57.3507     67.8529     
1 1 1 3  2  42 o 12 225.135 2.87794 932.723     31.8597  864.491     32.9927  149.852    163.168     29.69       163.168     
1 1 1 3  2  43 o 7  1021.07 9.65578 18515.3     494.09   18550.5     494.08   751.181    88.4906     113.575     88.4906     
1 1 1 3  2  44 o 4  497.592 5.19143 4455.25     125.958  4328.43     132.746  265.835    153.726     137.899     333.726     
1 1 1 3  2  45 o 7  457.972 4.8672  3815.96     108.641  3625.36     114.49   325.331    306.158     38.9701     306.158     
1 1 1 3  2  46 o 15 564.839 5.65864 5748.81     151.847  5575.48     167.83   419.697    191.881     81.737      191.881     
1 1 1 3  2  47 f 0  547.17  5.76115 5303.92     157.977  5325.18     157.975  257.155    172.761     0           0           
1 1 1 3  2  48 o 5  341.281 4.12138 2095.07     68.3457  2036.84     72.4998  189.645    310.789     71.3267     130.789     
1 1 1 3  2  49 o 13 686.038 7.47232 8511.75     272.729  8231.34     240.537  442.242    136.48      33.1625     316.48      
1 1 1 3  2  50 o 14 197.78  3.16558 705.589     29.3216  681.692     33.2333  33.82      3.59087     186.514     183.591     
1 1 1 3  2  51 o 8  246.856 3.12317 1065.41     38.0864  1095.76     39.189   183.941    232.04      54.3642     232.04      
1 1 1 3  2  52 o 4  475.02  4.51221 4085.24     100.014  3925.15     114.039  312.831    81.7389     2.3035      261.739     
1 1 1 3  2  53 o 3  227.209 3.04802 908.52      34.7013  922.393     34.7093  143.289    299.148     5.63461     119.148     
1 1 1 3  2  54 o 10 259.247 3.22555 1210.98     39.728   1173.19     43.9055  118.523    112.139     100.636     292.139     
1 1 1 3  2  55 o 15 413.056 4.01174 2988.18     76.09    3068.03     89.6092  347.985    99.6531     156.874     99.6531     
1 1 1 3  2  56 o 16 119.171 2.24909 238.951     13.1201  265.284     13.7167  65.0778    292.034     41.6581     292.034     
1 1 1 3  2  57 o 6  117.008 2.45835 251.314     14.0572  234.745     14.6989  49.4293    147.342     38.8424     327.342     
1 1 1 3  2  58 o 10 94.5788 2.25881 155.746     10.9226  161.822     10.4411  38.0687    230.158     23.3715     50.1583     
1 1 1 3  2  59 o 15 380.075 3.73598 2522.49     68.2181  2606        74.0621  263.849    42.0159     37.1608     42.0159     
1 1 1 3  2  60 o 6  404.569 4.0442  2899.9      78.2152  2912.84     85.6217  262.095    72.1818     2.50139     72.182      
1 1 1 3  2  61 o 6  32.4376 3.56704 15.9019     5.46387  22.628      5.66299  38.2681    258.723     95.8484     258.723     
1 1 1 3  2  62 o 19 138.623 2.58302 334.067     17.909   348.131     17.9432  49.6897    350.025     70.4322     170.025     
1 1 1 3  2  63 o 7  275.405 3.24926 1288.88     44.7418  1404.99     44.8924  209.45     175.631     71.2836     175.631     
1 1 1 3  2  64 f 0  323.34  3.50582 1817.32     58.0604  1896.85     55.4496  178.029    182.148     0           0           
1 1 1 3  2  65 o 6  243.933 3.10985 1018.07     38.8809  1095.68     37.0216  173.432    26.1713     40.0393     26.1713     
1 1 1 3  2  66 f 0  47.0059 3.25445 39.2791     7.66749  39.9763     7.46474  36.5057    67.7796     0           0           
1 1 1 3  2  67 o 10 149.863 2.648   388.805     20.2967  409.079     19.4168  102.717    273.731     22.7537     273.731     
1 1 1 3  2  68 o 8  49.3067 3.31958 40.0825     8.34974  47.3108     7.73461  9.01635    275.267     5.47879     95.2666     
1 1 1 3  2  69 o 16 177.28  3.1283  560.486     31.6222  557.812     23.3079  100.556    277.397     17.991      97.3968     
1 1 1 3  2  70 o 12 185.597 2.83475 569.639     28.1034  656.856     24.0846  126.85     42.6762     25.2522     42.6762     
1 1 1 3  2  71 f 0  148.382 2.46183 356.366     18.9523  428.144     17.3389  72.1821    219.106     0           0           
1 1 1 3  2  72 o 13 59.9032 3.02983 60.5057     9.56814  68.0848     8.35364  5.92158    114.926     80.48       114.926     
1 1 1 3  2  73 o 11 94.7354 2.77571 147.052     13.6934  173.632     12.389   43.7031    157.568     24.4337     337.568     
1 1 1 3  2  74 o 19 48.8006 3.63494 43.2161     9.51346  42.8849     7.91531  21.5572    243.262     4.78918     63.2616     
1 1 1 3  2  75 o 18 217.504 3.0626  816.212     34.8351  873.255     31.7186  136.83     5.91515     7.49149     5.91515     
1 1 1 3  2  76 o 7  58.9585 3.25452 66.8871     10.3573  58.3682     8.72972  28.3583    244.164     10.7329     64.164      
1 1 1 3  2  77 o 9  80.2736 3.00617 119.845     13.141   111.339     10.9229  33.1752    231.324     28.8233     51.3238     
1 1 1 3  2  78 o 12 53.2589 3.62959 58.5591     10.1635  44.8466     8.96082  12.5053    281.717     36.3091     101.717     
1 1 1 3  2  79 o 7  98.7902 3.15788 169.556     16.8316  181.394     14.1163  48.1827    135.767     20.9676     315.767     
1 1 1 3  2  80 o 12 20.1679 5.46494 3.5625      8.78026  6.55668     6.8996   0.242787   262.239     6.93967     262.239     
1 1 1 3  2  81 o 4  31.7438 5.72105 12.5958     10.6157  25.3562     8.4744   11.1429    251.169     1.39904     251.169     
1 1 1 3  2  82 o 15 55.5687 4.60362 60.0417     12.2575  54.365      12.819   27.1128    203.998     8.51594     23.9979     
1 1 1 3  2  83 o 1  35.4328 5.83592 21.9407     10.6354  26.7739     9.75816  1.09701    77.7818     36.8216     257.782     
1 1 1 3  2  84 o 8  28.9148 6.26261 16.6908     10.4084  15.5834     9.45089  8.73093    220.151     10.9154     40.1508     
1 1 1 3  2  85 o 1  47.2517 5.51284 41.6401     12.2358  44.425      12.9662  31.7817    214.622     13.2961     214.622     
1 1 1 3  2  86 o 10 30.7351 6.80277 11.3279     11.9722  25.6291     12.2743  11.702     99.722      5.59088     99.722      
1 1 1 3  2  87 o 8  88.4975 4.80371 138.312     23.0844  157.38      18.3807  50.3549    154.922     0.709035    334.922     
1 1 1 3  2  88 o 11 36.5692 8.4599  34.6391     21.0934  23.8601     14.6462  19.4787    142.419     7.7304      142.419     
1 1 1 3  2  89 o 8  35.5277 9.67446 32.7175     24.7839  19.5736     24.2966  11.1696    163.943     13.051      343.943     
1 1 1 3  2  90 x 0  ?       ?       ?           ?        ?           ?        34.1023    100.133     0           0           
1 1 1 3  2  91 x 0  ?       ?       ?           ?        ?           ?        2.85469    248.833     0           0           
1 1 1 3  2  92 x 13 ?       ?       ?           ?        ?           ?        13.6985    303.334     0           0           
1 1 1 3  2  93 x 19 ?       ?       ?           ?        ?           ?        26.801     53.8652     0           0           
1 1 1 3  2  94 x 0  ?       ?       ?           ?        ?           ?        6.70615    184.88      0           0           
1 1 1 3  2  95 x 16 ?       ?       ?           ?        ?           ?        9.7008     44.8231     0           0           
1 1 1 3  2  96 x 5  ?       ?       ?           ?        ?           ?        11.6736    102.144     0           0           
1 1 1 3  2  97 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 3  3  0  o 4  1094.5  23.2611 21326.9     1273.26  21326.9     1273.26  1322.09    180         1076.37     180         
1 1 1 3  3  1  o 12 73.8969 2.23435 97.2872     8.23994  97.2872     8.23994  73.6838    210         163.814     210         
1 1 1 3  3  2  o 11 662.302 6.47509 7778.91     214.82   7778.91     214.82   439.118    240         73.9894     60          
1 1 1 3  3  3  o 4  98.5964 2.29848 172.81      11.329   172.81      11.329   18.9851    90.0004     47.3437     90.0004     
1 1 1 3  3  4  o 19 331.363 3.49336 1946.94     57.9815  1946.94     57.9815  239.703    300         44.4778     300         
1 1 1 3  3  5  o 4  357.141 3.55684 2261.5      63.6313  2261.5      63.6313  229.313    150         45.783      330         
1 1 1 3  3  6  o 13 249.009 2.83998 1099.55     35.419   1099.55     35.419   105.591    180         77.5909     8.69732e-06 
1 1 1 3  3  7  o 7  669.702 5.9694  7952.54     200.271  7952.54     200.271  273.754    30          414.159     210         
1 1 1 3  3  8  o 12 1419.01 30.0483 36022.7     2132.47  36022.7     2132.47  1043.8     240         50.7942     240         
1 1 1 3  3  9  o 16 646.073 5.7665  7401.19     186.637  7401.19     186.637  656.356    270         386.013     270         
1 1 1 3  3  10 o 17 118.56  2.17638 249.565     12.9113  249.565     12.9113  25.6984    120         80.2358     120         
1 1 1 3  3  11 o 4  1308.22 22.4581 30509.8     1470.39  30509.8     1470.39  958.423    330         42.0306     330         
1 1 1 3  3  12 o 7  356.244 3.56222 2250.2      63.5673  2250.2      63.5673  128.179    180         253.324     1.43896e-05 
1 1 1 3  3  13 o 1  393.672 3.98428 2748.02     78.5678  2748.02     78.5678  269.665    30          22.5234     210         
1 1 1 3  3  14 o 19 898.844 7.81608 14330.5     351.954  14330.5     351.954  717.234    60          148.995     60          
1 1 1 3  3  15 o 3  463.504 4.12012 3809.02     95.6686  3809.02     95.6686  132.153    90          398.039     270         
1 1 1 3  3  16 o 16 866.388 7.24787 13314.1     314.591  13314.1     314.591  703.724    120         170.444     120         
1 1 1 3  3  17 o 12 291.195 2.98899 1503.53     43.5976  1503.53     43.5976  196.607    330         3.39754     150         
1 1 1 3  3  18 o 12 597.622 5.16341 6333.4      154.588  6333.4      154.588  507.27     180         162.877     180         
1 1 1 3  3  19 o 11 220.366 2.76567 861.326     30.5209  861.326     30.5209  86.291     30          13.1772     30          
1 1 1 3  3  20 o 15 208.065 2.51085 767.778     26.1635  767.778     26.1635  83.8911    60          84.7114     240         
1 1 1 3  3  21 f 0  122.141 2.19766 264.855     13.4321  264.855     13.4321  144.44     270         0           0           
1 1 1 3  3  22 o 10 609.005 5.69782 6577.83     173.827  6577.83     173.827  482.023    300         99.9889     300         
1 1 1 3  3  23 o 15 190.495 2.55863 643.706     24.406   643.706     24.406   76.2742    330         20.568      150         
1 1 1 3  3  24 o 1  63.8161 2.19248 72.6703     6.97386  72.6703     6.97386  26.4087    180         61.558      180         
1 1 1 3  3  25 o 4  901.215 8.16396 14407       368.578  14407       368.578  540.504    30          192.666     210         
1 1 1 3  3  26 o 4  92.3365 2.18481 151.578     10.0842  151.578     10.0842  50.0762    60          158.545     60          
1 1 1 3  3  27 o 2  691.022 6.32475 8467.52     218.943  8467.52     218.943  482.04     270         9.72852     90          
1 1 1 3  3  28 o 14 82.7835 2.11836 121.904     8.76214  121.904     8.76214  85.7216    300         240.563     300         
1 1 1 3  3  29 o 3  226.098 2.94302 906.73      33.3211  906.73      33.3211  130.379    150         49.8862     330         
1 1 1 3  3  30 o 14 92.3394 2.1518  151.571     9.93295  151.571     9.93295  0.584476   180.001     2.43814     180.001     
1 1 1 3  3  31 o 7  653.079 6.09969 7562.96     199.555  7562.96     199.555  563.824    210         213.192     210         
1 1 1 3  3  32 o 19 41.6258 2.46297 31.3416     5.05207  31.3416     5.05207  70.8677    60          154.02      60          
1 1 1 3  3  33 o 11 526.971 5.01712 4923.93     132.441  4923.93     132.441  432.428    270         129.586     270         
1 1 1 3  3  34 o 3  213.081 2.70069 805.283     28.8181  805.283     28.8181  136.069    300         75.5294     300         
1 1 1 3  3  35 o 12 1317.16 11.7823 30789.9     777.452  30789.9     777.452  1174.07    150         517.235     150         
1 1 1 3  3  36 o 10 61.3295 2.5346  67.3272     7.72859  67.3272     7.72859  42.999     180         103.518     180         
1 1 1 3  3  37 o 10 647.201 6.27462 7428.55     203.424  7428.55     203.424  465.421    30          34.7796     30          
1 1 1 3  3  38 o 3  11.6932 4.29391 3.52652     3.26174  3.52652     3.26174  68.804     240         138.29      240         
1 1 1 3  3  39 o 3  744.67  7.19685 9836.56     268.463  9836.56     268.463  485.71     90          55.2683     270         
1 1 1 3  3  40 f 0  167.126 2.75094 495.735     23.012   495.735     23.012   5.28333    119.999     0           0           
1 1 1 3  3  41 o 10 234.5   3.05403 975.441     35.8628  975.441     35.8628  126.406    150         95.4952     150         
1 1 1 3  3  42 o 5  1154.56 10.9328 23677       632.313  23677       632.313  800.927    1.11667e-07 20.7003     1.11667e-07 
1 1 1 3  3  43 o 11 152.127 2.71967 410.883     20.7041  410.883     20.7041  40.2647    30          19.3303     30          
1 1 1 3  3  44 o 12 568.104 5.54462 5725.25     157.788  5725.25     157.788  464.622    60          154.922     60          
1 1 1 3  3  45 o 2  83.6917 2.40799 124.734     10.0614  124.734     10.0614  11.1146    270         103.095     270         
1 1 1 3  3  46 o 19 556.571 5.5315  5496.15     154.216  5496.15     154.216  320.157    300         114.524     120         
1 1 1 3  3  47 o 17 649.348 6.36762 7483.99     207.123  7483.99     207.123  544.678    330         210.95      330         
1 1 1 3  3  48 o 2  444.099 4.82569 3499.52     107.342  3499.52     107.342  345.304    180         91.4295     180         
1 1 1 3  3  49 o 8  247.176 3.37534 1084.15     41.7753  1084.15     41.7753  118.558    30          95.4814     210         
1 1 1 3  3  50 o 2  114.24  2.70088 232.071     15.4234  232.071     15.4234  13.1421    240         123.684     60          
1 1 1 3  3  51 o 12 113.91  2.44002 230.588     13.8999  230.588     13.8999  29.3265    90          90.6235     270         
1 1 1 3  3  52 o 7  471.556 4.49451 3945.44     106.169  3945.44     106.169  330.308    300         31.3861     300         
1 1 1 3  3  53 o 13 91.29   2.48284 148.356     11.3206  148.356     11.3206  0.989328   150.002     0.408673    150.002     
1 1 1 3  3  54 o 12 209.812 3.04402 781.307     31.976   781.307     31.976   101.573    360         75.1848     180         
1 1 1 3  3  55 o 4  717.274 6.8321  9142.83     245.484  9142.83     245.484  545.237    210         141.818     210         
1 1 1 3  3  56 o 11 338.43  3.71369 2032.36     62.9505  2032.36     62.9505  293.039    240         139.848     240         
1 1 1 3  3  57 o 11 250.411 3.15259 1112.73     39.534   1112.73     39.534   158.964    270         11.2162     90          
1 1 1 3  3  58 o 8  117.747 2.5097  246.415     14.7788  246.415     14.7788  77.9724    300         5.88665     300         
1 1 1 3  3  59 o 11 9.70148 4.24858 1.14741     4.1012   1.14741     4.1012   40.5405    330         82.39       330         
1 1 1 3  3  60 o 1  73.1368 2.59025 95.5278     9.43914  95.5278     9.43914  20.5753    360         33.6593     180         
1 1 1 3  3  61 o 3  164.616 2.48801 481.005     20.5039  481.005     20.5039  62.2723    210         89.0257     30          
1 1 1 3  3  62 o 4  116.928 2.40417 242.966     14.0608  242.966     14.0608  47.6973    240         55.5788     60          
1 1 1 3  3  63 o 5  127.77  2.34863 289.978     15.0155  289.978     15.0155  78.0567    270         8.3549      90          
1 1 1 3  3  64 o 18 203.289 2.86149 733.7       29.1259  733.7       29.1259  150.539    300         40.0526     300         
1 1 1 3  3  65 o 15 48.3033 2.97383 42.3124     7.06782  42.3124     7.06782  27.2739    330         114.194     330         
1 1 1 3  3  66 o 4  86.0637 2.64485 132.1       11.3581  132.1       11.3581  41.2919    180         29.1616     180         
1 1 1 3  3  67 o 12 542.457 4.82113 5234.42     131.015  5234.42     131.015  402.959    30          116.922     30          
1 1 1 3  3  68 o 12 157.605 2.73553 441.467     21.5766  441.467     21.5766  123.095    60          46.7561     60          
1 1 1 3  3  69 o 17 18.1662 5.76567 8.50125     5.60404  8.50125     5.60404  10.7722    270         25.3413     270         
1 1 1 3  3  70 o 18 130.164 2.57086 301.345     16.7403  301.345     16.7403  74.0619    120         15.335      300         
1 1 1 3  3  71 o 5  36.7373 4.17409 25.7834     7.09034  25.7834     7.09034  10.9705    330         62.0527     330         
1 1 1 3  3  72 o 2  27.1013 5.04522 15.5046     5.92005  15.5046     5.92005  16.8289    8.65047e-06 55.4749     8.65047e-06 
1 1 1 3  3  73 f 0  144.416 2.61035 371.076     18.864   371.076     18.864   133.705    30          0           0           
1 1 1 3  3  74 o 9  ?       ?       -9.4561     1.81459  -9.4561     1.81459  20.0439    60          0           0           
1 1 1 3  3  75 o 17 5.35021 2.75388 -9.4838     4.25284  -9.4838     4.25284  1.49479    270.001     3.08185     270.001     
1 1 1 3  3  76 o 9  73.931  3.03374 98.2324     11.1526  98.2324     11.1526  51.1103    120         11.6065     120         
1 1 1 3  3  77 o 3  21.9662 6.4483  12.2042     7.06907  12.2042     7.06907  0.884165   150         15.8195     150         
1 1 1 3  3  78 o 18 152.749 2.87349 416.296     21.961   416.296     21.961   101.238    180         16.8301     180         
1 1 1 3  3  79 o 6  15.5181 6.01744 6.12856     6.71829  6.12856     6.71829  16.8988    210         47.829      210         
1 1 1 3  3  80 o 3  44.4343 4.07606 37.0717     8.65573  37.0717     8.65573  29.9314    60          20.0332     60          
1 1 1 3  3  81 o 2  96.8479 2.90706 168.089     14.0513  168.089     14.0513  71.8325    90          27.5011     90          
1 1 1 3  3  82 o 12 11.8711 5.28733 1.32875     6.63639  1.32875     6.63639  10.7125    120         28.2411     120         
1 1 1 3  3  83 o 7  73.5087 3.64722 98.2232     13.281   98.2232     13.281   27.1709    330         33.0324     150         
1 1 1 3  3  84 o 18 12.9811 5.78485 1.70795     7.95591  1.70795     7.95591  3.50509    180         12.4119     180         
1 1 1 3  3  85 o 8  16.9488 6.89054 7.04494     9.35278  7.04494     9.35278  1.19089    210         15.5505     210         
1 1 1 3  3  86 o 16 13.1324 6.08261 -0.679614   9.95263  -0.679614   9.95263  3.52058    60          13.3045     60          
1 1 1 3  3  87 o 14 17.4896 7.50452 6.31045     12.2142  6.31045     12.2142  0.440693   270         3.69478     89.9999     
1 1 1 3  3  88 o 4  25.3052 9.57735 18.8909     16.6197  18.8909     16.6197  8.19891    300         6.63854     120         
1 1 1 3  3  89 o 14 26.1526 10.955  19.5832     24.8287  19.5832     24.8287  0.138909   330         28.5648     150         
1 1 1 3  3  90 x 14 ?       ?       ?           ?        ?           ?        33.4299    360         0           0           
1 1 1 3  3  91 x 7  ?       ?       ?           ?        ?           ?        36.5064    30          0           0           
1 1 1 3  3  92 x 19 ?       ?       ?           ?        ?           ?        19.5907    240         0           0           
1 1 1 3  3  93 x 12 ?       ?       ?           ?        ?           ?        53.9084    270         0           0           
1 1 1 3  3  94 x 4  ?       ?       ?           ?        ?           ?        2.83538    300         0           0           
1 1 1 3  3  95 x 2  ?       ?       ?           ?        ?           ?        13.7634    150         0           0           
1 1 1 3  3  96 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 4  0  0  o 16 594.942 6.75055 6277.35     201.151  6277.35     201.151  524.704    9.40951e-07 231.397     9.40951e-07 
1 1 1 4  0  1  o 13 336.444 3.05229 2006.72     51.4444  2006.72     51.4444  73.4285    59.9998     44.0903     59.9998     
1 1 1 4  0  2  o 12 396.082 3.71368 2781.39     73.6848  2781.39     73.6848  340.806    120         192.635     120         
1 1 1 4  0  3  o 8  757.694 6.39425 10179.5     242.719  10179.5     242.719  930.963    360         797.833     360         
1 1 1 4  0  4  o 2  163.353 2.0572  473.259     16.8288  473.259     16.8288  14.2167    240         98.9982     240         
1 1 1 4  0  5  o 19 1263.52 38.3164 28762.1     2416.02  28762.1     2416.02  1105.03    120         395.169     120         
1 1 1 4  0  6  o 12 1149.05 24.4838 23565.6     1406.97  23565.6     1406.97  943.172    4.04805e-07 236.379     4.04805e-07 
1 1 1 4  0  7  o 9  609.195 4.8825  6579.25     149.016  6579.25     149.016  566.534    60          258.878     60          
1 1 1 4  0  8  o 6  920.206 8.38135 15018.9     386.365  15018.9     386.365  953.205    120         586.075     120         
1 1 1 4  0  9  o 16 320.999 2.97867 1826.74     47.8981  1826.74     47.8981  230.891    360         59.7712     360         
1 1 1 4  0  10 o 10 526.946 4.25067 4922.42     112.217  4922.42     112.217  406.406    60          57.6364     60          
1 1 1 4  0  11 o 3  1026.6  9.72244 18697.3     499.99   18697.3     499.99   747.335    120         23.9967     120         
1 1 1 4  0  12 x 4  ?       ?       ?           ?        ?           ?        1517.74    1.20733e-06 0           0           
1 1 1 4  0  13 o 19 1702.87 36.0694 52099.5     3071.82  52099.5     3071.82  1250.73    60          65.2313     60          
1 1 1 4  0  14 o 17 968.175 8.4182  16626.7     408.306  16626.7     408.306  760.243    120         136.382     120         
1 1 1 4  0  15 x 15 ?       ?       ?           ?        ?           ?        1114.28    180         0           0           
1 1 1 4  0  16 o 3  694.435 6.15115 8551.94     213.991  8551.94     213.991  680.714    240         370.314     240         
1 1 1 4  0  17 o 3  594.64  5.3372  6270.24     158.99   6270.24     158.99   528.373    300         208.844     300         
1 1 1 4  0  18 o 6  136.567 2.20394 330.99      15.0659  330.99      15.0659  21.5568    180         126.616     180         
1 1 1 4  0  19 o 12 219.723 2.61533 856.212     28.7796  856.212     28.7796  15.3632    60.0001     272.755     240         
1 1 1 4  0  20 o 14 555.688 5.25402 5476.41     146.254  5476.41     146.254  524.793    300         259.701     300         
1 1 1 4  0  21 o 4  82.0186 2.21459 119.72      9.07242  119.72      9.07242  101.412    7.49878e-07 251.18      7.49878e-07 
1 1 1 4  0  22 o 14 280.544 3.11258 1395.73     43.7362  1395.73     43.7362  219.579    240         95.1628     240         
1 1 1 4  0  23 o 14 180.796 2.47881 579.857     22.4401  579.857     22.4401  7.57503    120         1.68483     300         
1 1 1 4  0  24 o 6  142.705 2.18589 361.354     15.616   361.354     15.616   4.47585    180         20.3344     3.79267e-05 
1 1 1 4  0  25 o 11 79.4121 1.96246 112.149     7.78829  112.149     7.78829  17.2171    59.9999     45.2415     59.9999     
1 1 1 4  0  26 o 13 179.145 2.39805 569.265     21.5115  569.265     21.5115  70.222     300         54.6346     120         
1 1 1 4  0  27 o 7  565.63  4.86783 5672.33     137.938  5672.33     137.938  430.845    180         64.8901     180         
1 1 1 4  0  28 o 3  452.06  4.08513 3623.07     92.5128  3623.07     92.5128  208.418    60          219.01      240         
1 1 1 4  0  29 o 17 308.25  2.94649 1684.56     45.4978  1684.56     45.4978  122.38     120         188.097     300         
1 1 1 4  0  30 o 7  1020.94 8.47501 18484.8     433.477  18484.8     433.477  494.399    180         442.614     9.06733e-06 
1 1 1 4  0  31 o 15 1800.65 14.7569 57559.7     1331.23  57559.7     1331.23  1088.98    240         342.399     60          
1 1 1 4  0  32 o 14 419.706 3.85011 3123.01     80.9495  3123.01     80.9495  215.712    300         155.013     120         
1 1 1 4  0  33 o 2  591.519 4.76642 6202.94     141.252  6202.94     141.252  494.69     180         164.359     180         
1 1 1 4  0  34 o 16 902.178 7.84933 14434.8     354.762  14434.8     354.762  763.611    60          271.238     60          
1 1 1 4  0  35 o 14 550.99  4.66536 5382.29     128.78   5382.29     128.78   501.549    120         237.488     120         
1 1 1 4  0  36 o 13 1327.29 11.3073 31261.7     751.87   31261.7     751.87   1126.67    180         412.658     180         
1 1 1 4  0  37 f 0  366.764 3.38522 2384.82     62.1966  2384.82     62.1966  468.983    240         0           0           
1 1 1 4  0  38 o 2  294.199 3.04048 1534.67     44.8058  1534.67     44.8058  211.73     300         19.1734     300         
1 1 1 4  0  39 o 1  447.957 3.99657 3557.71     89.6867  3557.71     89.6867  382.65     6.00452e-06 147.942     6.00452e-06 
1 1 1 4  0  40 o 3  349.831 3.30639 2169.81     57.9425  2169.81     57.9425  278.005    240         75.1069     240         
1 1 1 4  0  41 o 14 373.008 3.82763 2467.23     71.5158  2467.23     71.5158  252.415    120         6.97677     300         
1 1 1 4  0  42 o 16 356.288 3.42584 2250.8      61.1432  2250.8      61.1432  269.406    180         51.0699     180         
1 1 1 4  0  43 f 0  947.045 7.77185 15914.2     368.743  15914.2     368.743  605.376    60          0           0           
1 1 1 4  0  44 o 9  146.039 2.22094 378.439     16.2372  378.439     16.2372  30.8786    120         133.916     300         
1 1 1 4  0  45 o 15 55.3363 2.3333  54.8374     6.41735  54.8374     6.41735  69.1699    180         183.413     180         
1 1 1 4  0  46 o 14 17.0307 4.32542 6.80221     3.37655  6.80221     3.37655  85.4943    60          175.237     60          
1 1 1 4  0  47 o 14 350.51  3.53525 2178.86     62.07    2178.86     62.07    263.883    120         53.7929     120         
1 1 1 4  0  48 o 6  254.421 2.88707 1148.07     36.789   1148.07     36.789   117.382    360         108.371     180         
1 1 1 4  0  49 o 11 292.571 3.6009  1518.67     52.7601  1518.67     52.7601  323.21     240         256.74      240         
1 1 1 4  0  50 f 0  132.584 2.71723 312.327     18.0199  312.327     18.0199  50.9164    120         0           0           
1 1 1 4  0  51 o 3  551.116 5.56634 5391.29     153.665  5391.29     153.665  373.666    2.98106e-07 10.1235     2.98107e-07 
1 1 1 4  0  52 o 11 285.827 3.63671 1449.71     52.0542  1449.71     52.0542  104.638    60          171.979     240         
1 1 1 4  0  53 o 16 215.754 3.15817 826.198     34.1142  826.198     34.1142  165.412    120         43.8756     120         
1 1 1 4  0  54 o 10 78.5321 2.4444  109.937     9.57756  109.937     9.57756  17.0888    360         60.4425     180         
1 1 1 4  0  55 o 14 59.9188 2.22422 64.1527     6.63657  64.1527     6.63657  2.57813    240         14.2526     60.0001     
1 1 1 4  0  56 o 16 6.07864 2.92748 -1.61346    2.73831  -1.61346    2.73831  27.1402    120         54.6096     120         
1 1 1 4  0  57 o 16 325.61  3.34737 1880.9      54.5953  1880.9      54.5953  279.091    5.91237e-06 130.355     5.91237e-06 
1 1 1 4  0  58 o 4  97.383  2.0745  168.529     10.1033  168.529     10.1033  22.4466    60.0001     11.42       60.0001     
1 1 1 4  0  59 o 1  24.3181 3.82137 11.9102     4.07006  11.9102     4.07006  63.1692    120         140.415     120         
1 1 1 4  0  60 o 2  87.9131 2.27061 137.532     9.97326  137.532     9.97326  41.9034    180         5.44615     180         
1 1 1 4  0  61 o 14 209.555 2.56673 779.119     26.9368  779.119     26.9368  174.252    60          76.7402     60          
1 1 1 4  0  62 o 14 193.693 2.55592 665.75      24.7902  665.75      24.7902  121.643    120         7.06077     300         
1 1 1 4  0  63 o 6  9.59359 4.06499 1.66038     3.49305  1.66038     3.49305  87.945     180         179.317     180         
1 1 1 4  0  64 o 6  357.964 3.39879 2274.12     60.9463  2274.12     60.9463  314.219    240         168.984     240         
1 1 1 4  0  65 o 9  12.16   4.83612 3.49326     4.46974  3.49326     4.46974  5.99323    120         12.5524     120         
1 1 1 4  0  66 o 13 131.451 2.52569 307.078     16.6104  307.078     16.6104  120.862    4.90719e-06 75.0333     4.90719e-06 
1 1 1 4  0  67 o 3  114.29  2.48078 232.297     14.1785  232.297     14.1785  101.227    240         59.0822     240         
1 1 1 4  0  68 o 5  8.12356 3.93497 -3.39781    5.10502  -3.39781    5.10502  10.4898    300         21.5003     300         
1 1 1 4  0  69 o 14 32.4687 4.20967 20.507      6.16992  20.507      6.16992  2.15876    360         13.3014     360         
1 1 1 4  0  70 o 10 87.3567 2.60947 136.132     11.3773  136.132     11.3773  69.9768    60          32.9354     60          
1 1 1 4  0  71 o 6  184.212 2.57494 602.951     23.7499  602.951     23.7499  165.683    300         101.021     300         
1 1 1 4  0  72 o 14 53.0923 3.35428 51.2846     8.75303  51.2846     8.75303  11.9797    360         39.8423     180         
1 1 1 4  0  73 o 13 108.006 2.87019 208.097     15.4854  208.097     15.4854  58.6505    240         16.682      60          
1 1 1 4  0  74 o 8  8.26558 3.9687  -2.6631     4.95429  -2.6631     4.95429  11.7871    300         24.7368     300         
1 1 1 4  0  75 o 7  18.6917 6.79519 9.22927     8.11393  9.22927     8.11393  0.831408   6.3299e-05  3.32911     6.3299e-05  
1 1 1 4  0  76 o 1  64.43   2.86724 74.6912     9.17285  74.6912     9.17285  29.6764    60          19.5897     240         
1 1 1 4  0  77 o 19 78.2546 3.26206 110.21      12.69    110.21      12.69    46.9754    120         1.52897     300         
1 1 1 4  0  78 o 13 44.3839 3.90984 36.7776     8.33262  36.7776     8.33262  31.1504    4.49142e-06 14.4504     4.49142e-06 
1 1 1 4  0  79 o 17 80.1227 3.75777 116.223     14.9339  116.223     14.9339  51.7346    240         6.54934     240         
1 1 1 4  0  80 o 16 18.002  7.02577 8.30048     9.22321  8.30048     9.22321  2.06052    120         11.1839     120         
1 1 1 4  0  81 o 7  61.4643 4.27482 69.6813     12.8544  69.6813     12.8544  36.4904    360         0.70977     180         
1 1 1 4  0  82 f 0  25.1794 7.75481 16.6359     10.1472  16.6359     10.1472  28.2378    240         0           0           
1 1 1 4  0  83 o 8  134.537 3.5054  325.265     23.5612  325.265     23.5612  94.1534    120         28.4533     120         
1 1 1 4  0  84 o 4  59.7599 5.28856 67.722      15.1678  67.722      15.1678  26.0849    180         18.5084     360         
1 1 1 4  0  85 o 16 68.3844 4.82166 87.2579     16.1187  87.2579     16.1187  38.1247    240         4.25202     60          
1 1 1 4  0  86 o 4  76.9616 4.3642  109.251     16.5755  109.251     16.5755  35.5219    300         19.1276     120         
1 1 1 4  0  87 o 18 56.3462 6.46705 63.1034     16.8184  63.1034     16.8184  29.4949    180         6.71255     8.65515e-06 
1 1 1 4  0  88 o 18 33.2768 10.9714 32.6739     20.3637  32.6739     20.3637  5.43205    60          27.5609     240         
1 1 1 4  0  89 o 3  21.1709 10.3896 -18.835     38.4967  -18.835     38.4967  1.19217    120         2.4799      300         
1 1 1 4  0  90 x 19 ?       ?       ?           ?        ?           ?        33.3036    180         0           0           
1 1 1 4  0  91 x 9  ?       ?       ?           ?        ?           ?        33.1209    240         0           0           
1 1 1 4  0  92 x 5  ?       ?       ?           ?        ?           ?        21.4256    300         0           0           
1 1 1 4  0  93 x 1  ?       ?       ?           ?        ?           ?        9.81231    1.61556e-05 0           0           
1 1 1 4  0  94 x 19 ?       ?       ?           ?        ?           ?        3.68198    60.0001     0           0           
1 1 1 4  0  95 x 10 ?       ?       ?           ?        ?           ?        0.906712   300         0           0           
1 1 1 4  0  96 x 13 ?       ?       ?           ?        ?           ?        6.02438    180         0           0           
1 1 1 4  0  97 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 4  1  0  o 12 1006.7  17.4562 18031.1     879.468  18031.1     879.468  995.562    360         543.88      360         
1 1 1 4  1  1  o 10 567.094 5.00883 5865.48     145.21   5537.41     139.505  394.208    181.887     16.5436     181.887     
1 1 1 4  1  2  o 19 1048.49 14.025  19423.8     736.91   19651.7     736.93   745.917    52.0257     6.37842     52.0265     
1 1 1 4  1  3  o 15 622.494 5.96106 6857.11     181.488  6881.94     190.342  352.71     300.726     157.888     120.726     
1 1 1 4  1  4  x 7  ?       ?       ?           ?        ?           ?        740.653    185.21      0           0           
1 1 1 4  1  5  o 4  492.039 4.37751 4281.65     107.937  4300.06     107.944  205.431    19.9798     262.333     199.98      
1 1 1 4  1  6  x 11 ?       ?       ?           ?        ?           ?        891.882    220.537     0           0           
1 1 1 4  1  7  f 0  1312.75 56.6609 31348.4     2629.59  0           0        871.27     243.448     0           0           
1 1 1 4  1  8  o 17 1427.8  43.676  38544.3     3116.32  35980.4     3116.17  1262.45    2.18536     496.299     2.18536     
1 1 1 4  1  9  o 5  1002.12 10.3018 17909.2     532.418  17736.3     501.99   809.728    235.219     205.91      235.219     
1 1 1 4  1  10 x 9  ?       ?       ?           ?        ?           ?        1011.84    182.658     0           0           
1 1 1 4  1  11 o 10 235.5   2.51695 965.222     29.154   1000.44     30.2579  8.417      213.649     265.091     33.6486     
1 1 1 4  1  12 o 11 1128.92 10.7239 22328.2     575.871  22926       636.721  876.983    166.501     155.996     166.501     
1 1 1 4  1  13 o 17 1394.77 18.5975 34988.6     1299.8   34387.4     1299.97  1136.25    297.407     292.218     297.407     
1 1 1 4  1  14 o 19 976.611 8.16911 17108.4     383.933  16734.9     414.72   797.557    322.936     220.577     322.936     
1 1 1 4  1  15 o 8  754.638 6.5061  10203.5     241.015  9995.35     250.861  780.972    328.851     534.122     328.851     
1 1 1 4  1  16 o 6  919.404 7.68422 15034.3     354.032  14961.5     354.07   722.937    147.527     154.247     147.527     
1 1 1 4  1  17 o 6  1041.84 8.8327  19488       451.71   19054.4     470.174  874.19     195.824     281.818     195.824     
1 1 1 4  1  18 o 5  457.637 4.15299 3712.51     97.1257  3712.67     93.3267  230.823    126.224     161.966     306.224     
1 1 1 4  1  19 o 15 622.757 5.44515 6862.51     173.283  6892.95     166.509  497.902    39.0376     139.227     39.0376     
1 1 1 4  1  20 o 7  592.76  5.20203 6225.68     157.577  6236.02     151.416  444.058    162.418     72.9997     162.418     
1 1 1 4  1  21 o 18 399.52  3.75446 2807.79     76.6388  2850.91     73.646   262.862    37.1608     4.10496     217.161     
1 1 1 4  1  22 o 11 265.123 2.86118 1256.9      38.7727  1234.57     37.2533  165.088    299.61      61.9398     299.61      
1 1 1 4  1  23 o 17 71.9954 2.00137 90.2642     7.20064  93.7327     7.21126  47.3677    93.9227     114.048     93.9227     
1 1 1 4  1  24 o 2  900.835 7.58841 14369.8     349.338  14426.5     335.648  705.793    163.333     152.286     163.333     
1 1 1 4  1  25 o 4  816.067 6.97819 11622.6     290.906  12002.4     279.508  583.605    329.584     28.5866     329.584     
1 1 1 4  1  26 o 17 586.056 5.1526  6003.73     154.269  6173.78     148.224  392.366    71.5177     23.8747     251.518     
1 1 1 4  1  27 o 2  768.819 6.76124 10385       271.024  10577       249.31   539.291    262.59      8.86259     262.59      
1 1 1 4  1  28 o 19 1166.3  9.6261  23916.4     562.608  24354.6     562.616  868.015    264.346     104.138     264.346     
1 1 1 4  1  29 o 9  295.876 3.01804 1567.69     44.7476  1534.97     44.749   111.146    311.416     169.517     131.416     
1 1 1 4  1  30 o 18 1511.66 12.6863 40521.1     941.644  40639       980.131  1068.35    71.3511     22.9426     71.3511     
1 1 1 4  1  31 o 15 184.821 2.26422 600.791     20.9673  609.767     20.975   37.4888    65.2967     148.73      245.297     
1 1 1 4  1  32 o 18 976.382 7.97271 16604.1     382.885  17212.4     397.365  781.461    351.836     208.529     351.836     
1 1 1 4  1  33 o 6  259.327 2.72657 1174.01     34.7714  1209.49     36.0988  182.153    146.112     46.0116     146.112     
1 1 1 4  1  34 o 8  1528.88 12.5445 41125.1     961.093  41917.2     961.128  1136.67    288.186     150.209     288.186     
1 1 1 4  1  35 o 19 570.355 4.93527 5651.81     141.037  5881.5      141.05   355.816    35.9705     67.149      215.971     
1 1 1 4  1  36 o 14 366.796 3.43512 2374.37     63.1405  2394.19     63.1451  260.828    21.4858     41.4533     21.4858     
1 1 1 4  1  37 o 2  254.675 2.7396  1132.59     33.6028  1166.22     36.3088  149.326    69.8557     11.3243     249.856     
1 1 1 4  1  38 o 14 663.188 5.49521 7782.76     179.334  7812.28     185.887  512.243    67.2415     125.673     67.2415     
1 1 1 4  1  39 o 8  450.753 4.19404 3583.97     94.7281  3618.71     94.7495  292.759    178.994     15.3765     358.994     
1 1 1 4  1  40 o 13 757.108 6.49182 10114.5     251.149  10219.1     241.32   482.329    45.2257     66.5534     225.226     
1 1 1 4  1  41 o 17 263.147 2.8477  1214.39     36.7891  1240.05     38.3159  205.459    239.285     100.332     239.285     
1 1 1 4  1  42 o 3  308.333 3.4912  1634.12     53.9212  1736.85     53.9326  210.181    259.27      20.9734     259.27      
1 1 1 4  1  43 o 1  361.589 3.72227 2271.77     67.4235  2364.12     67.4576  241.353    314.971     4.58269     314.971     
1 1 1 4  1  44 o 9  601.922 6.02263 6340.63     176.873  6517.44     186.45   453.758    288.34      96.7604     288.34      
1 1 1 4  1  45 o 11 197.374 2.82632 640.892     24.9995  741.921     30.9191  124.968    324.379     9.62943     324.379     
1 1 1 4  1  46 o 17 406.739 4.21101 2936.53     81.6233  2931.12     89.8409  318.329    304.769     97.5894     304.769     
1 1 1 4  1  47 o 10 644.634 6.31576 7404.08     198.815  7354.75     209.083  482.046    351.154     98.9576     351.154     
1 1 1 4  1  48 o 5  206.844 3.24033 753.171     35.6014  763.967     31.414   137.458    211.641     17.7279     211.641     
1 1 1 4  1  49 o 12 89.2187 2.78285 136.512     10.8277  146.341     13.8978  10.8126    198.004     16.8474     18.004      
1 1 1 4  1  50 o 11 99.7365 2.52539 168.539     10.8326  184.762     14.2719  25.951     212.848     27.2057     32.8482     
1 1 1 4  1  51 o 11 585.682 5.87273 6006.71     168.301  6182.57     176.434  379.352    158.652     19.6095     338.652     
1 1 1 4  1  52 o 2  227.986 2.96276 915.129     29.7     928.143     37.5927  91.0889    287.772     113.224     107.772     
1 1 1 4  1  53 o 7  230.063 2.96991 905.956     31.3264  971.718     37.0838  168.613    292.737     42.8739     292.737     
1 1 1 4  1  54 o 5  132.349 2.58862 294.656     15.1781  327.359     19.0738  56.5952    104.407     49.2292     284.407     
1 1 1 4  1  55 o 1  445.528 4.53038 3548.02     96.0996  3500.83     105.894  315.381    269.143     46.6495     269.143     
1 1 1 4  1  56 o 18 412.667 3.99715 2933.93     80.6793  3112.6      84.6619  298.272    105.181     58.1677     105.181     
1 1 1 4  1  57 o 14 294.539 3.27651 1539.65     46.3042  1538.39     50.3361  211.524    234.375     44.0146     234.375     
1 1 1 4  1  58 o 8  87.4011 2.20474 124.892     9.10852  146.747     10.1839  27.577     304.324     35.3564     124.324     
1 1 1 4  1  59 o 16 62.7963 2.41456 61.9516     7.0811   78.8112     8.06234  8.20169    54.175      75.566      54.175      
1 1 1 4  1  60 o 10 135.978 2.24315 321.536     13.9436  334.18      16.5616  87.7439    142.359     17.0947     142.359     
1 1 1 4  1  61 o 4  90.8533 2.35305 139.658     9.91441  153.632     11.4754  24.399     108.325     52.5094     288.325     
1 1 1 4  1  62 o 19 288.346 3.36422 1448.36     46.7502  1503.33     50.4624  192.636    217.859     18.8642     217.859     
1 1 1 4  1  63 o 18 89.3592 2.42703 138.366     11.0626  145.341     10.6132  36.2992    180.472     25.1275     0.471819    
1 1 1 4  1  64 o 18 145.829 2.21215 351.527     16.2331  403.684     16.0271  60.14      317.86      59.958      137.86      
1 1 1 4  1  65 o 16 394.846 4.20385 2725.1      85.7464  2821.54     80.4208  314.855    261.55      128.292     261.55      
1 1 1 4  1  66 o 19 129.636 2.48317 272.521     16.5263  325.37      15.5142  104.584    177.891     58.3586     177.891     
1 1 1 4  1  67 o 17 199.21  2.78892 720.305     30.6433  689.366     24.8551  129.389    115.385     10.8681     115.385     
1 1 1 4  1  68 o 19 70.1957 2.80595 94.166      10.9839  81.68       8.66628  32.5162    36.7945     8.85893     216.795     
1 1 1 4  1  69 o 14 80.2573 2.75736 117.695     12.2752  111.8       9.74917  39.205     331.004     12.3745     151.004     
1 1 1 4  1  70 o 18 168.988 2.6784  536.015     25.0696  479.956     20.252   105.287    228.105     2.90265     228.105     
1 1 1 4  1  71 o 16 192.381 2.814   669.508     29.3093  647.446     24.8324  134.89     90.6712     33.5436     90.6712     
1 1 1 4  1  72 o 19 137.212 2.60689 342.191     18.9184  328.175     16.8784  60.5611    185.263     45.7642     5.26271     
1 1 1 4  1  73 o 7  131.157 2.57279 315.246     17.8715  297.524     15.9051  66.682     359.068     25.2652     179.068     
1 1 1 4  1  74 o 11 94.7666 2.81198 161.598     13.6175  159.014     13.0296  68.2337    235.727     26.125      235.727     
1 1 1 4  1  75 o 6  147.738 2.56837 407.392     20.1022  370.618     17.9375  82.5779    146.969     14.6985     326.969     
1 1 1 4  1  76 o 7  28.9313 4.8807  15.3184     7.27013  16.1568     6.69182  0.182025   239.128     27.2007     59.128      
1 1 1 4  1  77 o 18 146.062 2.86939 396.637     22.7471  366.714     19.1795  88.839     56.376      1.37688     56.376      
1 1 1 4  1  78 o 19 47.7313 3.50767 43.7711     8.60376  39.0288     7.93683  26.0852    183.368     1.0543      183.368     
1 1 1 4  1  79 o 8  79.8687 2.9881  128.742     11.5591  101.275     12.0676  50.2551    312.226     7.41317     312.226     
1 1 1 4  1  80 o 7  37.7312 5.40531 20.444      9.13702  34.484      10.6861  13.772     101.046     11.5562     281.046     
1 1 1 4  1  81 o 19 45.7519 3.98447 40.786      9.63112  36.1933     8.25816  20.6823    149.964     8.71113     329.964     
1 1 1 4  1  82 o 17 59.5354 3.9213  56.4024     11.1569  73.768      11.8845  35.2928    358.558     3.43932     358.558     
1 1 1 4  1  83 o 1  77.0539 3.57628 111.744     13.304   104.119     14.1032  42.3429    331.104     4.63857     151.104     
1 1 1 4  1  84 o 17 61.2865 4.02793 65.402      11.9054  73.0003     12.5516  29.5573    23.1749     11.0357     203.175     
1 1 1 4  1  85 o 16 71.4554 3.723   91.5684     12.8995  95.7279     13.5781  43.358     74.6087     4.89839     74.6087     
1 1 1 4  1  86 o 18 21.0471 6.15865 5.00839     9.10066  2.16925     12.266   2.27883    175.953     12.358      355.953     
1 1 1 4  1  87 o 14 68.7257 4.84728 78.3776     15.7869  101.409     17.0656  29.3907    3.66438     19.4951     183.664     
1 1 1 4  1  88 o 19 47.871  8.19448 35.1003     17.9134  66.0125     21.6498  31.5845    229.588     14.548      229.588     
1 1 1 4  1  89 o 10 27.4765 8.71896 -9.63078    30.109   6.39001     21.1306  5.01583    47.6224     14.585      227.622     
1 1 1 4  1  90 x 7  ?       ?       ?           ?        ?           ?        39.0547    326.897     0           0           
1 1 1 4  1  91 x 19 ?       ?       ?           ?        ?           ?        14.3343    16.6253     0           0           
1 1 1 4  1  92 x 6  ?       ?       ?           ?        ?           ?        21.8967    70.7664     0           0           
1 1 1 4  1  93 x 9  ?       ?       ?           ?        ?           ?        17.3995    307.201     0           0           
1 1 1 4  1  94 x 4  ?       ?       ?           ?        ?           ?        5.06562    108.053     0           0           
1 1 1 4  1  95 x 10 ?       ?       ?           ?        ?           ?        14.6149    108.328     0           0           
1 1 1 4  1  96 x 4  ?       ?       ?           ?        ?           ?        9.43934    4.78721     0           0           
1 1 1 4  1  97 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 4  2  0  o 4  319.633 3.44381 1811.6      55.1346  1811.6      55.1346  117.795    360         218.196     180         
1 1 1 4  2  1  o 10 461.941 4.58787 3876.4      108.749  3688.94     103.684  399.565    34.5324     247.758     34.5324     
1 1 1 4  2  2  o 18 874.275 9.11267 13770.6     387.114  13351.8     410.62   935.438    28.8633     673.496     28.8633     
1 1 1 4  2  3  o 10 1016.23 12.0186 18269       517.497  18408.9     694.37   777.344    66.1767     116.903     66.1767     
1 1 1 4  2  4  o 5  767.988 7.24084 10398.9     285.189  10518.8     271.927  469.138    330.997     140.735     150.997     
1 1 1 4  2  5  o 11 784.081 7.03723 10854.2     270.459  10948.2     282.493  590.026    14.6656     82.923      14.6656     
1 1 1 4  2  6  o 1  680.069 6.18137 8135.2      206.063  8263.77     215.235  462.118    38.9063     22.1033     218.906     
1 1 1 4  2  7  o 9  1036.54 9.82865 19204.3     510.531  18926.5     510.555  840.728    42.7398     216.159     42.7398     
1 1 1 4  2  8  f 0  909.653 8.08914 14749.4     360.601  14603.2     376.648  514.19     235.259     0           0           
1 1 1 4  2  9  o 8  1229.63 14.3696 27162.7     919.291  26597.1     850.98   836.861    80.6501     75.1971     260.65      
1 1 1 4  2  10 o 8  1172.43 12.0109 24443       684.574  24385.5     726.166  993.892    72.1546     326.962     72.1546     
1 1 1 4  2  11 o 2  977.878 8.53493 17229.7     400.153  16701.4     435.013  863.432    170.703     351.405     170.703     
1 1 1 4  2  12 o 15 897.971 7.66927 14226.8     338.169  14378.5     352.008  689.014    64.5078     114.465     64.5078     
1 1 1 4  2  13 o 13 669.801 6.0026  8028.93     192.821  7880.58     209.63   520.067    34.4247     112.638     34.4247     
1 1 1 4  2  14 f 0  708.947 6.05386 8917.68     206.634  8906.66     223.202  272.169    284.645     0           0           
1 1 1 4  2  15 o 11 1037.15 8.66813 19122.6     432.815  19061.9     467.521  774.37     246.38      83.7613     246.38      
1 1 1 4  2  16 o 14 768.442 6.68171 10515.8     241.315  10433.3     272.248  432.141    283.732     215.182     103.732     
1 1 1 4  2  17 o 17 69.945  1.97558 94.0493     6.60271  79.9008     7.12977  50.4664    255.818     115.52      255.818     
1 1 1 4  2  18 o 5  131.17  2.12961 294.069     13.6921  315.906     14.3075  48.6035    123.728     201.065     123.728     
1 1 1 4  2  19 o 3  190.567 2.52707 647.063     23.6012  640.094     24.6489  9.14757    267.413     195.174     87.413      
1 1 1 4  2  20 f 0  318.035 3.2825  1808.31     50.0674  1777.19     54.4339  286.282    312.674     0           0           
1 1 1 4  2  21 o 19 205.024 2.5461  738.814     26.1577  751.051     26.1613  75.287     228.755     49.512      48.7547     
1 1 1 4  2  22 o 5  191.346 2.4775  636.326     23.7512  661.443     23.7563  19.9897    38.2123     180.599     218.212     
1 1 1 4  2  23 o 8  317.233 3.27821 1802.57     52.1134  1764.68     52.1152  209.163    267.354     15.9694     267.354     
1 1 1 4  2  24 o 13 339.093 3.41788 2089.75     56.828   1986.55     59.2213  246.038    192.615     57.9604     192.615     
1 1 1 4  2  25 o 11 669.499 6.06349 7934.43     198.969  7960.58     207.826  348.135    181.601     236.634     1.6007      
1 1 1 4  2  26 o 10 425.751 4.1732  3256.71     89.0353  3168.82     89.0321  376.403    237.748     193.368     237.748     
1 1 1 4  2  27 o 4  981.415 8.8561  17047.6     435.561  17126.1     435.573  708.11     96.0582     43.5627     96.0582     
1 1 1 4  2  28 o 11 164.075 2.37983 488.894     19.1229  465.292     19.974   46.1468    127.024     11.2733     307.024     
1 1 1 4  2  29 o 5  734.124 6.9102  9564.71     248.098  9546.06     260.198  557.231    274.755     97.0126     274.755     
1 1 1 4  2  30 o 15 545.369 5.31938 5230.42     141.903  5313.64     148.827  401.857    217.982     56.7133     217.982     
1 1 1 4  2  31 o 7  706.167 6.53085 8770.1      231.105  8912.13     231.124  567.066    41.7989     159.877     41.7989     
1 1 1 4  2  32 o 14 624.018 5.79863 6889.38     181.332  6916.43     181.339  513.43     327.05      171.236     327.05      
1 1 1 4  2  33 o 7  467.479 4.40096 3905.9      100.817  3840.71     105.296  241.188    203.812     156.189     23.8115     
1 1 1 4  2  34 o 6  403.101 4.06478 2896.59     82.1116  2863.03     82.112   281.731    53.5027     24.4995     53.5027     
1 1 1 4  2  35 o 14 1230.5  10.7782 26857.8     678.901  26902.4     650.043  888.714    316.088     74.2648     316.088     
1 1 1 4  2  36 o 13 244.018 2.90051 1072.05     34.6723  1038.45     36.2189  128.29     354.523     43.3619     174.523     
1 1 1 4  2  37 o 1  313.529 3.43176 1746.94     51.4139  1737.26     56.3026  109.457    168.248     193.315     348.248     
1 1 1 4  2  38 o 18 296.144 3.29991 1536.4      48.9799  1572.21     48.9631  126.737    48.8414     128.925     228.841     
1 1 1 4  2  39 o 8  632.664 6.06537 7131.66     187.669  7064.23     196.786  404.643    231.961     49.7946     51.9612     
1 1 1 4  2  40 o 7  313.754 3.69915 1746.83     61.3091  1742.78     54.8456  245.099    83.1767     95.7432     83.1767     
1 1 1 4  2  41 o 10 280.319 3.45236 1400.26     49.7674  1385.24     47.2087  138.159    293.756     87.3413     113.756     
1 1 1 4  2  42 o 11 979.292 9.9159  16956       512.795  17137.9     458.65   719.664    197.307     104.677     197.307     
1 1 1 4  2  43 o 18 735.474 7.17578 9597.34     277.375  9607.36     250.908  551.545    254.778     106.296     254.778     
1 1 1 4  2  44 o 1  396.334 4.3856  2876.86     93.9314  2695.4      80.1133  343.653    92.5388     165.73      92.5388     
1 1 1 4  2  45 o 1  412.75  4.36223 3032.42     94.6377  3009.92     85.6313  331.809    133.552     116.207     133.552     
1 1 1 4  2  46 o 13 559.331 5.72725 5546.72     164.698  5558.51     156.255  418.664    52.6772     86.6658     52.6772     
1 1 1 4  2  47 o 9  268.725 3.19207 1268.37     41.9561  1292.15     44.0102  146.18     191.449     58.5641     11.4492     
1 1 1 4  2  48 o 9  72.5799 2.64725 93.5323     10.2367  93.7204     8.90636  5.88181    321.219     52.7721     321.219     
1 1 1 4  2  49 o 17 382.581 4.38006 2633.2      73.9463  2560.82     92.6809  255.569    302.772     6.2177      302.772     
1 1 1 4  2  50 o 11 184.11  2.71536 619.949     25.0842  582.177     25.0061  84.0972    219.352     62.505      39.3522     
1 1 1 4  2  51 o 1  504.537 5.32471 4512.24     134.653  4528.96     134.611  317.576    353.251     34.3122     173.251     
1 1 1 4  2  52 o 6  373.68  3.86564 2514.54     70.6385  2440.26     74.0389  243.42     208.877     5.0051      28.8772     
1 1 1 4  2  53 o 9  262.976 3.57549 1257.55     39.4727  1196.34     53.365   166.029    122.884     10.0533     302.884     
1 1 1 4  2  54 o 3  155.177 3.10424 392.887     26.5537  463.126     20.7195  34.1794    287.255     129.162     107.255     
1 1 1 4  2  55 o 10 264.292 3.56824 1236.12     43.8735  1242.42     50.4349  144.898    66.0274     52.9257     246.027     
1 1 1 4  2  56 o 12 362.541 3.98381 2282.07     74.1815  2384.34     70.4194  272.88     325.999     74.5541     325.999     
1 1 1 4  2  57 o 16 326.175 3.62287 1866.53     58.2158  1909.5      60.2232  194.949    20.9847     32.9871     200.985     
1 1 1 4  2  58 o 4  132.263 2.45922 294.558     15.8846  326.653     16.6867  72.7765    79.4025     11.4411     259.402     
1 1 1 4  2  59 o 2  316.025 3.53506 1724.29     57.3824  1821.19     54.4381  294.707    239.456     188.951     239.456     
1 1 1 4  2  60 f 0  233.58  3.0038  947.886     36.0521  988.073     34.1963  113.806    241.64      0           0           
1 1 1 4  2  61 o 12 101.032 2.3981  173.2       12.3521  189.403     11.8506  55.8381    17.558      8.9776      17.558      
1 1 1 4  2  62 o 13 168.263 2.67803 509.227     23.6009  495.253     21.5418  114.445    56.1383     23.4983     56.1383     
1 1 1 4  2  63 o 2  368.467 3.87436 2391.13     72.0676  2432.92     70.9982  278.275    1.62175     86.6763     1.62175     
1 1 1 4  2  64 o 12 119.928 2.3994  241.297     14.2384  269.767     14.5558  80.5031    42.3621     20.9814     42.3621     
1 1 1 4  2  65 o 3  121.869 2.50336 262.084     15.5211  265.418     15.0165  60.3699    105.65      27.3991     285.65      
1 1 1 4  2  66 o 9  132.973 2.41368 289.943     16.1035  338.779     15.9628  97.4363    327.252     35.8511     327.252     
1 1 1 4  2  67 o 2  357.116 3.95636 2188.32     74.1295  2353.75     66.9607  247.338    231.51      43.9764     231.51      
1 1 1 4  2  68 o 9  75.5889 2.57253 106.2       9.48827  97.2981     9.90611  30.0439    187.252     25.0937     7.25237     
1 1 1 4  2  69 o 9  342.656 3.73339 2117.6      67.2551  2066.35     60.8734  238.529    106.498     47.687      106.498     
1 1 1 4  2  70 o 6  182.369 3.1073  603.224     30.1354  581.028     26.5822  90.5061    299.682     44.6606     119.681     
1 1 1 4  2  71 o 9  136.67  2.77716 322.492     19.4895  342.816     18.4527  83.9537    307.63      2.36808     307.63      
1 1 1 4  2  72 o 19 33.9598 4.68861 20.8897     7.74784  21.8983     7.63628  4.98798    227.335     35.0822     227.335     
1 1 1 4  2  73 o 19 129.865 2.82925 296.43      18.8931  304.939     17.8557  76.1755    238.918     4.35553     58.918      
1 1 1 4  2  74 o 4  86.5231 2.87425 142.102     12.539   125.629     12.2944  69.467     107.815     41.8173     107.815     
1 1 1 4  2  75 o 18 57.7371 3.31045 60.1171     9.37844  59.8456     9.61227  12.4708    221.602     42.6057     41.602      
1 1 1 4  2  76 o 4  30.361  4.81586 16.8756     7.44011  17.7588     6.85505  1.61682    247.884     34.1299     247.884     
1 1 1 4  2  77 o 10 78.4499 3.02451 106.771     11.6024  114.136     12.0904  42.7605    273.889     6.79389     93.8885     
1 1 1 4  2  78 o 6  138.117 2.97136 381.867     18.99    303.96      21.51    92.8615    30.6333     20.0237     30.6334     
1 1 1 4  2  79 o 6  27.2828 5.37623 18.685      7.50222  8.77962     8.47119  1.34609    132.346     29.4762     132.346     
1 1 1 4  2  80 o 1  87.9604 3.20261 147.061     13.6834  131.867     14.3729  50.5009    242.851     2.31819     62.8514     
1 1 1 4  2  81 o 17 41.8647 6.17586 45.0911     9.74741  22.3847     15.0886  21.2954    278.533     0.598953    98.5328     
1 1 1 4  2  82 o 2  32.5318 5.88095 26.7452     8.22507  12.4403     12.3149  11.0164    156.777     10.1539     336.777     
1 1 1 4  2  83 o 15 121.476 3.78934 241.121     17.9729  297.431     27.7773  79.3152    168.084     15.8515     168.084     
1 1 1 4  2  84 o 14 20.7404 6.339   -3.739      8.54702  7.16081     15.0328  2.71933    146.887     6.64159     326.887     
1 1 1 4  2  85 o 5  42.1087 6.39692 48.7786     11.2506  22.0107     15.3435  21.0667    0.855757    3.31683     180.856     
1 1 1 4  2  86 o 17 22.0847 6.6356  3.10805     9.25083  3.66517     16.1728  4.4003     160.98      4.94106     340.98      
1 1 1 4  2  87 o 1  26.5098 7.24519 18.9386     13.5411  -4.36849    16.9892  8.70533    296.627     1.3664      116.627     
1 1 1 4  2  88 o 1  29.7221 7.86945 1.80708     15.8853  27.8637     17.8658  9.18361    207.2       9.47858     27.2004     
1 1 1 4  2  89 o 10 31.3003 9.01075 5.79173     21.7985  25.5138     23.4867  9.57238    200.011     9.71504     20.0107     
1 1 1 4  2  90 x 14 ?       ?       ?           ?        ?           ?        34.2242    182.245     0           0           
1 1 1 4  2  91 x 19 ?       ?       ?           ?        ?           ?        46.3957    182.674     0           0           
1 1 1 4  2  92 x 16 ?       ?       ?           ?        ?           ?        18.3211    115.761     0           0           
1 1 1 4  2  93 x 8  ?       ?       ?           ?        ?           ?        23.4867    103.443     0           0           
1 1 1 4  2  94 x 18 ?       ?       ?           ?        ?           ?        8.33204    16.8018     0           0           
1 1 1 4  2  95 x 14 ?       ?       ?           ?        ?           ?        22.8115    257.851     0           0           
1 1 1 4  2  96 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 4  3  0  o 15 127.441 2.24253 288.306     14.302   288.306     14.302   102.928    2.43296e-05 311.485     2.43296e-05 
1 1 1 4  3  1  o 11 393.168 4.09898 2731.5      82.6568  2747.7      78.8122  231.321    108.975     168.332     108.975     
1 1 1 4  3  2  o 15 683.393 6.49925 8373.28     227.876  8187.69     217.264  540.507    136.716     134.543     136.716     
1 1 1 4  3  3  o 11 742.211 6.85774 9709.14     243.268  9826.29     266.486  589.115    262.903     143.775     262.903     
1 1 1 4  3  4  o 19 342.094 3.71896 2026.97     65.2059  2121.49     62.1781  220.76     154.242     117.019     154.242     
1 1 1 4  3  5  o 6  502.844 4.85662 4502.69     122.385  4460.74     122.383  372.385    287.862     70.4941     287.862     
1 1 1 4  3  6  o 6  269.822 2.98674 1309.22     40.3843  1271.16     40.3819  74.9912    293.022     503.538     293.022     
1 1 1 4  3  7  o 5  584.352 5.51892 5977.85     161.607  6128.91     161.609  366.067    165.495     75.5832     345.495     
1 1 1 4  3  8  o 16 813.706 7.12092 11752.4     290.378  11730.6     290.378  594.89     103.463     46.2663     103.463     
1 1 1 4  3  9  o 15 1175.58 11.377  24683.9     652.262  24399.7     687.557  980.573    240.96      293.389     240.96      
1 1 1 4  3  10 o 16 207.933 2.60212 775.477     27.1143  756.886     27.113   10.3484    61.3482     208.157     241.348     
1 1 1 4  3  11 o 3  143.982 2.31532 362.331     17.0582  372.393     16.3341  77.5099    24.6747     288.585     24.6747     
1 1 1 4  3  12 o 4  422.505 4.03314 3161.51     85.3953  3166.3      85.3957  278.572    265.828     2.43382     85.8278     
1 1 1 4  3  13 o 7  615.015 5.41168 6746.35     163.404  6665.88     170.07   345.511    262.612     165.69      82.6124     
1 1 1 4  3  14 o 18 413.237 3.86609 2990.27     78.4576  3063.35     81.666   288.051    24.1294     32.69       24.1294     
1 1 1 4  3  15 o 1  311.4   3.25707 1717.2      50.829   1719.99     50.8276  213.32     16.6263     82.9229     16.6263     
1 1 1 4  3  16 o 6  495.702 4.49267 4367.72     109.344  4344.79     113.81   367.807    193.81      64.7957     193.81      
1 1 1 4  3  17 o 4  264.888 2.88082 1257.18     37.4612  1229.91     38.9871  152.127    199.233     36.0471     199.233     
1 1 1 4  3  18 o 19 394.571 3.73929 2797.85     72.422   2721.75     75.3755  320.1      322.876     137.138     322.876     
1 1 1 4  3  19 o 9  502.48  4.55622 4513.23     112.393  4439.85     116.981  321.845    172.837     44.5335     352.837     
1 1 1 4  3  20 o 13 169.343 2.24807 508.08      19.0784  508.275     19.078   11.9187    130.428     143.832     310.428     
1 1 1 4  3  21 o 8  212.3   2.55624 793.933     26.6507  803.524     27.7372  31.1361    186.302     195.553     6.30193     
1 1 1 4  3  22 o 2  400.555 3.73788 2822.65     73.5199  2865        76.5337  292.29     180.685     53.6276     180.685     
1 1 1 4  3  23 o 15 938.184 7.89767 15901.2     363.64   15336.5     378.489  564.162    65.2932     190.585     245.293     
1 1 1 4  3  24 o 10 265.943 3.0719  1256.68     39.028   1250.05     42.7584  182.111    29.7322     63.9743     29.7322     
1 1 1 4  3  25 o 5  368.969 3.67938 2414.99     68.0342  2410.41     68.0337  235.585    321.928     20.5921     141.928     
1 1 1 4  3  26 o 19 420     4.17726 3128.9      87.9233  3123.82     87.9222  284.898    66.9717     2.20269     66.9716     
1 1 1 4  3  27 o 2  1303.65 11.6603 30167.8     761.784  30179.2     761.78   925.192    196.511     20.0602     196.511     
1 1 1 4  3  28 o 19 839.219 7.61875 12541.9     320.421  12436.3     320.415  602.285    60.1847     34.748      60.1847     
1 1 1 4  3  29 o 2  383.956 4.00963 2635.19     75.2785  2590.18     78.9457  286.273    42.657      61.3327     42.6571     
1 1 1 4  3  30 o 3  165.973 2.46075 477.423     20.4633  498.935     20.4643  6.84892    309.491     184.9       129.491     
1 1 1 4  3  31 o 12 590.312 5.50191 6144.45     162.759  6209.53     162.764  438.006    101.196     64.6889     101.196     
1 1 1 4  3  32 o 8  527.209 5.00963 4945.82     132.357  4907.51     132.356  412.517    38.7056     106.037     38.7056     
1 1 1 4  3  33 f 0  330.904 3.47535 1998.72     56.1905  1883.06     58.9209  229.918    351.537     0           0           
1 1 1 4  3  34 o 3  346.273 3.81172 2130.13     66.1442  2119.87     66.1467  299.235    145.653     245.9       145.653     
1 1 1 4  3  35 o 17 260.504 3.27318 1176        41.6147  1229.52     43.8523  85.4656    81.9502     166.333     261.95      
1 1 1 4  3  36 o 7  585.319 5.95363 6119.57     169.953  6029.03     179.124  454.519    204.555     115.624     204.555     
1 1 1 4  3  37 o 10 527.998 5.45187 4933.06     140.422  4951.84     148.007  380.416    177.377     49.7566     177.377     
1 1 1 4  3  38 o 15 316.49  3.60638 1767.79     57.204   1782.73     57.194   231.035    134.712     64.4697     134.712     
1 1 1 4  3  39 o 15 144.961 2.41824 368.265     17.9635  376.504     17.1515  18.8812    202.535     110.135     22.5348     
1 1 1 4  3  40 o 10 405.159 4.26976 2858.69     86.6658  2961.61     86.7028  231.32     196.916     78.5817     16.9161     
1 1 1 4  3  41 o 19 657.487 6.26075 7623.43     211.093  7713.83     201.303  449.51     86.2451     6.07475     86.245      
1 1 1 4  3  42 o 5  494.054 4.80126 4265.03     121.598  4391.93     115.984  265.862    113.102     135.678     293.102     
1 1 1 4  3  43 f 0  445.41  4.75444 3510.75     108.861  3525.62     103.305  325.97     122.548     0           0           
1 1 1 4  3  44 o 14 517.407 4.98905 4752.6      129.357  4744.28     129.369  428.848    257.837     164.155     257.837     
1 1 1 4  3  45 o 3  135.228 2.42388 326.611     16.3924  322.007     16.4327  53.501     69.6652     44.793      249.665     
1 1 1 4  3  46 o 17 292.666 3.36488 1524.71     50.5327  1512.42     48.1509  194.802    117.785     6.40553     117.785     
1 1 1 4  3  47 o 15 441.071 4.28254 3453.87     94.6633  3447.71     94.6579  204.134    59.1792     182.035     239.179     
1 1 1 4  3  48 o 16 242.227 2.92781 1060.83     38.0776  1019.76     32.9069  138.691    352.793     34.9947     172.793     
1 1 1 4  3  49 o 5  322.363 3.8483  1859.59     62.1573  1826.91     62.177   208.552    161.984     5.32716     341.984     
1 1 1 4  3  50 o 8  177.713 2.99245 561.219     28.937   559.078     24.1272  54.8492    80.7712     115.563     260.771     
1 1 1 4  3  51 o 16 133.744 2.63972 319.783     17.6939  314.947     17.6562  83.9855    139.023     38.5249     139.023     
1 1 1 4  3  52 o 16 329.318 4.11204 1902.93     67.8705  1945.99     67.849   224.636    89.0513     17.3127     89.0513     
1 1 1 4  3  53 o 13 480.209 5.33359 4126.75     116.421  4067.09     139.101  390.524    228.946     147.441     228.946     
1 1 1 4  3  54 o 12 128.256 2.95211 286.383     18.9212  297.714     18.9728  66.2067    190.653     21.7579     10.6526     
1 1 1 4  3  55 o 3  381.634 4.58159 2666.05     81.7943  2507.89     92.7132  256.952    19.9044     14.5658     19.9044     
1 1 1 4  3  56 o 2  204.638 2.95901 742.698     29.5467  742.727     31.1236  151.312    12.5076     45.7441     12.5076     
1 1 1 4  3  57 o 6  191.781 2.64531 670.216     26.0527  634.459     24.7998  64.8322    177.195     115.07      357.195     
1 1 1 4  3  58 o 16 161.734 2.44453 465.229     19.8115  462.402     19.8148  108.529    91.6388     20.3311     91.6388     
1 1 1 4  3  59 o 5  364.4   3.81949 2347.11     68.0699  2367.45     71.4034  349.268    68.4162     233.559     68.4162     
1 1 1 4  3  60 o 11 62.7491 2.66786 67.8821     8.12685  72.3213     8.57634  0.429046   232.993     54.3576     52.9934     
1 1 1 4  3  61 o 9  209.856 2.80962 781.618     29.1467  780.815     29.9438  143.223    330.863     23.6704     330.863     
1 1 1 4  3  62 o 12 96.9085 2.54786 176.95      12.3873  156.954     12.2886  48.0827    241.672     8.87896     61.6717     
1 1 1 4  3  63 o 4  214.017 2.88829 823.01      30.3445  802.655     31.5792  146.236    177.033     24.0231     177.033     
1 1 1 4  3  64 o 14 173.692 2.53951 526.62      21.1557  543.969     23.0401  117.66     62.5316     20.0243     62.5316     
1 1 1 4  3  65 o 11 159.062 2.52059 436.551     19.6219  461.537     20.5662  79.5994    295.719     38.7729     115.719     
1 1 1 4  3  66 o 3  431.048 4.11577 3297.68     88.827   3317.39     88.9872  314.47     94.8329     81.9106     94.8329     
1 1 1 4  3  67 o 7  291.351 3.04954 1524.58     42.6126  1492.29     46.3173  212.938    155.861     59.4594     155.861     
1 1 1 4  3  68 o 14 119.489 2.52066 238.315     15.121   269.721     14.9799  86.9647    164.998     32.7785     164.998     
1 1 1 4  3  69 o 8  205.459 2.82142 755.704     28.5571  745.137     29.5278  146.581    318.313     38.5591     318.313     
1 1 1 4  3  70 o 9  26.6772 4.9242  21.1385     7.31407  4.43977     7.41184  8.71043    237.538     29.4207     237.538     
1 1 1 4  3  71 o 10 30.0316 4.49859 13.6385     6.7011   20.0193     6.43805  1.48206    233.751     8.81572     233.751     
1 1 1 4  3  72 o 14 104.904 2.61986 207.284     13.8449  185.125     13.6354  56.3884    84.7585     11.6664     264.758     
1 1 1 4  3  73 o 7  65.2784 2.92038 84.4998     10.2433  68.4016     8.78457  5.21561    149.703     65.8039     329.703     
1 1 1 4  3  74 o 10 33.2411 4.28015 22.4626     7.45669  18.5217     6.29365  4.84326    154.746     19.8491     334.746     
1 1 1 4  3  75 o 2  37.5476 4.06954 30.9607     7.89403  21.2773     6.89335  10.6947    55.5459     17.3431     235.546     
1 1 1 4  3  76 o 11 62.5919 3.45729 55.0169     10.6529  88.1828     10.2503  34.4767    281.6       2.90907     101.6       
1 1 1 4  3  77 o 5  127.537 2.69026 295.728     17.7885  285.792     16.5571  72.9401    79.6009     7.79463     259.601     
1 1 1 4  3  78 o 19 78.4244 3.10589 118.419     11.8333  103.013     12.3865  43.7039    310.686     4.68161     130.686     
1 1 1 4  3  79 o 14 25.9079 4.92452 2.72391     7.44576  21.2552     7.48627  1.43253    195.186     20.2542     15.1862     
1 1 1 4  3  80 o 8  55.8984 3.61735 54.7278     9.85877  58.9323     10.1819  13.486     79.9779     37.6437     259.978     
1 1 1 4  3  81 o 2  63.4729 3.54141 67.0983     10.5288  79.4242     11.8306  37.8797    226.914     3.4676      226.914     
1 1 1 4  3  82 o 11 18.0635 5.2005  2.57719     7.05016  2.90039     7.74493  0.109892   275.95      3.35986     275.95      
1 1 1 4  3  83 o 15 17.4733 5.06934 4.64965     7.10324  -1.07762    7.43703  1.75077    206.612     15.0951     206.612     
1 1 1 4  3  84 o 11 27.9938 5.66909 9.26737     8.12076  21.1632     9.19338  11.1168    67.3845     2.16771     247.384     
1 1 1 4  3  85 o 18 43.3675 5.16364 35.8482     9.43109  36.3467     12.0643  17.4696    215.051     13.0998     35.0507     
1 1 1 4  3  86 o 14 74.8948 4.02628 81.2313     12.0442  129.573     18.139   39.8121    353.498     6.28343     173.498     
1 1 1 4  3  87 o 6  47.3678 6.68178 46.1255     14.6729  45.0862     15.9188  30.5654    3.2801      11.2651     3.2801      
1 1 1 4  3  88 o 1  33.3925 7.62926 35.4661     16.2825  9.6342      15.0506  15.5636    33.5186     5.39448     33.5186     
1 1 1 4  3  89 o 14 28.4777 8.45208 23.0568     21.3173  -15.5011    23.6     8.62473    74.5345     2.47165     254.535     
1 1 1 4  3  90 o 19 26.5697 13.0954 0           0        -55.4914    43.9746  1.96766    198.234     1.28151     18.2335     
1 1 1 4  3  91 x 4  ?       ?       ?           ?        ?           ?        30.1768    314.48      0           0           
1 1 1 4  3  92 x 2  ?       ?       ?           ?        ?           ?        26.8664    358.55      0           0           
1 1 1 4  3  93 x 19 ?       ?       ?           ?        ?           ?        8.16305    100.436     0           0           
1 1 1 4  3  94 x 0  ?       ?       ?           ?        ?           ?        12.9132    17.9296     0           0           
1 1 1 4  3  95 x 16 ?       ?       ?           ?        ?           ?        24.9789    39.1817     0           0           
1 1 1 4  3  96 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 4  4  0  o 14 529.453 6.87226 4972.71     182.204  4972.71     182.204  405.47     360         62.2341     360         
1 1 1 4  4  1  o 13 598.132 5.64663 6343.89     169.189  6343.89     169.189  503.755    30          146.876     30          
1 1 1 4  4  2  o 2  126.713 2.33992 285.078     14.8358  285.078     14.8358  7.10736    60.0001     25.1152     60.0001     
1 1 1 4  4  3  o 1  579.474 5.46996 5954.19     158.783  5954.19     158.783  354.015    90          125.594     270         
1 1 1 4  4  4  o 8  889.708 8.08838 14039.9     360.502  14039.9     360.502  599.529    300         80.6207     120         
1 1 1 4  4  5  o 11 666.05  6.41849 7867.27     214.15   7867.27     214.15   607.814    330         257.885     330         
1 1 1 4  4  6  o 4  1334.64 14.8993 31645.6     995.974  31645.6     995.974  931.38     2.97147e-06 55.8131     180         
1 1 1 4  4  7  o 16 1371.49 15.2682 33422.4     1048.82  33422.4     1048.82  1221.18    30          471.523     30          
1 1 1 4  4  8  o 14 779.894 6.83908 10786.4     267.204  10786.4     267.204  615.823    60          111.402     60          
1 1 1 4  4  9  f 0  1163.24 10.3844 24011.4     605.136  24011.4     605.136  962.029    90          0           0           
1 1 1 4  4  10 o 1  576.854 5.22518 5900.42     150.997  5900.42     150.997  490.288    300         152.824     300         
1 1 1 4  4  11 o 18 397.321 3.97228 2799.19     79.058   2799.19     79.058   344.958    150         126.537     150         
1 1 1 4  4  12 o 8  219.991 2.9409  858.488     32.3963  858.488     32.3963  0.0949707  360         305.164     360         
1 1 1 4  4  13 o 3  102.349 2.08767 186.074     10.6877  186.074     10.6877  72.1097    210         201.894     210         
1 1 1 4  4  14 o 17 680.146 6.03627 8204.34     205.673  8204.34     205.673  579.514    240         185.62      240         
1 1 1 4  4  15 o 4  141.265 2.36657 354.203     16.7326  354.203     16.7326  52.6598    270         254.113     270         
1 1 1 4  4  16 o 8  86.6869 2.02697 133.589     8.7838   133.589     8.7838   7.33804    120         18.9279     120         
1 1 1 4  4  17 o 11 78.5807 2.15024 109.906     8.43879  109.906     8.43879  40.2564    330         98.4915     330         
1 1 1 4  4  18 o 13 232.028 2.70347 954.772     31.4165  954.772     31.4165  123.363    3.78393e-06 32.676      3.78393e-06 
1 1 1 4  4  19 o 1  663.686 5.64275 7811.59     187.617  7811.59     187.617  445.678    30          54.1732     210         
1 1 1 4  4  20 o 8  366.174 3.47852 2377.39     63.8066  2377.39     63.8066  223.468    60          73.9872     240         
1 1 1 4  4  21 o 15 197.08  2.42803 688.86      23.9641  688.86      23.9641  42.3299    90          180.986     270         
1 1 1 4  4  22 o 15 45.6423 2.06992 37.3658     4.68935  37.3658     4.68935  153.388    300         328.222     300         
1 1 1 4  4  23 o 7  262.117 2.93307 1218.34     38.5063  1218.34     38.5063  183.403    330         6.10496     330         
1 1 1 4  4  24 o 8  1238.77 10.2415 27226.5     635.598  27226.5     635.598  845.828    180         62.7175     8.34796e-06 
1 1 1 4  4  25 o 5  1345.34 11.0551 32114.2     745.119  32114.2     745.119  986.215    210         69.7028     210         
1 1 1 4  4  26 f 0  311.291 3.19375 1718.13     49.7991  1718.13     49.7991  289.241    60          0           0           
1 1 1 4  4  27 o 13 371.09  3.73208 2441.64     69.3733  2441.64     69.3733  406.339    270         317.271     270         
1 1 1 4  4  28 o 6  1221.25 10.9292 26460.7     668.648  26460.7     668.648  844.99     300         29.6664     120         
1 1 1 4  4  29 o 4  550.408 5.74366 5372.43     158.351  5372.43     158.351  414.143    330         54.4747     330         
1 1 1 4  4  30 f 0  172.856 2.76346 530.245     23.911   530.245     23.911   135.356    180         0           0           
1 1 1 4  4  31 o 2  758.622 7.67167 10207.8     291.525  10207.8     291.525  441.468    210         180.072     30          
1 1 1 4  4  32 o 2  75.9595 2.35328 102.822     8.91886  102.822     8.91886  20.6844    60.0001     62.9691     60.0001     
1 1 1 4  4  33 o 9  49.0411 2.63209 43.3467     6.38095  43.3467     6.38095  46.1377    270         104.065     270         
1 1 1 4  4  34 o 9  771.133 8.30195 10549.5     320.659  10549.5     320.659  514.517    300         45.6962     120         
1 1 1 4  4  35 o 16 861.563 8.24209 13167.4     355.718  13167.4     355.718  501.721    330         195.033     150         
1 1 1 4  4  36 o 16 1281.55 12.0723 29156.8     775.016  29156.8     775.016  935.55     360         91.9015     360         
1 1 1 4  4  37 o 12 22.2327 4.4501  10.6163     4.29351  10.6163     4.29351  34.3984    210         70.0876     210         
1 1 1 4  4  38 o 1  163.753 2.62483 475.877     21.5152  475.877     21.5152  68.2961    240         30.5796     60          
1 1 1 4  4  39 o 14 131.376 2.6443  306.576     17.3776  306.576     17.3776  14.0885    270         12.3494     90.0001     
1 1 1 4  4  40 o 5  292.829 3.30534 1520.7      48.4776  1520.7      48.4776  211.397    300         19.8457     300         
1 1 1 4  4  41 o 2  624.904 5.72951 6926.22     179.361  6926.22     179.361  412.111    330         34.1631     150         
1 1 1 4  4  42 o 18 290.656 3.25971 1498.26     47.4541  1498.26     47.4541  197.407    6.97517e-07 3.51282     180         
1 1 1 4  4  43 o 3  418.221 4.41131 3102.36     92.4094  3102.36     92.4094  334.082    30          96.3456     30          
1 1 1 4  4  44 f 0  150.659 2.5931  402.942     19.5521  402.942     19.5521  93.8657    60          0           0           
1 1 1 4  4  45 o 12 615.064 6.08837 6713.17     187.581  6713.17     187.581  383.713    270         69.4481     90          
1 1 1 4  4  46 o 15 58.5142 2.60718 61.3963     7.57484  61.3963     7.57484  33.2827    120         108.613     120         
1 1 1 4  4  47 o 10 208.058 3.10734 768.247     32.3666  768.247     32.3666  82.8379    150         115.971     330         
1 1 1 4  4  48 f 0  403.269 4.61539 2885.83     93.2197  2885.83     93.2197  203.938    4.24602e-06 0           0           
1 1 1 4  4  49 o 3  301.015 4.18728 1608.36     63.1105  1608.36     63.1105  129.62     30          146.096     210         
1 1 1 4  4  50 o 3  343.978 3.62863 2098.92     62.5197  2098.92     62.5197  171.069    240         119.784     60          
1 1 1 4  4  51 f 0  385.245 4.16901 2633.39     80.4454  2633.39     80.4454  222.539    270         0           0           
1 1 1 4  4  52 o 4  580.677 5.7322  5986.75     166.735  5986.75     166.735  443.743    300         112.087     300         
1 1 1 4  4  53 o 7  24.7013 4.53499 12.7765     4.85074  12.7765     4.85074  56.2985    150         125.914     150         
1 1 1 4  4  54 o 1  377.212 4.17621 2525.22     78.9021  2525.22     78.9021  310.066    180         119.37      180         
1 1 1 4  4  55 o 17 779.224 7.71324 10800.1     301.07   10800.1     301.07   574.598    210         117.862     210         
1 1 1 4  4  56 f 0  330.369 3.66552 1936.75     60.6533  1936.75     60.6533  192.243    60          0           0           
1 1 1 4  4  57 o 17 18.3088 5.31008 8.31768     4.80801  8.31768     4.80801  55.7309    90          118.188     90          
1 1 1 4  4  58 o 5  333.933 3.59019 1978.78     60.0497  1978.78     60.0497  274.172    300         110.492     300         
1 1 1 4  4  59 o 4  218.444 2.7148  846.671     29.6987  846.671     29.6987  185.877    330         86.2605     330         
1 1 1 4  4  60 o 12 62.2992 2.48599 69.4518     7.70446  69.4518     7.70446  8.90812    360         21.7208     180         
1 1 1 4  4  61 f 0  51.6819 2.67616 48.1077     6.84397  48.1077     6.84397  53.3051    30          0           0           
1 1 1 4  4  62 o 1  46.5214 2.7594  39.1736     6.32521  39.1736     6.32521  0.580346   240         7.55987     240         
1 1 1 4  4  63 o 3  71.3418 2.54777 90.9235     9.0556   90.9235     9.0556   32.5492    270         12.4485     90          
1 1 1 4  4  64 o 5  133.316 2.42691 315.735     16.19    315.735     16.19    106.585    120         41.9879     120         
1 1 1 4  4  65 o 3  132.198 2.25029 310.379     14.8886  310.379     14.8886  67.5789    150         34.1027     330         
1 1 1 4  4  66 o 6  208.859 2.64035 774.418     27.616   774.418     27.616   120.073    360         26.3027     180         
1 1 1 4  4  67 o 2  97.0209 2.94495 167.937     14.2585  167.937     14.2585  53.1204    30          16.9708     210         
1 1 1 4  4  68 o 16 163.86  2.5717  477.027     21.0945  477.027     21.0945  64.5032    240         78.4934     60          
1 1 1 4  4  69 o 9  311.09  3.53099 1720.67     55.0161  1720.67     55.0161  225.573    90          58.6953     90          
1 1 1 4  4  70 o 1  85.9956 2.72744 132.061     11.7002  132.061     11.7002  48.5296    300         10.8652     120         
1 1 1 4  4  71 o 16 179.355 2.88708 572.203     25.9193  572.203     25.9193  164.068    330         103.618     330         
1 1 1 4  4  72 o 1  39.244  4.29923 29.3178     7.85137  29.3178     7.85137  5.28303    360         6.64476     180         
1 1 1 4  4  73 o 4  25.8285 6.13056 15.3455     7.08228  15.3455     7.08228  15.0895    210         55.3685     210         
1 1 1 4  4  74 o 19 101.002 2.80577 182.143     14.1519  182.143     14.1519  96.4355    60          67.9862     60          
1 1 1 4  4  75 o 9  84.8683 2.98338 129.065     12.6168  129.065     12.6168  57.2768    270         10.0156     270         
1 1 1 4  4  76 o 17 18.594  6.27568 9.1522      6.6965   9.1522      6.6965   4.4612     120         18.8035     120         
1 1 1 4  4  77 o 17 7.15668 3.60534 -8.09815    5.68082  -8.09815    5.68082  32.4143    150         68.8282     150         
1 1 1 4  4  78 f 0  10.4284 4.76904 -0.0858994  5.84964  -0.0858994  5.84964  22.5856    180         0           0           
1 1 1 4  4  79 o 13 15.6863 6.23222 6.06005     7.4133   6.06005     7.4133   2.26485    30          8.08459     30          
1 1 1 4  4  80 f 0  87.1804 3.15953 136.66      13.7207  136.66      13.7207  65.8553    240         0           0           
1 1 1 4  4  81 o 3  125.38  3.18745 281.735     19.9689  281.735     19.9689  72.5737    90          5.34749     270         
1 1 1 4  4  82 o 18 12.1338 5.43025 1.20919     7.09424  1.20919     7.09424  4.70483    120         13.4719     120         
1 1 1 4  4  83 o 10 14.0973 5.96861 3.96075     7.51913  3.96075     7.51913  0.552151   150         2.5994      150         
1 1 1 4  4  84 o 8  31.2185 7.03852 22.5        9.69716  22.5        9.69716  13.1193    180         9.96589     8.6534e-06  
1 1 1 4  4  85 o 18 23.6719 7.66242 15.2548     9.90893  15.2548     9.90893  7.58318    30          0.851036    210         
1 1 1 4  4  86 o 8  70.9941 4.47296 93.618      15.6097  93.618      15.6097  33.8191    240         15.633      60          
1 1 1 4  4  87 o 3  21.3107 7.98407 12.8382     11.4499  12.8382     11.4499  4.28928    90          8.29848     270         
1 1 1 4  4  88 o 3  15.7551 7.27145 0.290839    14.0393  0.290839    14.0393  0.188993   119.999     1.3338      119.999     
1 1 1 4  4  89 o 9  18.6085 8.70115 -0.517747   21.1244  -0.517747   21.1244  0.145939   150         4.54224     330         
1 1 1 4  4  90 o 7  17.9221 8.64752 -8.77898    24.1336  -8.77898    24.1336  0.441319   180         6.97239     360         
1 1 1 4  4  91 x 10 ?       ?       ?           ?        ?           ?        35.3194    210         0           0           
1 1 1 4  4  92 x 11 ?       ?       ?           ?        ?           ?        14.0046    240         0           0           
1 1 1 4  4  93 x 12 ?       ?       ?           ?        ?           ?        14.5895    90          0           0           
1 1 1 4  4  94 x 12 ?       ?       ?           ?        ?           ?        7.75019    120         0           0           
1 1 1 4  4  95 x 14 ?       ?       ?           ?        ?           ?        10.7236    150         0           0           
1 1 1 4  4  96 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 5  0  0  o 14 962.189 12.9279 16431.9     622.869  16431.9     622.869  1141.06    180         918.021     180         
1 1 1 5  0  1  o 14 1268.28 26.7994 28735.1     1699.89  28735.1     1699.89  869.418    60          84.6616     240         
1 1 1 5  0  2  o 6  1045.74 10.4745 19404.1     548.682  19404.1     548.682  687.915    300         127.576     120         
1 1 1 5  0  3  x 8  ?       ?       ?           ?        ?           ?        765.682    180         0           0           
1 1 1 5  0  4  x 19 ?       ?       ?           ?        ?           ?        673.73     60          0           0           
1 1 1 5  0  5  x 9  ?       ?       ?           ?        ?           ?        1461.19    300         0           0           
1 1 1 5  0  6  o 17 138     2.08084 337.895     14.3758  337.895     14.3758  95.7191    180         315.862     180         
1 1 1 5  0  7  x 15 ?       ?       ?           ?        ?           ?        1207.45    60          0           0           
1 1 1 5  0  8  o 4  630.682 5.02593 7051.58     158.805  7051.58     158.805  659.657    300         414.887     300         
1 1 1 5  0  9  o 15 319.409 2.90076 1808.64     46.4149  1808.64     46.4149  236.176    180         75.6924     180         
1 1 1 5  0  10 o 7  1148.44 10.3589 23400.6     595.969  23400.6     595.969  818.408    60          9.86442     240         
1 1 1 5  0  11 o 14 764.158 6.0296  10353.3     230.84   10353.3     230.84   518.097    300         58.8524     120         
1 1 1 5  0  12 o 5  1235.31 11.6773 27085.4     722.613  27085.4     722.613  928.911    180         88.7305     180         
1 1 1 5  0  13 o 4  534.612 4.41685 5067        118.298  5067        118.298  451.066    240         137.159     240         
1 1 1 5  0  14 o 11 889.867 7.18004 14043.2     320.099  14043.2     320.099  798.1      120         323.652     120         
1 1 1 5  0  15 o 7  143.126 2.07564 363.429     14.8737  363.429     14.8737  39.7804    180         203.89      180         
1 1 1 5  0  16 o 19 418.54  3.74832 3105.79     78.5917  3105.79     78.5917  398.92     60          311.009     60          
1 1 1 5  0  17 o 5  305.638 3.11359 1656.37     47.6679  1656.37     47.6679  94.9107    120         64.8112     120         
1 1 1 5  0  18 o 9  843.415 7.06214 12618.3     298.401  12618.3     298.401  461.577    1.94738e-06 278.707     180         
1 1 1 5  0  19 o 8  1126.74 9.71144 22536.9     548.18   22536.9     548.18   760.396    240         83.1667     60          
1 1 1 5  0  20 o 3  26.8894 2.45357 13.438      3.15506  13.438      3.15506  180.963    300         368.775     300         
1 1 1 5  0  21 o 1  83.2945 2.03761 123.376     8.48235  123.376     8.48235  9.5358     4.37199e-05 24.6232     4.37199e-05 
1 1 1 5  0  22 o 15 78.5885 2.05075 109.882     8.05166  109.882     8.05166  21.7881    240         54.8418     240         
1 1 1 5  0  23 o 2  469.426 4.56662 3907.63     107.383  3907.63     107.383  502.452    300         342.649     300         
1 1 1 5  0  24 o 9  1469.71 12.4629 38356.6     917.637  38356.6     917.637  1104.65    360         129.513     360         
1 1 1 5  0  25 o 13 169.986 2.48411 512.652     21.141   512.652     21.141   13.4642    60          2.65528     240         
1 1 1 5  0  26 o 1  800.816 7.30803 11373.8     293.177  11373.8     293.177  646.475    300         162.842     300         
1 1 1 5  0  27 o 3  664.312 6.11834 7825.5      203.611  7825.5      203.611  669.334    360         402.565     360         
1 1 1 5  0  28 o 4  1000.02 8.62241 17736.4     431.968  17736.4     431.968  716.749    60          26.4835     60          
1 1 1 5  0  29 o 17 146.429 2.29532 380.473     16.8248  380.473     16.8248  22.9436    120         15.0532     300         
1 1 1 5  0  30 o 14 694.592 6.42888 8555.1      223.696  8555.1      223.696  358.513    2.35011e-07 257.13      180         
1 1 1 5  0  31 o 19 847.287 7.34399 12730.4     311.728  12730.4     311.728  612.988    60          39.668      60          
1 1 1 5  0  32 o 9  645.297 5.48355 7382.78     177.272  7382.78     177.272  667.203    120         432.482     120         
1 1 1 5  0  33 o 18 840.601 7.05033 12529.9     296.908  12529.9     296.908  741.06     2.03172e-06 309.33      2.03172e-06 
1 1 1 5  0  34 o 16 567.044 4.79506 5700.54     136.217  5700.54     136.217  332.127    60          125.411     240         
1 1 1 5  0  35 o 12 564.026 4.86124 5640.18     137.36   5640.18     137.36   606.229    300         428.503     300         
1 1 1 5  0  36 o 13 897.37  7.5145  14281.1     337.828  14281.1     337.828  663.587    360         82.3218     360         
1 1 1 5  0  37 o 12 238.192 3.01603 1006.3      35.9757  1006.3      35.9757  178.289    240         50.3686     240         
1 1 1 5  0  38 o 14 136.873 2.2864  332.505     15.6632  332.505     15.6632  13.1319    300         98.2262     120         
1 1 1 5  0  39 f 0  305.899 3.29149 1659.31     50.4318  1659.31     50.4318  120.928    0           0           0           
1 1 1 5  0  40 o 13 678.665 6.58422 8169.74     223.839  8169.74     223.839  460.304    240         12.9738     60          
1 1 1 5  0  41 o 18 98.7011 2.448   173.258     12.0748  173.258     12.0748  23.5213    300         139.286     300         
1 1 1 5  0  42 o 12 176.21  2.70438 550.988     23.856   550.988     23.856   43.3073    2.97474e-06 153.301     180         
1 1 1 5  0  43 o 9  734.738 7.45951 9580.49     274.538  9580.49     274.538  510.651    240         17.5165     240         
1 1 1 5  0  44 o 10 293.702 3.8274  1530.38     56.2908  1530.38     56.2908  212.251    120         24.2238     120         
1 1 1 5  0  45 o 7  81.463  2.9074  118.5       11.8     118.5       11.8     7.4087     8.71208e-06 80.0704     8.71208e-06 
1 1 1 5  0  46 o 10 541.974 5.72271 5212.29     155.354  5212.29     155.354  389.69     60          44.3872     60          
1 1 1 5  0  47 o 13 54.8168 2.54637 53.9365     6.92489  53.9365     6.92489  26.1296    300         80.0403     300         
1 1 1 5  0  48 o 5  183.081 2.86681 594.914     26.2737  594.914     26.2737  103.801    180         38.9798     8.65081e-06 
1 1 1 5  0  49 o 19 351.11  3.80489 2186.89     66.9138  2186.89     66.9138  325.379    60          178.341     60          
1 1 1 5  0  50 o 13 60.2889 2.99529 65.3708     8.94525  65.3708     8.94525  17.447     120         68.0264     120         
1 1 1 5  0  51 o 2  199.233 2.78457 704.336     27.7777  704.336     27.7777  112.982    4.24476e-06 40.6024     180         
1 1 1 5  0  52 o 5  244.469 3.05193 1060.33     37.364   1060.33     37.364   161.9      240         2.38834     59.9997     
1 1 1 5  0  53 o 1  133.872 2.99547 318.619     20.0506  318.619     20.0506  66.1206    120         45.5868     300         
1 1 1 5  0  54 o 3  6.44322 3.11534 -2.04033    3.16764  -2.04033    3.16764  46.2123    180         93.0662     180         
1 1 1 5  0  55 o 15 453.832 4.35985 3654.91     99.1168  3654.91     99.1168  278.807    60          42.5754     240         
1 1 1 5  0  56 f 0  37.0549 3.1512  25.3772     5.62759  25.3772     5.62759  42.8084    120         0           0           
1 1 1 5  0  57 o 19 105.302 2.63492 197.283     13.8653  197.283     13.8653  60.296     180         30.5734     180         
1 1 1 5  0  58 o 11 113.606 2.61332 229.498     14.8427  229.498     14.8427  66.2281    60          13.2581     240         
1 1 1 5  0  59 o 16 21.0562 5.21834 10.3026     4.98714  10.3026     4.98714  32.9121    120         71.4226     120         
1 1 1 5  0  60 o 4  29.5004 5.49641 18.3116     7.02039  18.3116     7.02039  23.206     180         56.0725     180         
1 1 1 5  0  61 o 19 303.629 3.36825 1635.98     51.2233  1635.98     51.2233  258.346    240         122.794     240         
1 1 1 5  0  62 o 4  16.2963 5.49344 6.92014     5.12951  6.92014     5.12951  7.0517     300         14.9067     300         
1 1 1 5  0  63 o 7  44.392  3.41288 36.1709     7.36509  36.1709     7.36509  10.2584    8.61339e-06 53.0196     8.61339e-06 
1 1 1 5  0  64 o 1  166.459 2.80569 492.166     23.3749  492.166     23.3749  141.588    60          69.4841     60          
1 1 1 5  0  65 o 6  410.514 4.79666 2996.05     98.6187  2996.05     98.6187  305.841    120         86.4911     120         
1 1 1 5  0  66 o 12 136.031 2.42505 328.737     16.508   328.737     16.508   75.3203    2.87419e-07 22.7609     180         
1 1 1 5  0  67 o 9  15.7319 6.0259  6.2301      6.65325  6.2301      6.65325  14.9582    240         32.9141     240         
1 1 1 5  0  68 o 15 224.413 2.9834  894.6       33.5253  894.6       33.5253  152.562    300         21.1699     300         
1 1 1 5  0  69 f 0  217.624 2.79765 841.251     30.4885  841.251     30.4885  119.847    180         0           0           
1 1 1 5  0  70 o 1  238.924 3.27781 1015.03     39.2133  1015.03     39.2133  166.231    60          32.4453     60          
1 1 1 5  0  71 o 4  118.918 2.53976 251.665     15.1043  251.665     15.1043  70.9541    300         6.83597     120         
1 1 1 5  0  72 o 17 56.3774 3.90848 58.1651     10.782   58.1651     10.782   18.8564    8.38814e-06 30.1622     180         
1 1 1 5  0  73 o 5  38.4067 4.29888 28.158      7.65446  28.158      7.65446  5.5698     60          25.6982     240         
1 1 1 5  0  74 o 17 58.6267 3.09695 62.1199     8.97946  62.1199     8.97946  42.9306    300         18.0014     300         
1 1 1 5  0  75 o 4  190.336 2.81356 644.807     26.8107  644.807     26.8107  125.645    360         17.0246     360         
1 1 1 5  0  76 o 18 74.4009 2.77686 99.2458     10.2874  99.2458     10.2874  29.7594    240         31.672      60          
1 1 1 5  0  77 o 4  150.244 2.99705 402.797     22.5253  402.797     22.5253  100.431    300         17.4888     300         
1 1 1 5  0  78 o 16 24.4092 6.58719 14.5678     7.59165  14.5678     7.59165  2.79364    8.40177e-06 9.09482     180         
1 1 1 5  0  79 o 5  193.125 3.05477 665.75      29.5316  665.75      29.5316  135.315    60          36.945      60          
1 1 1 5  0  80 o 8  11.4892 5.21247 0.393535    6.80965  0.393535    6.80965  1.8544     120         4.66655     120         
1 1 1 5  0  81 o 1  29.0735 6.96957 19.7799     9.09103  19.7799     9.09103  3.55734    6.25995e-05 0.609922    6.25995e-05 
1 1 1 5  0  82 o 11 14.2476 6.1531  3.41393     8.32744  3.41393     8.32744  1.33524    60.0001     4.63066     60.0001     
1 1 1 5  0  83 o 15 16.2772 6.63966 6.26568     8.72771  6.26568     8.72771  0.116232   120         1.11554     120         
1 1 1 5  0  84 o 7  15.3297 6.49224 4.77965     8.90121  4.77965     8.90121  1.59281    8.67812e-06 10.3998     8.67811e-06 
1 1 1 5  0  85 o 2  12.3921 5.75185 -0.933675   8.97004  -0.933675   8.97004  1.68674    240         5.88057     240         
1 1 1 5  0  86 o 15 27.0108 7.61343 18.7166     9.9693   18.7166     9.9693   7.71405    120         15.0628     300         
1 1 1 5  0  87 o 5  15.909  7.07462 3.37318     11.83    3.37318     11.83    0.544042   8.59159e-06 6.7815      8.59158e-06 
1 1 1 5  0  88 o 12 15.3051 7.23579 -3.26387    15.301   -3.26387    15.301   0.0544726  59.9998     0.357465    59.9998     
1 1 1 5  0  89 o 13 22.6093 9.85628 11.5722     21.8318  11.5722     21.8318  3.74035    300         9.84975     120         
1 1 1 5  0  90 x 3  ?       ?       ?           ?        ?           ?        12.9566    360         0           0           
1 1 1 5  0  91 x 1  ?       ?       ?           ?        ?           ?        19.7743    60          0           0           
1 1 1 5  0  92 x 8  ?       ?       ?           ?        ?           ?        19.6212    120         0           0           
1 1 1 5  0  93 x 14 ?       ?       ?           ?        ?           ?        16.0576    180         0           0           
1 1 1 5  0  94 x 2  ?       ?       ?           ?        ?           ?        13.3104    60          0           0           
1 1 1 5  0  95 x 15 ?       ?       ?           ?        ?           ?        16.3583    300         0           0           
1 1 1 5  0  96 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 5  1  0  o 1  978.018 8.85987 16966.3     434.084  16966.3     434.084  898.331    180         390.167     180         
1 1 1 5  1  1  o 18 419.791 3.8718  3198.77     84.5893  3048.3      78.3112  314.354    129.849     101.316     129.849     
1 1 1 5  1  2  o 16 1098.66 12.2995 20916.3     739.806  21963.5     604.046  794.446    160.966     28.8242     160.966     
1 1 1 5  1  3  o 8  184.562 2.5215  595.328     21.3126  611.916     25.2176  3.92139    170.029     121.675     350.029     
1 1 1 5  1  4  o 15 380.246 3.848   2498.07     77.8104  2627.52     68.254   277.548    220.416     163.329     220.416     
1 1 1 5  1  5  o 17 1007.43 9.42331 17982.9     440.464  18031.5     508.668  670.44     176.421     87.5447     356.421     
1 1 1 5  1  6  o 9  670.276 5.54122 8018.97     186.126  7909.2      186.13   529.052    82.346      132.015     82.346      
1 1 1 5  1  7  o 17 618.47  5.13677 6863.21     159.2    6697.35     159.201  525.245    217.478     208.03      217.478     
1 1 1 5  1  8  f 0  1458.14 23.5704 38332.8     1842.23  37685.5     1595.39  896.246    170.132     0           0           
1 1 1 5  1  9  o 10 210.049 2.43474 778.653     25.6273  784.96      25.6306  40.001     192.882     114.053     12.882      
1 1 1 5  1  10 x 3  ?       ?       ?           ?        ?           ?        1400.8     279.425     0           0           
1 1 1 5  1  11 o 8  464.178 4.02027 3839.45     93.5162  3797.92     93.5196  311.109    357.736     0.161014    357.736     
1 1 1 5  1  12 o 3  1161.17 10.2103 24234.2     541.739  23642.4     641.069  770.572    347.541     107.597     167.541     
1 1 1 5  1  13 o 16 1469.94 16.5234 38470.4     1217.15  38525.9     1217.24  1185.79    166.5       281.301     166.5       
1 1 1 5  1  14 o 3  195.817 2.36723 666.405     22.7966  692.666     23.6658  31.1697    316.937     124.153     136.937     
1 1 1 5  1  15 o 6  746.689 6.20319 9965.9      227.732  9810.01     236.351  467.145    26.2866     112.655     206.287     
1 1 1 5  1  16 o 4  686.671 5.76048 8424.05     194.482  8299.72     201.845  408.973    356.737     141.984     176.737     
1 1 1 5  1  17 f 0  568.233 4.86833 5798.89     135.993  5651.47     141.141  290.83     24.33       0           0           
1 1 1 5  1  18 o 13 416.307 3.76583 3156.79     77.0343  2988.52     79.9468  200.502    216.187     162.769     36.1866     
1 1 1 5  1  19 o 18 274.26  2.90606 1361.24     38.3338  1305.21     41.4123  93.7688    47.4699     160.724     227.47      
1 1 1 5  1  20 o 3  158.801 2.22166 456.647     17.6739  437.212     17.6805  14.96      313.018     73.6393     133.018     
1 1 1 5  1  21 o 12 283.305 2.90746 1416.25     41.2737  1428.64     41.2835  97.4513    203.828     171.233     23.8277     
1 1 1 5  1  22 o 4  445.108 4.01591 3478.75     89.5684  3545.12     89.5854  337.252    162.135     78.168      162.135     
1 1 1 5  1  23 o 16 380.351 3.70217 2546.92     70.5604  2581.29     70.5712  259.896    183.294     16.8342     183.294     
1 1 1 5  1  24 o 13 321.37  3.28497 1841.41     52.9025  1819.27     52.9062  220.843    271.901     31.9335     271.901     
1 1 1 5  1  25 o 3  418.441 3.93108 3108.25     82.431   3098.2      82.437   300.975    156.489     40.5728     156.489     
1 1 1 5  1  26 o 12 370.114 3.61691 2421.36     67.0831  2433.92     67.0891  342.761    102.446     242.924     102.446     
1 1 1 5  1  27 o 3  538.142 4.85463 5042.07     130.899  5224.66     130.915  309.596    211.829     123.446     31.8292     
1 1 1 5  1  28 o 6  265.701 2.88599 1287.39     39.2005  1215.11     37.6606  189.252    215.934     60.7962     215.934     
1 1 1 5  1  29 o 14 360.442 3.48371 2290.37     64.1642  2314.24     61.6506  192.934    104.832     98.4368     284.832     
1 1 1 5  1  30 o 13 552.873 5.0175  5435.33     144.717  5400.28     133.115  361.92     252.414     36.3172     72.4137     
1 1 1 5  1  31 o 5  543.643 4.97301 5205.98     140.98   5270.95     129.682  459.861    184.454     179.5       184.454     
1 1 1 5  1  32 o 7  788.579 6.93794 10985.8     262.547  11066.6     285.416  463.806    196.104     165.87      16.1042     
1 1 1 5  1  33 o 3  575.03  5.00732 5909.99     144.294  5812.2      144.292  550.031    75.8        321.864     75.8        
1 1 1 5  1  34 f 0  251.859 2.73107 1126.27     35.1554  1121.83     33.775   156.936    319.591     0           0           
1 1 1 5  1  35 o 11 744.796 6.27818 9827.29     234.322  9843.12     234.341  545.924    114.98      69.0159     114.98      
1 1 1 5  1  36 o 4  1020.81 8.81949 18201       432.189  18780       469.884  798.665    145.836     191.292     145.836     
1 1 1 5  1  37 o 5  247.86  2.85996 1118.1      37.1413  1059.64     33.9013  138.527    61.6642     22.5066     241.664     
1 1 1 5  1  38 o 13 899.702 8.84386 14269.2     409.025  14463.1     388.041  710.846    237.497     191.078     237.497     
1 1 1 5  1  39 o 4  311.729 3.56746 1745.26     53.0683  1699.41     58.1996  82.2098    65.0974     247.285     245.097     
1 1 1 5  1  40 o 11 470.817 5.05262 3998.71     119.271  3862.19     119.133  338.113    261.702     46.4972     261.702     
1 1 1 5  1  41 o 7  214.464 2.86122 829.156     28.5839  801.235     32.7034  144.746    84.5862     47.9604     84.5862     
1 1 1 5  1  42 o 14 999.702 9.46128 17927.8     474.022  17594.2     473.953  697.897    45.565      32.4032     45.565      
1 1 1 5  1  43 o 9  781.807 7.61545 11144.6     306.345  10565.9     290.449  617.762    80.1612     175.265     80.1612     
1 1 1 5  1  44 o 17 237.798 2.84142 992.373     34.2495  1012.19     33.4582  190.438    29.1457     91.1694     29.1457     
1 1 1 5  1  45 o 5  74.5765 2.25756 98.5267     8.5182   98.9652     8.31551  9.61705    22.3458     60.6076     22.3458     
1 1 1 5  1  46 o 15 580.047 5.24437 5910.9      155.679  6029.42     149.065  433.61     181.045     87.9457     181.045     
1 1 1 5  1  47 o 2  146.762 2.51963 385.481     18.5019  378.083     18.5591  77.5608    37.5751     12.1439     217.575     
1 1 1 5  1  48 o 14 291.696 3.61318 1536.21     55.7302  1481.76     49.8339  186.34     354.329     7.93223     174.329     
1 1 1 5  1  49 f 0  203.855 3.22174 709.033     31.8296  765.218     34.0083  128.715    255.138     0           0           
1 1 1 5  1  50 f 0  302.563 3.74865 1693.21     50.376   1555.71     62.1185  212.519    57.5726     0           0           
1 1 1 5  1  51 o 1  43.6556 2.96294 35.228      6.51118  32.9942     6.29417  20.6721    7.78093     56.398      7.78093     
1 1 1 5  1  52 o 3  642.279 7.0891  7342.65     213.611  7339.23     241.851  432.514    68.1347     11.8156     68.1345     
1 1 1 5  1  53 o 11 130.659 3.00932 310.156     17.3015  296.036     21.6927  85.0876    168.11      17.5481     168.11      
1 1 1 5  1  54 o 3  258.252 3.75424 1225.04     50.6589  1142.4      46.5284  138.448    243.276     58.9023     63.276      
1 1 1 5  1  55 o 1  256.39  3.62027 1180.04     43.8695  1152.7      48.9579  157.72     237.86      15.8937     57.86       
1 1 1 5  1  56 o 2  271.825 3.80076 1360.11     53.5341  1263.39     50.0332  206.182    302.654     63.4581     302.654     
1 1 1 5  1  57 o 14 85.7995 2.56843 130.334     10.8154  131.203     11.2194  31.9183    160.15      2.40681     340.15      
1 1 1 5  1  58 f 0  51.8685 2.27897 42.4681     5.88035  53.6247     5.83953  39.8918    253.866     0           0           
1 1 1 5  1  59 o 7  139.966 2.76591 359.697     20.5885  335.955     18.1649  52.4912    81.5399     66.7971     261.54      
1 1 1 5  1  60 o 11 226.557 3.16304 938.642     37.9974  883.141     33.8072  187.864    310.787     93.9771     310.787     
1 1 1 5  1  61 o 7  96.856  2.71124 172.493     14.1209  160.916     12.128   30.287     258.513     49.7521     78.5133     
1 1 1 5  1  62 o 15 153.938 2.67328 419.92      21.5654  421.044     19.6118  90.5848    40.4128     6.58845     220.413     
1 1 1 5  1  63 o 16 151.617 2.68689 399.721     21.8885  416.329     18.7236  65.3155    299.46      57.0785     119.46      
1 1 1 5  1  64 o 8  71.0471 2.73132 94.8862     10.3249  84.9227     9.05787  18.53      186.129     39.1409     6.12905     
1 1 1 5  1  65 o 19 188.911 2.78765 653.58      27.7989  613.634     24.9767  95.769     326.032     45.4565     146.032     
1 1 1 5  1  66 o 15 44.1714 3.43293 40.3005     8.0794   30.2505     6.87353  15.6453    274.101     75.5206     274.101     
1 1 1 5  1  67 o 17 185.33  2.76682 603.723     27.6149  616.29      23.5752  124.207    18.1331     18.5604     18.1331     
1 1 1 5  1  68 o 12 113.039 2.54696 237.993     15.2635  216.543     13.5618  62.9977    162.331     9.44847     342.331     
1 1 1 5  1  69 o 15 225.031 2.94718 931.159     34.9745  870.109     31.4953  148.914    297.032     17.8725     297.032     
1 1 1 5  1  70 o 2  77.5483 2.85111 99.4405     11.4984  115.333     10.4275  31.5961    157.125     26.0545     337.125     
1 1 1 5  1  71 o 6  18.8606 4.63412 8.872       6.07119  2.19882     5.03375  18.5447    31.4675     44.9667     31.4675     
1 1 1 5  1  72 o 7  53.0221 3.15747 53.5307     8.96253  47.4793     7.66566  18.485     38.2045     13.7437     218.205     
1 1 1 5  1  73 o 14 82.1601 2.80753 120.436     12.7516  120.575     10.1413  41.8319    176.076     11.5951     356.076     
1 1 1 5  1  74 o 4  48.5246 2.97321 49.194      8.0749   35.934      6.28005  21.3154    56.1687     7.80508     236.169     
1 1 1 5  1  75 o 8  114.431 2.45224 253.675     15.5123  213.964     12.6003  77.139     269.683     16.5147     269.683     
1 1 1 5  1  76 o 14 17.2489 4.88233 0.0400459   7.13975  4.47837     5.97695  4.20658    198.178     14.3976     198.178     
1 1 1 5  1  77 o 8  76.906  3.03487 111.388     12.9534  101.045     10.2984  38.6622    182.587     13.2924     2.5868      
1 1 1 5  1  78 o 5  54.409  3.56484 60.5875     10.2873  47.1992     8.93801  31.1758    160.933     1.85942     160.933     
1 1 1 5  1  79 o 13 103.714 2.83461 201.929     15.6496  183.973     13.7636  65.1641    217.285     7.34864     217.285     
1 1 1 5  1  80 o 5  41.565  4.19747 35.323      9.15201  28.7166     7.85558  12.1753    49.1897     21.3151     229.19      
1 1 1 5  1  81 o 15 24.6169 5.58841 10.9927     8.0582   11.1303     7.57462  0.260315   281.857     22.883      281.857     
1 1 1 5  1  82 o 18 41.8279 5.02762 43.9321     9.70744  23.4335     10.0509  22.3128    192.798     0.708649    192.798     
1 1 1 5  1  83 o 9  16.4776 4.96327 4.4241      7.38809  -8.39113    8.23787  0.58863    286.594     5.98792     286.594     
1 1 1 5  1  84 o 3  21.4232 5.76949 11.8224     9.44996  -1.00122    8.80871  2.66259    265.965     11.6976     85.965      
1 1 1 5  1  85 o 6  82.0173 3.65933 148.49      15.4641  100.177     14.2209  53.9101    228.752     13.3754     228.752     
1 1 1 5  1  86 o 2  25.5716 6.22168 18.6225     10.3691  3.16562     10.4889  7.93334    107.358     0.135641    107.358     
1 1 1 5  1  87 o 13 54.8372 6.6353  68.7438     18.6506  52.9589     16.5197  21.1683    161.458     19.1585     341.458     
1 1 1 5  1  88 o 2  38.5303 9.2356  27.2436     19.0181  39.6216     23.5093  11.5827    53.212      17.275      233.212     
1 1 1 5  1  89 o 9  24.3842 7.68095 0.440896    16.1244  -0.566946   21.7157  4.1527     164.644     3.18667     344.644     
1 1 1 5  1  90 x 8  ?       ?       ?           ?        ?           ?        24.7913    183.016     0           0           
1 1 1 5  1  91 x 10 ?       ?       ?           ?        ?           ?        25.8264    335.233     0           0           
1 1 1 5  1  92 x 13 ?       ?       ?           ?        ?           ?        28.9285    268.839     0           0           
1 1 1 5  1  93 x 10 ?       ?       ?           ?        ?           ?        23.4295    201.948     0           0           
1 1 1 5  1  94 x 18 ?       ?       ?           ?        ?           ?        24.8191    251.971     0           0           
1 1 1 5  1  95 x 2  ?       ?       ?           ?        ?           ?        12.483     70.0216     0           0           
1 1 1 5  1  96 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 5  2  0  o 10 263.947 3.08933 1235.48     40.8387  1235.48     40.8387  137.238    2.2519e-05  11.7415     180         
1 1 1 5  2  1  o 14 410.344 4.04666 3015.84     85.022   2952.66     81.4015  296.204    277.913     70.6833     277.913     
1 1 1 5  2  2  o 11 661.467 6.16695 7846.96     213.622  7667.38     195.003  436.392    303.029     48.5505     123.029     
1 1 1 5  2  3  o 10 866.448 8.15249 13393.3     327.597  13237.4     378.258  713.859    106.296     210.328     106.296     
1 1 1 5  2  4  o 12 944.831 9.34664 15805.8     476.14   15871.5     406.032  690.686    122.472     44.9458     122.472     
1 1 1 5  2  5  o 1  366.457 3.80333 2374.98     69.8458  2384.86     69.8478  219.92     110.014     25.9237     290.014     
1 1 1 5  2  6  o 13 525.436 4.72834 4943.4      121.963  4843.7      126.938  465.925    262.436     241.21      262.436     
1 1 1 5  2  7  o 5  426.388 3.99045 3265.71     83.519   3178.82     86.926   200.637    313.378     173.752     133.378     
1 1 1 5  2  8  o 13 1429.09 22.1543 37076.2     1370.87  35908.6     1769.58  1290.73    6.5406      547.711     6.5406      
1 1 1 5  2  9  f 0  114.88  2.13417 233.348     12.0286  234.677     12.5198  143.821    242.331     0           0           
1 1 1 5  2  10 o 5  843.796 7.099   12577.8     288.449  12676.2     311.569  711.276    123.862     239.626     123.862     
1 1 1 5  2  11 o 17 296.31  3.02111 1558.92     43.0975  1552.9      46.552   179.253    77.9484     56.6403     77.9484     
1 1 1 5  2  12 o 18 452.631 4.09602 3648.59     89.2469  3613.97     96.4012  268.181    214.233     75.5249     34.2333     
1 1 1 5  2  13 o 12 677.836 5.81369 8194.83     189.688  8099.28     204.897  408.142    75.2226     131.946     255.223     
1 1 1 5  2  14 o 5  1100.58 9.32831 21595.7     504.046  21418.8     524.651  852.804    116.092     147.499     116.092     
1 1 1 5  2  15 o 4  340.71  3.37833 2098.21     54.0409  2017        60.9635  44.0914    164.191     371.039     344.191     
1 1 1 5  2  16 o 19 465.96  4.26601 3880.25     97.5806  3817.84     101.574  346.995    78.2211     68.7679     78.2211     
1 1 1 5  2  17 o 8  275.045 2.88446 1335.59     38.2023  1345.83     41.2666  114.256    322.152     114.282     142.152     
1 1 1 5  2  18 o 14 231.428 2.7012  948.096     29.389   950.264     33.1577  107.073    123.554     19.1249     303.554     
1 1 1 5  2  19 o 15 312.332 3.13892 1723.79     47.2056  1734.11     50.9946  220.074    4.32843     65.1321     4.32843     
1 1 1 5  2  20 o 15 159.219 2.23032 447.668     17.095   450.798     18.4748  18.5639    353.659     63.1414     173.659     
1 1 1 5  2  21 f 0  564.582 4.88452 5648.92     132.766  5653.95     143.434  472.706    12.3888     0           0           
1 1 1 5  2  22 o 19 332.406 3.38151 1968.32     56.3274  1948.33     56.3318  171.434    15.5953     95.5741     195.595     
1 1 1 5  2  23 o 12 295.215 3.06668 1556.37     44.4419  1532.65     46.2636  103.713    328.324     181.271     148.324     
1 1 1 5  2  24 o 1  360.707 3.56785 2323.12     64.4902  2288.68     64.4958  302.058    354.1       146.535     354.1       
1 1 1 5  2  25 o 3  259.169 2.77964 1180.72     36.8061  1199.84     35.3705  114.439    8.99096     101.478     188.991     
1 1 1 5  2  26 o 15 523.712 4.68239 4863.31     125.315  4859.34     120.421  444.529    218.112     175.992     218.112     
1 1 1 5  2  27 f 0  1136.38 9.39198 22698.6     554.76   23123.3     513.755  865.112    1.34124     0           0           
1 1 1 5  2  28 o 18 366.475 3.49995 2378.13     65.5444  2381.92     62.9854  189.686    267.67      115.018     87.6704     
1 1 1 5  2  29 o 3  287.836 2.93724 1454.02     43.9416  1482.28     40.6996  152.065    50.574      71.7357     230.574     
1 1 1 5  2  30 o 14 506.112 4.72317 4528.85     122.359  4551.02     117.163  220.018    99.5577     257.567     279.558     
1 1 1 5  2  31 f 0  627.372 5.99449 6903.71     192.842  7051.68     183.876  433.029    283.337     0           0           
1 1 1 5  2  32 o 7  506.066 4.97653 4535.43     123.175  4543.39     129.179  380.613    118.474     71.4965     118.474     
1 1 1 5  2  33 o 1  299.039 3.42    1562.31     51.2508  1607.3      51.2461  168.632    175.349     54.3339     355.349     
1 1 1 5  2  34 o 19 253.998 3.3377  1146.23     42.4913  1140.36     42.4791  93.3095    221.214     141.43      41.2139     
1 1 1 5  2  35 o 19 428.139 4.69251 3297.07     100.684  3201.34     100.664  270.311    163.344     34.4166     343.344     
1 1 1 5  2  36 o 5  903.53  8.83833 14528.7     389.507  14443       410.543  698.223    320.35      154.219     320.35      
1 1 1 5  2  37 o 6  706.775 7.00688 8954.72     241.493  8764.96     254.534  490.56     270.397     16.2337     270.397     
1 1 1 5  2  38 o 11 563.992 5.71191 5676.56     157.113  5603.47     165.598  307.398    231.836     151.048     51.8362     
1 1 1 5  2  39 o 11 374.866 3.84848 2477.88     72.2976  2503.61     72.2969  220.437    351.117     55.5433     171.117     
1 1 1 5  2  40 o 14 219.359 2.80596 842.93      30.8433  862.627     30.8456  113.346    3.51981     41.0673     183.52      
1 1 1 5  2  41 o 9  309.757 3.38338 1668.6      52.5052  1732.98     52.5226  239.274    284.547     81.1873     284.547     
1 1 1 5  2  42 o 13 532.755 5.15493 5025.68     134.319  5041.44     140.871  320.343    296.596     79.8298     116.596     
1 1 1 5  2  43 o 19 309.392 3.4437  1662.41     51.6044  1731.6      55.1806  260.213    267.104     123.279     267.104     
1 1 1 5  2  44 o 17 341.446 3.64761 2062.93     63.5097  2070.81     61.2968  257.158    311.603     65.154      311.603     
1 1 1 5  2  45 o 14 461.807 4.77273 3752.03     115.452  3813.9      105.126  311.866    302.275     4.70601     302.276     
1 1 1 5  2  46 o 18 365.227 4.13372 2355.24     77.6084  2376.1      73.6401  272.892    232.485     62.5899     232.485     
1 1 1 5  2  47 o 9  221.333 3.15391 863.183     34.9745  873.855     34.9906  174.888    157.163     77.3962     157.163     
1 1 1 5  2  48 o 2  87.8854 2.71472 128.336     12.5638  146.324     11.108   7.93429    304.279     104.018     304.279     
1 1 1 5  2  49 o 5  255.966 3.62117 1176.72     43.3725  1147.34     49.261   141.522    45.6285     48.5455     225.629     
1 1 1 5  2  50 o 14 192.653 2.9763  652.508     30.28    663.641     27.0715  141.541    212.31      49.4096     212.31      
1 1 1 5  2  51 o 6  381.752 4.52756 2690.83     97.2976  2484.35     75.3048  258.252    191.881     13.0927     191.881     
1 1 1 5  2  52 o 6  398.582 4.62672 2854.82     100.327  2785.78     83.9668  328.137    325.264     132.135     325.264     
1 1 1 5  2  53 o 12 477.614 5.29866 4092.86     109.735  4012.59     141.561  324.32     2.56515     17.2869     2.56515     
1 1 1 5  2  54 o 13 270.752 3.71066 1324.64     53.9066  1276.93     46.6472  195.983    91.8738     41.4042     91.8738     
1 1 1 5  2  55 o 4  80.7212 2.42345 114.78      9.77317  116.685     9.78889  24.8732    219.896     23.5976     39.8958     
1 1 1 5  2  56 o 4  734.496 7.28999 9699.35     275.436  9534.58     261.148  525.549    145.074     85.3315     145.074     
1 1 1 5  2  57 o 3  308.892 3.5774  1702.18     55.4872  1684.19     55.268   184.432    97.6625     31.1599     277.663     
1 1 1 5  2  58 o 2  171.127 2.74539 535.662     24.2483  503.309     22.8456  94.3989    261.681     24.3401     81.6811     
1 1 1 5  2  59 f 0  181.812 2.82475 598.205     25.0956  574.513     26.3313  103.944    238.872     0           0           
1 1 1 5  2  60 o 18 200.065 3.01702 718.228     28.5632  701.978     31.8069  124.929    82.4408     1.03747     262.441     
1 1 1 5  2  61 o 12 208.568 3.04544 792.4       30.0259  751.504     33.4379  145.615    130.111     30.4435     130.111     
1 1 1 5  2  62 o 17 155.038 2.73666 400.064     21.2002  453.894     21.2437  97.2589    107.502     5.53861     107.502     
1 1 1 5  2  63 o 7  359.889 3.95307 2330.48     69.3816  2272.87     73.1054  224.156    116.471     11.8312     296.471     
1 1 1 5  2  64 f 0  163.823 2.90081 465.41      21.6045  487.792     25.8963  84.5331    283.421     0           0           
1 1 1 5  2  65 o 17 258.757 3.21025 1169.58     40.3872  1209.1      42.8657  198.893    140.06      71.768      140.06      
1 1 1 5  2  66 o 9  197.451 2.98344 715.105     28.5416  670.232     30.3883  125.396    258.632     4.07996     258.632     
1 1 1 5  2  67 o 13 231.889 3.08978 951.763     34.8151  959.497     36.9728  123.799    37.4347     43.6142     217.435     
1 1 1 5  2  68 o 3  212.971 2.88242 780.05      28.1983  832.494     33.2594  130.426    321.253     4.83939     141.252     
1 1 1 5  2  69 o 14 135.674 2.62242 336.09      17.3642  318.678     18.2197  86.1451    219.729     7.3686      219.729     
1 1 1 5  2  70 o 10 173.215 2.61511 538.696     22.751   528.047     22.6493  106.58     94.4141     0.24955     274.414     
1 1 1 5  2  71 o 5  79.3753 2.76183 111.763     10.9956  112.982     10.9081  3.86668    70.1032     86.7091     250.103     
1 1 1 5  2  72 o 15 105.953 2.59042 200.716     13.7836  199.213     13.6839  61.7366    275.233     1.84424     95.2333     
1 1 1 5  2  73 o 19 70.4837 3.07774 91.4995     10.8393  86.384      10.7914  28.9295    8.98749     23.1329     188.987     
1 1 1 5  2  74 o 12 86.8937 2.91112 142.697     12.69    127.411     12.5665  49.719     291.092     3.62211     111.092     
1 1 1 5  2  75 o 10 112.846 2.72171 247.657     16.3466  207.896     14.4121  84.4644    38.6138     33.6526     38.6138     
1 1 1 5  2  76 o 19 20.3866 4.96959 10.4946     6.92772  2.91341     5.82308  1.64623    292.508     10.9466     292.508     
1 1 1 5  2  77 o 9  25.3596 5.36561 13.3821     7.39668  10.415      7.3632   2.67278    111.395     6.79626     291.395     
1 1 1 5  2  78 o 18 67.0732 2.8639  91.9312     10.178   70.3775     8.97789  35.141     202.016     7.58337     22.0159     
1 1 1 5  2  79 o 3  161.182 2.76985 473.785     22.6833  456.196     22.0652  120.362    87.4181     47.5779     87.4181     
1 1 1 5  2  80 o 7  39.5573 4.07776 31.5939     8.52165  26.3562     7.18645  3.56938    275.941     36.9729     95.9408     
1 1 1 5  2  81 o 1  60.1599 4.75404 70.8008     10.9892  63.2236     16.124   29.9389    349.472     8.79407     169.472     
1 1 1 5  2  82 o 1  75.0979 3.34017 101.83      12.0892  102.349     12.9116  54.2439    356.237     22.3944     356.237     
1 1 1 5  2  83 o 16 83.4354 3.5711  104.37      12.9172  151.034     16.8949  55.3768    328.01      13.907      328.01      
1 1 1 5  2  84 o 5  39.913  5.1158  22.9095     9.27607  39.0314     10.3559  21.6563    198.559     0.945286    198.559     
1 1 1 5  2  85 o 19 28.2216 5.8929  1.6244      8.40005  29.3086     11.9436  7.94359    45.7409     12.2839     225.741     
1 1 1 5  2  86 o 6  33.5988 6.42742 23.9091     9.50068  21.351      12.9567  5.45848    237.515     25.2126     57.5154     
1 1 1 5  2  87 o 8  58.9648 5.19202 49.443      13.946   86.5603     15.3484  35.7843    278.186     5.93817     278.186     
1 1 1 5  2  88 o 13 26.1652 7.30659 5.77629     16.1442  13.5123     12.8763  4.03088    18.892      16.2003     198.892     
1 1 1 5  2  89 o 18 40.6477 8.8995  13.0381     17.926   64.4613     25.4704  16.3595    328.588     9.0535      148.588     
1 1 1 5  2  90 o 1  60.2275 21.3884 0           0        123.633     57.281   20.2776    349.735     22.9554     169.735     
1 1 1 5  2  91 x 11 ?       ?       ?           ?        ?           ?        5.21606    119.956     0           0           
1 1 1 5  2  92 x 10 ?       ?       ?           ?        ?           ?        5.96169    220.846     0           0           
1 1 1 5  2  93 x 3  ?       ?       ?           ?        ?           ?        12.8956    19.6715     0           0           
1 1 1 5  2  94 x 2  ?       ?       ?           ?        ?           ?        22.6851    132.34      0           0           
1 1 1 5  2  95 x 4  ?       ?       ?           ?        ?           ?        7.47423    212.14      0           0           
1 1 1 5  2  96 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 5  3  0  o 1  273.801 3.12386 1329.41     42.8383  1329.41     42.8383  132.396    180         103.486     2.15484e-05 
1 1 1 5  3  1  o 18 437.832 4.2585  3386.53     95.439   3408.5      91.3795  225.299    242.45      140.709     62.4501     
1 1 1 5  3  2  o 7  166.43  2.51092 493.336     21.8796  488.32      19.9709  1.65028    251.083     88.4465     251.083     
1 1 1 5  3  3  o 12 390.82  4.08255 2738.87     78.0101  2675.33     81.81    114.395    335.892     299.576     155.892     
1 1 1 5  3  4  o 15 478.629 4.67464 4031.38     106.938  4089.64     117.151  307.71     137.39      32.0904     317.39      
1 1 1 5  3  5  o 15 818.291 7.71316 11872       338.133  11880.3     292.821  752.993    141.969     364.134     141.969     
1 1 1 5  3  6  o 13 954.612 8.43409 16132.8     394.621  16200.3     412.188  779.123    183.152     209.268     183.152     
1 1 1 5  3  7  o 1  928.107 8.04837 15436.7     374.332  15124.1     374.319  773.002    175.665     236.722     175.665     
1 1 1 5  3  8  o 16 957.939 8.2931  16348.4     398.12   16211.8     398.118  744.331    238.696     133.716     238.696     
1 1 1 5  3  9  o 8  466.471 4.31058 3814.41     100.759  3899.39     100.768  269.095    275.747     96.3215     95.7473     
1 1 1 5  3  10 o 18 625.225 5.59524 6977.58     175.31   6883.81     175.311  331.744    202.25      210.814     22.25       
1 1 1 5  3  11 o 15 313.822 3.40428 1745.95     53.5398  1744.85     53.5379  174.576    229.207     40.0017     49.2068     
1 1 1 5  3  12 o 15 549.162 4.98271 5382.11     137.128  5311.06     137.123  432.961    16.0221     116.801     16.0221     
1 1 1 5  3  13 o 4  640.916 5.60986 7313.46     176.524  7254.53     183.737  536.31     235.512     188.012     235.512     
1 1 1 5  3  14 o 6  714.06  6.30183 9100.61     225.505  8987.98     225.505  587.907    280.029     181.511     280.029     
1 1 1 5  3  15 o 8  319.455 3.30808 1827.52     52.9576  1790.06     52.9577  190.409    62.7127     21.3579     242.713     
1 1 1 5  3  16 o 12 431.53  3.99827 3374.93     84.6686  3227.99     88.1191  275.735    296.406     29.9914     116.406     
1 1 1 5  3  17 o 6  438.868 4.15215 3453.57     91.3166  3375.61     91.3154  336.567    34.993      88.7967     34.9929     
1 1 1 5  3  18 o 19 299.371 3.1056  1611.77     45.6358  1565.25     47.496   175.919    79.447      22.1521     259.447     
1 1 1 5  3  19 o 13 323.196 3.20979 1874.93     49.9215  1827.87     53.9201  207.433    62.6857     3.1203      62.6859     
1 1 1 5  3  20 o 4  558.507 4.88023 5558.89     131.205  5502.13     141.722  395.392    255.449     20.2376     255.449     
1 1 1 5  3  21 o 19 304.309 3.06685 1629.2      44.9453  1653.17     48.5497  69.9993    187.086     266.18      7.08613     
1 1 1 5  3  22 o 5  200.589 2.55    713.878     24.5405  712.141     26.6793  32.4805    254.324     176.391     74.3236     
1 1 1 5  3  23 o 7  1765.23 15.4295 55403       1334.99  55553.6     1394.32  1329.35    216.974     162.213     216.974     
1 1 1 5  3  24 o 16 513.169 4.40235 4628.82     111.104  4706.43     115.316  375.094    344.622     46.3707     344.622     
1 1 1 5  3  25 o 19 738.561 6.35749 9751.07     230.499  9591.52     239.928  512.947    352.703     5.01227     172.703     
1 1 1 5  3  26 o 5  687.448 6.16519 8333.54     216.911  8422.78     207.728  353.907    273.367     251.986     93.3674     
1 1 1 5  3  27 o 8  306.349 3.16446 1654.91     48.5782  1671.27     48.5854  229.862    68.7211     177.248     68.7211     
1 1 1 5  3  28 o 5  193.701 2.54374 670.907     25.2235  658.801     24.1581  96.6306    187.429     21.3805     187.429     
1 1 1 5  3  29 o 19 1085.18 9.98214 20969       529.724  20821.4     555.588  833.315    157.64      149.81      157.64      
1 1 1 5  3  30 o 11 598.849 5.86767 6428.01     176.092  6286.94     176.078  429.334    336.21      32.8343     336.21      
1 1 1 5  3  31 o 6  293.506 3.45894 1575.73     52.3397  1478.29     49.4267  203.907    148.364     29.9318     148.364     
1 1 1 5  3  32 o 1  381.201 4.16664 2570.02     81.6573  2580.81     77.4741  292.84     255.614     78.6665     255.614     
1 1 1 5  3  33 o 7  486.591 5.02967 4181.27     125.817  4212.47     119.37   215.971    43.9211     234.665     223.921     
1 1 1 5  3  34 o 5  639.784 6.42864 7242.6      211.453  7272.59     200.614  471.558    35.0807     66.3277     35.0807     
1 1 1 5  3  35 o 2  516.772 5.3441  4719.58     134.711  4748.77     142.013  367.51     113.833     35.1767     113.833     
1 1 1 5  3  36 o 5  863.908 8.48273 13151.5     376.699  13333.7     357.402  573.933    110.207     40.9087     290.207     
1 1 1 5  3  37 o 12 874.907 8.3491  13520.2     366.05   13645.4     366.081  662.124    48.1007     124.239     48.1007     
1 1 1 5  3  38 o 12 458.732 4.56159 3736.28     102.33   3724.35     107.334  250.412    329.693     117.244     149.693     
1 1 1 5  3  39 o 18 305.573 3.52319 1618.58     53.937   1691.73     53.9486  144.652    148.063     111.291     328.063     
1 1 1 5  3  40 o 12 299.09  3.47635 1592.09     49.4145  1578.98     54.6431  179.001    22.5268     31.2644     202.527     
1 1 1 5  3  41 o 1  337.807 3.59681 2012.72     59.4215  2032.79     62.3372  219.771    198.082     6.70295     18.082      
1 1 1 5  3  42 o 3  176.718 2.61195 551.591     23.1364  555.335     23.1265  105.928    2.59134     13.2875     2.59134     
1 1 1 5  3  43 o 8  127.433 2.36683 286.99      15.1008  288.991     15.1029  19.552     284.903     106.099     104.903     
1 1 1 5  3  44 o 3  302.456 3.45282 1612.67     53.5578  1630.84     51.0686  210.21     151.08      24.0357     151.08      
1 1 1 5  3  45 o 17 391.588 4.20233 2705.52     86.4599  2733.33     78.2235  252.075    92.0741     18.8408     272.074     
1 1 1 5  3  46 o 3  423.32  4.55713 3141.21     99.1279  3216.83     94.0884  338.074    309.906     113.012     309.906     
1 1 1 5  3  47 o 8  239.233 3.20378 1016.49     39.3921  1012.95     37.4055  97.4885    271.377     117.051     91.3771     
1 1 1 5  3  48 o 11 655.198 7.19755 7607.6      250.596  7660.34     221.017  498.256    188.603     118.356     188.603     
1 1 1 5  3  49 o 10 221.108 3.25286 846.079     33.6993  887.993     38.335   101.205    245.712     82.1572     65.7116     
1 1 1 5  3  50 o 14 369.28  4.65399 2464.87     96.5188  2376.32     74.7209  304.463    353.224     124.548     353.224     
1 1 1 5  3  51 o 2  131.8   2.41847 305.103     16.3938  311.011     15.517   82.8686    359.491     45.7054     359.491     
1 1 1 5  3  52 o 19 172.709 2.7483  529.01      25.6204  528.73      21.8007  72.3575    167.114     76.1768     347.114     
1 1 1 5  3  53 o 15 229.207 3.08535 927.656     32.5087  935.759     38.1681  180.801    80.0923     68.5323     80.0923     
1 1 1 5  3  54 o 3  437.817 4.4116  3443.45     91.7965  3363.09     101.426  306.877    340.558     37.5191     340.558     
1 1 1 5  3  55 o 10 131.466 2.7659  291.134     18.1146  322.793     18.2606  63.5725    326.024     32.1691     146.024     
1 1 1 5  3  56 o 3  555.712 5.59158 5598.84     139.047  5385.46     170.159  441.282    276.3       153.966     276.3       
1 1 1 5  3  57 o 7  276.495 3.35757 1385.74     43.7855  1327.4      48.9868  168.643    289.317     19.39       109.317     
1 1 1 5  3  58 o 15 162.97  2.69915 478.557     20.5585  463.84      23.3706  116.144    71.3151     35.1486     71.3151     
1 1 1 5  3  59 o 9  51.3562 2.79671 38.2416     6.50514  56.7918     7.7573   1.01044    352.017     11.2864     352.017     
1 1 1 5  3  60 o 16 52.5494 3.08077 52.0333     7.54067  46.6994     8.43772  1.52158    218.434     26.8635     218.434     
1 1 1 5  3  61 o 19 89.2038 2.63896 137.722     10.8149  145.098     12.6941  6.45402    263.335     90.9396     83.3351     
1 1 1 5  3  62 o 1  156.771 2.7019  442.991     20.2625  429.368     22.0993  114.595    48.8887     39.9792     48.8887     
1 1 1 5  3  63 f 0  132.279 2.57183 315.799     17.0497  305.573     17.0126  110.379    316.317     0           0           
1 1 1 5  3  64 o 2  111.514 2.59081 224.183     14.4823  217.626     14.4336  74.5651    261.99      19.0045     261.99      
1 1 1 5  3  65 o 17 144.849 2.5971  376.045     18.8597  369.207     18.8136  85.5964    261.325     7.24375     81.3254     
1 1 1 5  3  66 o 16 359.55  3.82014 2293.17     68.8511  2307.41     68.8151  246.526    228.625     37.2342     228.625     
1 1 1 5  3  67 o 9  103.135 2.57001 196.005     13.2991  182.336     13.2154  58.402     281.691     5.16941     101.691     
1 1 1 5  3  68 o 15 204.868 2.77569 733.714     28.5058  758.02      28.4831  108.335    74.5309     39.2791     254.531     
1 1 1 5  3  69 o 4  85.6976 2.56404 126.555     11.1953  134.969     10.7499  40.1217    262.509     19.7948     82.5086     
1 1 1 5  3  70 o 13 123.351 2.4398  268.89      15.6186  272.331     14.486   57.7833    215.552     34.6109     35.5515     
1 1 1 5  3  71 o 18 93.2291 2.50791 159.596     12.0162  150.036     11.3781  48.0878    182.452     13.344      2.45207     
1 1 1 5  3  72 o 6  58.0763 2.81167 56.7056     8.3284   64.0822     7.87764  28.2417    178.933     1.19922     178.933     
1 1 1 5  3  73 o 3  15.7572 4.50299 4.3298      5.91178  -1.28725    5.41243  11.2508    87.8938     27.4558     87.8938     
1 1 1 5  3  74 f 0  57.5001 3.12062 61.2637     9.83647  57.5077     7.95742  40.0001    250.501     0           0           
1 1 1 5  3  75 o 6  35.9639 4.58487 18.978      8.71498  29.3922     6.71207  11.1458    187.439     13.1986     7.43903     
1 1 1 5  3  76 o 11 105.638 2.68786 207.548     15.1466  191.477     13.2611  70.7422    124.063     15.0125     124.063     
1 1 1 5  3  77 o 10 57.0187 3.23869 60.0227     9.7416   57.3008     8.59607  36.8714    252.743     10.6225     252.743     
1 1 1 5  3  78 o 2  74.7403 2.8003  117.124     11.6394  84.6377     9.30496  45.2788    114.49      3.32853     114.49      
1 1 1 5  3  79 o 6  80.6394 2.77674 122.361     11.42    111.121     10.953   37.9553    308.06      19.2391     128.06      
1 1 1 5  3  80 o 8  19.9164 4.99482 4.66787     7.38907  7.4771      5.40136  0.0206703  267.043     6.26975     267.043     
1 1 1 5  3  81 f 0  29.3181 5.22919 14.1544     8.07131  18.6784     7.4036   15.5749    201.454     0           0           
1 1 1 5  3  82 o 1  35.727  5.1793  23.4332     8.72829  25.3503     9.19763  17.848     121.315     0.345184    121.315     
1 1 1 5  3  83 f 0  97.2464 3.60927 164.674     15.1368  179.627     19.7637  60.4623    148.767     0           0           
1 1 1 5  3  84 o 8  81.0718 3.51492 113.156     13.0815  126.828     15.3433  54.2344    346.723     14.7558     346.723     
1 1 1 5  3  85 o 2  38.2053 5.59987 33.2328     9.46359  24.0557     11.21    9.95608    71.5419     22.1888     251.542     
1 1 1 5  3  86 o 18 57.7853 4.52293 63.6904     12.4532  62.1079     13.2688  28.4035    100.108     8.51955     280.108     
1 1 1 5  3  87 o 15 48.6737 5.2933  46.5835     12.6452  45.3575     12.3526  27.9018    129.162     2.86641     129.162     
1 1 1 5  3  88 o 2  29.7938 7.16346 11.9851     12.3     23.3584     13.7114  9.57945    154.57      8.58182     334.57      
1 1 1 5  3  89 o 1  36.7074 9.03768 11.3754     17.2033  50.3155     25.3089  17.9397    100.322     4.24843     100.322     
1 1 1 5  3  90 o 4  38.8734 11.8673 66.6626     55.6008  13.4033     25.9723  16.5361    125.89      5.05979     305.89      
1 1 1 5  3  91 x 11 ?       ?       ?           ?        ?           ?        29.2087    62.8256     0           0           
1 1 1 5  3  92 x 18 ?       ?       ?           ?        ?           ?        14.2135    178.322     0           0           
1 1 1 5  3  93 x 10 ?       ?       ?           ?        ?           ?        14.4024    272.449     0           0           
1 1 1 5  3  94 x 12 ?       ?       ?           ?        ?           ?        14.5616    277.074     0           0           
1 1 1 5  3  95 x 10 ?       ?       ?           ?        ?           ?        9.88774    193.124     0           0           
1 1 1 5  3  96 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 5  4  0  o 17 219.055 2.68454 851.024     29.4503  851.024     29.4503  76.2355    180         42.8549     7.45493e-05 
1 1 1 5  4  1  o 18 692.859 6.27605 8459.44     213.151  8564.22     222.633  467.796    136.908     35.7017     316.908     
1 1 1 5  4  2  o 12 478.28  4.66719 4069.29     116.859  4040.07     106.677  406.56     335.925     186.503     335.925     
1 1 1 5  4  3  o 17 181.676 2.5663  586.948     23.3657  582.811     23.3641  66.7104    352.639     340.848     352.639     
1 1 1 5  4  4  o 15 927.533 8.43531 15242.3     373.876  15285.2     409.546  692.141    43.3677     70.3068     43.3678     
1 1 1 5  4  5  o 5  561.082 5.57406 5521.47     156.724  5641.34     156.727  347.731    70.5708     81.728      250.571     
1 1 1 5  4  6  o 11 229.991 2.83264 917.732     32.641   957.203     32.6451  84         268.094     27.652      88.0944     
1 1 1 5  4  7  f 0  552.037 4.98005 5389.04     137.77   5415.51     137.774  275.859    109.28      0           0           
1 1 1 5  4  8  o 5  458.167 4.56727 3715.23     107.331  3726.78     102.337  362.155    73.6615     117.623     73.6615     
1 1 1 5  4  9  o 7  113.259 2.17378 226.247     12.3261  228.7       12.327   58.6752    89.9023     179.499     89.9023     
1 1 1 5  4  10 o 14 722.626 6.36818 9312.03     230.616  9210.53     230.611  599.22     28.6147     189.917     28.6147     
1 1 1 5  4  11 o 17 514.337 4.71801 4716.1      121.61   4663.7      121.606  339.918    46.0167     26.2984     226.017     
1 1 1 5  4  12 o 8  148.243 2.34874 391.458     17.828   387.406     17.0652  14.8494    288.088     135.775     288.088     
1 1 1 5  4  13 o 10 590.551 5.42976 6205.89     157.146  6163.34     164.139  472.224    33.0712     130.646     33.0712     
1 1 1 5  4  14 o 10 961.195 8.30912 16286.2     400.229  16522.9     400.247  619.002    129.339     123.954     309.339     
1 1 1 5  4  15 o 16 383.584 3.74774 2644.87     72.0399  2571.66     72.0349  218.713    228.28      75.2861     48.28       
1 1 1 5  4  16 o 12 484.596 4.39703 4219.48     104.594  4107.57     108.856  397.382    142.688     142.121     142.688     
1 1 1 5  4  17 f 0  224.92  2.64352 903.592     29.1911  889.502     30.3801  230.473    90.1194     0           0           
1 1 1 5  4  18 o 11 405.016 3.82183 2922.43     75.9975  2893        79.098   259.238    255.344     25.9827     75.3442     
1 1 1 5  4  19 o 13 536.5   4.80418 5121.52     126.547  5084.66     131.714  326.048    241.744     90.9521     61.7439     
1 1 1 5  4  20 o 8  530.562 4.71288 5075.89     122.727  4905.57     127.729  404.219    139.969     79.8259     139.969     
1 1 1 5  4  21 o 16 480.903 4.44414 4052.84     107.095  4146.3      107.103  354.762    253.678     53.2646     253.678     
1 1 1 5  4  22 o 12 1030.73 8.50416 18797.7     439.255  18905       439.292  737.459    21.0005     21.7682     21.0004     
1 1 1 5  4  23 o 3  1241.36 10.2289 27184.1     636.299  27526.1     636.346  878.555    43.5353     4.55211     43.5353     
1 1 1 5  4  24 o 3  836.098 7.28444 12434.2     305.219  12359.6     305.221  685.937    288.366     201.896     288.366     
1 1 1 5  4  25 o 6  334.871 3.41512 1962.91     57.3071  2011.69     57.3101  151.663    336.676     147.51      156.676     
1 1 1 5  4  26 o 1  194.967 2.45484 650.83      23.4998  696.684     24.4732  93.2706    266.786     23.5044     266.786     
1 1 1 5  4  27 o 16 566.416 5.25056 5685.46     152.241  5687.89     145.766  367.455    101.016     49.0247     281.016     
1 1 1 5  4  28 o 9  770.683 6.75714 10461.3     260.958  10600.1     260.984  430.874    112.748     214.508     292.748     
1 1 1 5  4  29 o 14 251.922 3.10096 1114.24     39.1439  1135.06     39.152   162.161    14.2666     11.5185     14.2666     
1 1 1 5  4  30 o 19 533.027 5.00872 5213.05     127.365  4861.91     139.41   427.638    136.264     125.577     136.264     
1 1 1 5  4  31 o 17 1016.36 9.55898 18447       486.881  18212.1     486.857  671.196    345.222     75.0797     165.222     
1 1 1 5  4  32 o 17 590.531 5.81387 6184.22     172.056  6180.17     172.055  439.545    246.736     68.0954     246.736     
1 1 1 5  4  33 o 4  939.555 8.88932 15688.7     418.557  15635.2     418.55   671.153    187.553     39.2645     187.553     
1 1 1 5  4  34 o 7  586.522 5.62131 6089.28     161.253  6108.01     169.12   277.489    132.823     251.074     312.823     
1 1 1 5  4  35 o 18 275.178 3.22956 1332.41     43.4741  1351.49     45.5874  208.933    268.449     126.684     268.449     
1 1 1 5  4  36 f 0  785.288 7.35201 10907       296.117  10970.5     282.339  489.596    184.937     0           0           
1 1 1 5  4  37 o 5  333.745 3.92272 1971.17     65.6027  1977.29     65.6151  255.415    205.657     85.961      205.657     
1 1 1 5  4  38 o 6  383.2   3.97801 2640.42     78.2118  2565.44     74.5707  259.755    152.133     12.0553     152.133     
1 1 1 5  4  39 o 3  276.213 3.42129 1328.06     48.5491  1376.59     46.0791  80.1483    310.955     203.477     130.955     
1 1 1 5  4  40 o 4  291.176 3.61775 1486.44     52.7867  1519.29     52.7893  222.06     117.533     72.341      117.533     
1 1 1 5  4  41 f 0  270.824 3.524   1337.37     46.3771  1263.39     49.1318  213.265    115.097     0           0           
1 1 1 5  4  42 o 11 537.073 5.67107 5082.98     152.621  5151.68     152.647  461.681    152.251     200.123     152.251     
1 1 1 5  4  43 o 15 79.4689 2.59197 112.493     10.2544  111.84      10.3347  1.3252     128.038     23.3931     128.038     
1 1 1 5  4  44 o 7  350.95  3.88056 2204.65     64.7099  2163.23     71.5478  225.579    359.891     16.0986     179.891     
1 1 1 5  4  45 o 15 148.527 2.5632  397.136     19.5026  384.931     18.6552  37.6866    336.578     108.331     156.578     
1 1 1 5  4  46 o 2  375.493 4.08274 2504.19     76.8018  2497.26     76.8521  241.662    133.045     16.6883     313.045     
1 1 1 5  4  47 o 2  370.583 4.3213  2440.79     84.5958  2431.91     75.6771  272.286    258.042     54.1428     258.042     
1 1 1 5  4  48 o 12 26.588  3.891   11.8419     4.88257  14.2124     5.15012  30.1363    269.267     64.8544     269.267     
1 1 1 5  4  49 o 1  329.787 3.98793 1892.05     63.9251  1967.14     67.8905  237.471    135.878     42.1197     135.878     
1 1 1 5  4  50 o 7  442.855 4.4002  3468.69     97.662   3492.27     97.6468  336.659    123.688     85.9714     123.688     
1 1 1 5  4  51 o 8  417.496 4.21786 3102.91     86.1271  3083.46     90.3052  302.224    55.3129     51.4722     55.313      
1 1 1 5  4  52 o 14 511.61  5.02109 4626.59     131.755  4671.01     125.61   405.18     54.4268     131.793     54.4268     
1 1 1 5  4  53 o 12 66.7316 2.4287  76.8184     7.73949  81.5288     8.45004  4.97168    162.982     48.7629     342.982     
1 1 1 5  4  54 f 0  106.001 2.49186 197.124     12.5476  201.759     13.8704  61.0744    259.426     0           0           
1 1 1 5  4  55 o 1  331.257 3.78785 1935.61     61.1968  1959.23     64.5386  240.282    40.0388     49.0294     40.0388     
1 1 1 5  4  56 o 6  306.844 3.68005 1631.72     56.5475  1710.6      56.6079  266.789    155.468     139.014     155.468     
1 1 1 5  4  57 o 3  436.581 4.40869 3398.19     94.1376  3372.63     98.7038  249.329    144.359     71.7946     324.359     
1 1 1 5  4  58 o 10 104.791 2.47622 196.768     12.7345  193.118     13.2264  54.6158    80.8408     3.37388     260.841     
1 1 1 5  4  59 o 4  198.565 2.72756 712.206     26.2307  686.52      27.9851  118.374    217.408     13.5519     37.4076     
1 1 1 5  4  60 o 14 59.5892 2.63982 58.8741     7.52471  67.7334     8.16518  10.5676    335.645     79.0708     335.645     
1 1 1 5  4  61 f 0  103.647 2.48409 193.842     12.9365  187.68      12.8308  54.5373    146.336     0           0           
1 1 1 5  4  62 o 10 105.296 2.58926 203.066     13.9604  190.87      13.3266  70.3305    262.015     36.5657     262.015     
1 1 1 5  4  63 f 0  102.469 2.48892 186.731     12.6853  186.26      12.8381  73.8151    113.35      0           0           
1 1 1 5  4  64 o 13 89.2222 2.43363 141.355     11.4142  141.543     10.2766  54.6618    299.602     11.6638     299.602     
1 1 1 5  4  65 o 17 200.3   2.47582 728.478     26.4383  695.76      23.2253  171.878    43.6204     95.5009     43.6204     
1 1 1 5  4  66 o 4  82.8803 2.50673 121.082     10.3193  123.249     10.4561  45.7441    50.8058     0.591566    230.805     
1 1 1 5  4  67 o 9  149.553 2.61855 396.598     20.5814  398.134     18.5955  90.6896    136.658     2.92198     316.658     
1 1 1 5  4  68 o 4  231.831 2.97345 992.18      36.32    919.799     32.7771  164.406    336.653     39.0866     336.653     
1 1 1 5  4  69 o 5  171.659 2.64424 541.312     23.8902  506.541     21.6037  93.7315    326.273     25.3826     146.273     
1 1 1 5  4  70 o 17 93.3724 2.75513 162.77      12.9245  148.13      12.787   57.7559    129.416     7.11207     129.416     
1 1 1 5  4  71 o 15 121.839 2.41127 271.321     15.4688  257.066     13.9412  76.2678    231.39      6.09552     231.39      
1 1 1 5  4  72 o 9  81.0486 3.03439 122.202     13.5585  112.728     10.9503  39.9213    57.3073     14.3229     237.307     
1 1 1 5  4  73 o 1  163.746 2.68945 501.56      24.1681  454.253     19.935   104.956    130.595     9.26732     130.596     
1 1 1 5  4  74 o 12 50.0627 3.16782 50.1171     8.53281  40.3921     7.21301  19.7063    59.441      17.1181     239.441     
1 1 1 5  4  75 o 2  54.6978 3.06552 56.4235     8.9949   51.2503     7.66863  36.6629    8.73257     14.8694     8.73257     
1 1 1 5  4  76 o 10 77.5067 2.94732 116.206     11.7763  99.5535     11.029   34.1984    2.49578     23.7621     182.496     
1 1 1 5  4  77 o 14 30.8261 4.75484 16.9613     7.22475  18.8903     7.05497  6.91959    154.63      15.1419     334.63      
1 1 1 5  4  78 o 16 49.907  3.6243  46.1136     8.70793  44.5284     9.1449   23.043     287.704     9.8877      107.704     
1 1 1 5  4  79 o 9  136.117 2.9214  343.692     21.2327  321.35      18.5579  101.983    109.39      41.3717     109.39      
1 1 1 5  4  80 o 14 29.3644 5.09545 11.2901     8.11748  21.4447     7.19804  8.19054    95.2889     10.1389     275.289     
1 1 1 5  4  81 o 4  108.405 2.89633 228.389     15.9899  194.718     15.3885  66.6137    295.04      4.99718     295.04      
1 1 1 5  4  82 o 19 31.7706 5.34582 17.1334     8.44981  21.8176     8.37798  13.6154    2.83879     3.27809     182.839     
1 1 1 5  4  83 o 5  57.9326 3.65578 70.5547     10.5845  52.9441     10.2733  27.2685    339.913     11.9952     159.913     
1 1 1 5  4  84 o 3  39.6658 4.73222 31.5035     9.25258  28.3625     8.89076  23.967     149.417     6.58917     149.417     
1 1 1 5  4  85 o 11 31.7616 5.78929 17.8549     8.8306   22.2665     9.74686  8.77104    289.735     15.9339     109.735     
1 1 1 5  4  86 o 13 21.2737 6.05644 -0.228525   10.3184  9.19518     10.1319  0.0473491  356.031     19.0075     176.031     
1 1 1 5  4  87 o 5  53.9189 5.33559 70.3737     13.7952  43.6924     13.5548  28.0053    286.952     3.87291     106.952     
1 1 1 5  4  88 o 19 40.7345 7.63738 49.272      17.6365  23.1676     15.0641  16.1289    239.067     10.6114     59.0669     
1 1 1 5  4  89 o 9  29.3259 8.23736 -2.36139    16.0854  29.6915     21.7708  10.1097    268.696     2.71443     88.6958     
1 1 1 5  4  90 o 8  51.3844 10.9373 69.1713     31.1135  63.8438     29.8192  26.1085    297.277     2.63867     117.277     
1 1 1 5  4  91 x 8  ?       ?       ?           ?        ?           ?        6.3304     67.9403     0           0           
1 1 1 5  4  92 x 0  ?       ?       ?           ?        ?           ?        7.84921    23.9739     0           0           
1 1 1 5  4  93 x 1  ?       ?       ?           ?        ?           ?        15.2665    220.664     0           0           
1 1 1 5  4  94 x 3  ?       ?       ?           ?        ?           ?        8.77767    177.576     0           0           
1 1 1 5  4  95 x 16 ?       ?       ?           ?        ?           ?        12.2287    1.1248      0           0           
1 1 1 5  4  96 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 5  5  0  o 12 227.419 3.80715 917.974     43.3347  917.974     43.3347  4.07451    360         131.571     180         
1 1 1 5  5  1  o 19 108.513 2.28899 209.2       12.4226  209.2       12.4226  11.3629    210         34.1203     210         
1 1 1 5  5  2  o 14 235.953 3.20729 987.635     37.8933  987.635     37.8933  111.996    240         58.8782     60          
1 1 1 5  5  3  o 8  254.78  2.90129 1151.13     37.0223  1151.13     37.0223  146.557    270         18.5616     90          
1 1 1 5  5  4  o 4  555.266 5.26412 5467.47     146.424  5467.47     146.424  639.434    120         490.564     120         
1 1 1 5  5  5  o 11 64.4655 2.12625 74.1159     6.83498  74.1159     6.83498  61.4895    330         136.485     330         
1 1 1 5  5  6  o 4  741.285 6.79156 9746.36     252.204  9746.36     252.204  574.655    180         82.7089     180         
1 1 1 5  5  7  o 7  998.973 8.98024 17707.8     449.411  17707.8     449.411  704.688    210         27.4855     30          
1 1 1 5  5  8  o 16 353.936 3.51527 2221.22     62.3233  2221.22     62.3233  223.07     240         60.9447     60          
1 1 1 5  5  9  o 1  192.567 2.52814 657.76      24.3785  657.76      24.3785  15.2438    270         6.50389     89.9999     
1 1 1 5  5  10 o 4  449.524 4.20075 3583.12     94.5954  3583.12     94.5954  232.952    300         203.652     300         
1 1 1 5  5  11 o 14 629.651 5.59404 7031.14     176.454  7031.14     176.454  378.57     330         146.71      150         
1 1 1 5  5  12 o 12 196.034 2.54231 681.648     24.9569  681.648     24.9569  47.5965    3.0263e-05  12.6708     180         
1 1 1 5  5  13 o 10 792.579 6.92441 11143.8     274.939  11143.8     274.939  694.412    210         252.601     210         
1 1 1 5  5  14 o 3  36.6015 2.19367 24.2457     3.95468  24.2457     3.95468  11.2764    60.0002     23.3906     60.0002     
1 1 1 5  5  15 o 8  794.814 6.94296 11206.6     276.453  11206.6     276.453  732.952    90          328.241     90          
1 1 1 5  5  16 o 9  882.184 7.63977 13807.5     337.64   13807.5     337.64   655.502    300         49.3626     300         
1 1 1 5  5  17 o 10 365.559 3.54839 2369.48     64.9777  2369.48     64.9777  328.479    330         138.95      330         
1 1 1 5  5  18 o 4  75.5607 2.09409 101.631     7.90187  101.631     7.90187  4.84285    180         12.119      180         
1 1 1 5  5  19 o 1  952.181 8.23291 16084.4     392.724  16084.4     392.724  767.768    30          177.737     30          
1 1 1 5  5  20 o 9  60.1323 2.2169  64.5909     6.63887  64.5909     6.63887  37.1043    60          85.1363     60          
1 1 1 5  5  21 o 18 179.558 2.56956 571.987     23.1005  571.987     23.1005  192.482    270         640.152     270         
1 1 1 5  5  22 o 8  177.596 2.53059 559.545     22.5018  559.545     22.5018  76.3765    120         26.207      300         
1 1 1 5  5  23 o 2  635.13  5.88805 7152.98     187.338  7152.98     187.338  375.066    150         151.36      330         
1 1 1 5  5  24 o 18 918.776 8.2869  14971.8     381.42   14971.8     381.42   540.16     360         222.082     180         
1 1 1 5  5  25 o 2  368.483 4.03444 2407.77     74.4607  2407.77     74.4607  217.249    210         87.1303     30          
1 1 1 5  5  26 o 8  51.4785 2.20878 47.4717     5.64968  47.4717     5.64968  108.607    60          244.626     60          
1 1 1 5  5  27 o 5  1158.66 9.94311 23813.9     577.159  23813.9     577.159  845.997    270         56.4739     270         
1 1 1 5  5  28 o 10 129.007 2.13456 295.373     13.7831  295.373     13.7831  223.952    120         629.083     120         
1 1 1 5  5  29 o 13 169.848 2.61317 511.887     22.219   511.887     22.219   80.9958    150         48.8127     330         
1 1 1 5  5  30 o 8  752.725 6.29432 10046.4     237.361  10046.4     237.361  533.864    6.90309e-07 10.2224     6.90308e-07 
1 1 1 5  5  31 o 1  1413.79 11.4888 35467.2     813.747  35467.2     813.747  920.506    210         141.875     30          
1 1 1 5  5  32 o 4  1483.93 12.5923 39085.7     936.14   39085.7     936.14   1020.93    60          35.7932     240         
1 1 1 5  5  33 o 6  48.3019 2.69871 42.1093     6.43599  42.1093     6.43599  17.9013    90.0003     39.896      90.0003     
1 1 1 5  5  34 o 16 377.15  4.18789 2522.54     79.1095  2522.54     79.1095  163.437    300         199.249     120         
1 1 1 5  5  35 o 8  406.868 4.49874 2935.84     91.6783  2935.84     91.6783  352.27     330         138.159     330         
1 1 1 5  5  36 o 17 1281.01 12.6341 29143.8     810.713  29143.8     810.713  848.234    360         83.6383     180         
1 1 1 5  5  37 f 0  366.989 4.4621  2388.98     82.0094  2388.98     82.0094  154.154    30          0           0           
1 1 1 5  5  38 o 2  372.434 4.2018  2460.08     78.3783  2460.08     78.3783  418.854    240         346.153     240         
1 1 1 5  5  39 o 15 132.228 2.80215 310.656     18.5306  310.656     18.5306  5.03986    270.001     0.55707     90.0014     
1 1 1 5  5  40 o 4  921.819 8.76447 15084.1     404.72   15084.1     404.72   656.521    300         42.7899     300         
1 1 1 5  5  41 o 13 113.496 2.61039 228.985     14.8116  228.985     14.8116  25.4344    330         14.455      150         
1 1 1 5  5  42 o 12 599.83  6.23328 6384.34     187.281  6384.34     187.281  377.084    2.44507e-06 68.6505     180         
1 1 1 5  5  43 o 14 329.753 3.9162  1928.95     64.6752  1928.95     64.6752  245.42     210         39.5622     210         
1 1 1 5  5  44 o 10 215.167 3.06348 821.491     33.003   821.491     33.003   122.551    240         48.6201     60          
1 1 1 5  5  45 o 6  374.599 4.26173 2489.55     79.9576  2489.55     79.9576  302.469    90          94.7744     90          
1 1 1 5  5  46 o 4  537.247 5.9981  5123.92     161.4    5123.92     161.4    306.939    300         115.958     120         
1 1 1 5  5  47 o 11 622.321 6.46533 6876.65     201.537  6876.65     201.537  402.55     150         38.1356     330         
1 1 1 5  5  48 o 6  196.432 2.67055 684.605     26.267   684.605     26.267   146.07     180         27.2892     180         
1 1 1 5  5  49 o 9  334.538 3.6455  1985.41     61.0845  1985.41     61.0845  250.13     30          49.3636     30          
1 1 1 5  5  50 o 17 321.795 3.3806  1836.86     54.4901  1836.86     54.4901  224.037    60          15.5381     60          
1 1 1 5  5  51 o 2  626.729 5.5148  6972.48     173.148  6972.48     173.148  481.016    270         121.973     270         
1 1 1 5  5  52 o 1  128.336 2.43864 292.534     15.6583  292.534     15.6583  32.9124    300         105.66      120         
1 1 1 5  5  53 o 9  294.688 3.29416 1540.68     48.6209  1540.68     48.6209  159.068    330         74.5953     150         
1 1 1 5  5  54 o 8  175.496 2.74246 546.724     24.0929  546.724     24.0929  96.0152    180         41.1597     8.61865e-06 
1 1 1 5  5  55 o 5  215.167 3.109   821.78      33.4924  821.78      33.4924  183.374    30          81.7115     30          
1 1 1 5  5  56 o 3  304.216 3.519   1642.33     53.6166  1642.33     53.6166  203.125    60          4.46823     60          
1 1 1 5  5  57 o 3  47.715  2.94903 41.2779     6.92243  41.2779     6.92243  16.8253    90          69.1136     90          
1 1 1 5  5  58 o 12 103.918 2.38692 192.014     12.4008  192.014     12.4008  26.8062    120         82.0813     300         
1 1 1 5  5  59 o 10 316.333 3.41231 1775.69     54.0662  1775.69     54.0662  217.748    330         21.6749     330         
1 1 1 5  5  60 o 2  8.22683 3.87065 -1.31845    4.28797  -1.31845    4.28797  27.6762    180         56.0904     180         
1 1 1 5  5  61 o 19 32.0037 4.4111  20.107      6.30451  20.107      6.30451  12.9579    30          35.4359     30          
1 1 1 5  5  62 o 10 47.0747 2.95661 40.217      6.84253  40.217      6.84253  0.856593   60          15.2497     240         
1 1 1 5  5  63 o 6  152.204 2.5434  411.435     19.3756  411.435     19.3756  112.48     90          28.5204     90          
1 1 1 5  5  64 o 13 169.082 2.694   507.763     22.8012  507.763     22.8012  102.303    120         12.8559     300         
1 1 1 5  5  65 o 17 48.6086 2.89099 42.7944     6.9235   42.7944     6.9235   7.86488    150         73.9836     150         
1 1 1 5  5  66 o 11 38.656  3.51157 27.8066     6.495    27.8066     6.495    38.8578    360         124.777     360         
1 1 1 5  5  67 o 11 124.61  2.29645 275.948     14.3187  275.948     14.3187  109.484    30          60.6179     30          
1 1 1 5  5  68 o 19 120.306 2.19573 257.217     13.2181  257.217     13.2181  109.687    60          67.2125     60          
1 1 1 5  5  69 f 0  10.0826 4.45922 1.02235     4.63195  1.02235     4.63195  1.387      269.999     0           0           
1 1 1 5  5  70 o 14 209.028 3.03759 777.137     31.7892  777.137     31.7892  151.9      300         40.8708     300         
1 1 1 5  5  71 o 13 158.613 2.81359 447.695     22.3327  447.695     22.3327  115.613    150         32.4875     150         
1 1 1 5  5  72 o 12 209.909 3.0588  784.205     32.1459  784.205     32.1459  151.245    180         40.5171     180         
1 1 1 5  5  73 o 19 85.6278 2.92374 131.243     12.4793  131.243     12.4793  27.5021    30          51.4347     210         
1 1 1 5  5  74 o 5  45.8156 3.80054 38.9198     8.41191  38.9198     8.41191  16.3494    240         23.7821     60          
1 1 1 5  5  75 o 11 18.2723 6.20283 8.8399      6.55246  8.8399      6.55246  0.641002   89.9999     2.83235     89.9999     
1 1 1 5  5  76 o 19 7.94379 3.89987 -4.69706    5.43738  -4.69706    5.43738  3.14498    300         6.8212      300         
1 1 1 5  5  77 o 9  79.2896 2.95076 112.903     11.6503  112.903     11.6503  45.7671    330         5.40511     150         
1 1 1 5  5  78 o 6  21.0413 6.41108 11.4118     6.94269  11.4118     6.94269  0.0492373  8.64962e-06 13.2946     8.64967e-06 
1 1 1 5  5  79 o 8  49.1239 3.72675 44.6061     8.90821  44.6061     8.90821  37.2017    210         15.9899     210         
1 1 1 5  5  80 o 18 34.2602 5.20897 23.7811     7.84956  23.7811     7.84956  17.2459    60          4.18266     240         
1 1 1 5  5  81 o 6  46.2324 3.89927 39.8875     8.69529  39.8875     8.69529  12.6583    90          30.2254     270         
1 1 1 5  5  82 o 17 36.5712 4.96352 26.5717     8.12795  26.5717     8.12795  25.3456    120         15.0089     120         
1 1 1 5  5  83 o 7  10.8197 5.04612 -1.1941     7.03222  -1.1941     7.03222  6.7107     330         18.5123     330         
1 1 1 5  5  84 o 3  78.0609 3.33946 110.49      12.9532  110.49      12.9532  48.2993    1.61545e-09 4.08809     1.61545e-09 
1 1 1 5  5  85 o 5  41.631  5.04947 34.1014     9.6053   34.1014     9.6053   26.5426    210         4.13547     210         
1 1 1 5  5  86 o 15 16.9216 7.153   6.33901     10.7663  6.33901     10.7663  5.51185    60          27.5186     60          
1 1 1 5  5  87 o 11 83.342  4.06814 127.631     16.8019  127.631     16.8019  50.7658    90          4.15302     90          
1 1 1 5  5  88 o 3  35.0471 9.97586 33.2428     17.0614  33.2428     17.0614  9.03661    120         22.4031     300         
1 1 1 5  5  89 o 6  35.0344 10.2816 33.9766     17.9732  33.9766     17.9732  19.7345    150         10.1346     150         
1 1 1 5  5  90 o 10 18.37   8.86341 -8.84065    25.3498  -8.84065    25.3498  0.433105   180         1.09998     360         
1 1 1 5  5  91 x 12 ?       ?       ?           ?        ?           ?        11.1298    210         0           0           
1 1 1 5  5  92 x 12 ?       ?       ?           ?        ?           ?        15.5222    60          0           0           
1 1 1 5  5  93 x 0  ?       ?       ?           ?        ?           ?        16.3441    90          0           0           
1 1 1 5  5  94 x 8  ?       ?       ?           ?        ?           ?        7.69982    300         0           0           
1 1 1 5  5  95 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 6  0  0  o 14 435.21  5.44627 3359.47     118.7    3359.47     118.7    61.7256    359.999     35.1846     359.999     
1 1 1 6  0  1  o 11 1388.24 23.8648 34358.1     1658.07  34358.1     1658.07  957.708    240         81.31       60          
1 1 1 6  0  2  o 5  345.246 3.02359 2113.02     52.2952  2113.02     52.2952  124.035    300         246.684     120         
1 1 1 6  0  3  x 9  ?       ?       ?           ?        ?           ?        899.086    360         0           0           
1 1 1 6  0  4  o 9  335.544 3.29906 1996.2      55.4512  1996.2      55.4512  249.31     240         47.4687     240         
1 1 1 6  0  5  x 8  ?       ?       ?           ?        ?           ?        1173.54    120         0           0           
1 1 1 6  0  6  o 1  794.434 6.01288 11189.3     239.325  11189.3     239.325  833.974    360         526.415     360         
1 1 1 6  0  7  f 0  1665.35 35.2738 49766.6     2937.88  49766.6     2937.88  974.721    240         0           0           
1 1 1 6  0  8  o 12 236.346 2.48627 990.431     29.4335  990.431     29.4335  99.6354    300         49.1534     120         
1 1 1 6  0  9  x 13 ?       ?       ?           ?        ?           ?        1405.35    360         0           0           
1 1 1 6  0  10 o 2  980.669 7.61638 17054.7     374.209  17054.7     374.209  723.2      60          39.743      60          
1 1 1 6  0  11 o 15 1658.23 24.7295 49068.3     2052.98  49068.3     2052.98  1279.65    120         182.135     120         
1 1 1 6  0  12 o 18 333.078 3.04742 1966.82     50.8481  1966.82     50.8481  178.4      1.88323e-05 122.76      1.88323e-05 
1 1 1 6  0  13 o 10 542.554 4.44295 5218.78     120.766  5218.78     120.766  455.071    60          133.443     60          
1 1 1 6  0  14 o 13 723.045 5.93122 9270.46     214.851  9270.46     214.851  589.69     300         145.003     300         
1 1 1 6  0  15 o 6  1249.29 10.3144 27702.4     645.559  27702.4     645.559  795.625    180         194.536     360         
1 1 1 6  0  16 o 10 45.0096 1.9477  36.298      4.35518  36.298      4.35518  116.733    60          245.426     60          
1 1 1 6  0  17 o 7  1060.98 8.46515 19973.9     449.963  19973.9     449.963  776.298    120         38.6737     120         
1 1 1 6  0  18 o 12 389.239 3.52439 2686.24     68.7226  2686.24     68.7226  278.138    180         2.03137     180         
1 1 1 6  0  19 o 10 1072.76 8.56156 20421.2     460.14   20421.2     460.14   838.962    60          150.238     60          
1 1 1 6  0  20 o 12 174.553 2.23982 540.419     19.5784  540.419     19.5784  186.291    120         619.195     120         
1 1 1 6  0  21 o 6  440.819 4.02251 3445.5      88.8289  3445.5      88.8289  360.124    8.49598e-06 94.005      8.49598e-06 
1 1 1 6  0  22 o 8  27.7922 2.26242 14.2219     3.04274  14.2219     3.04274  10.925     59.9998     22.3628     59.9998     
1 1 1 6  0  23 o 5  228.417 2.49606 925.156     28.5569  925.156     28.5569  142.664    120         3.3025      300         
1 1 1 6  0  24 o 18 768.45  6.48001 10471.8     249.467  10471.8     249.467  578.111    180         68.3739     180         
1 1 1 6  0  25 o 6  715.66  6.05562 9081.56     217.113  9081.56     217.113  555.49     60          99.236      60          
1 1 1 6  0  26 o 19 32.5243 2.26312 19.282      3.60092  19.282      3.60092  101.041    300         210.175     300         
1 1 1 6  0  27 o 16 541.655 4.92    5201.82     133.502  5201.82     133.502  235.924    1.38638e-06 291.704     180         
1 1 1 6  0  28 o 7  104.644 2.23508 194.557     11.6969  194.557     11.6969  1.90881    240         13.8068     240         
1 1 1 6  0  29 o 11 170.675 2.47647 516.8       21.1617  516.8       21.1617  65.4865    120         83.0217     300         
1 1 1 6  0  30 o 12 471.763 4.74516 3946.37     112.134  3946.37     112.134  453.165    180         244.451     180         
1 1 1 6  0  31 o 19 81.328  2.09939 117.663     8.53053  117.663     8.53053  96.2751    60          272.73      60          
1 1 1 6  0  32 o 11 53.6989 2.15795 51.5864     5.76396  51.5864     5.76396  10.6537    120         24.9688     120         
1 1 1 6  0  33 f 0  344.409 3.40384 2103.09     58.7236  2103.09     58.7236  68.5006    180         0           0           
1 1 1 6  0  34 o 18 31.8569 2.833   18.8183     4.329    18.8183     4.329    93.6198    60          195.848     60          
1 1 1 6  0  35 o 3  163.119 2.63377 472.205     21.5046  472.205     21.5046  66.5546    120         26.6897     300         
1 1 1 6  0  36 o 13 36.7919 2.64282 24.7192     4.74817  24.7192     4.74817  1.75605    180         3.71489     180         
1 1 1 6  0  37 f 0  242.908 2.92813 1046.44     35.6211  1046.44     35.6211  95.4987    60          0           0           
1 1 1 6  0  38 o 15 263.081 3.24422 1227.56     42.7428  1227.56     42.7428  159.02     120         43.4063     300         
1 1 1 6  0  39 o 8  208.012 2.84393 767.578     29.6211  767.578     29.6211  138.688    1.89998e-06 60.9414     1.89998e-06 
1 1 1 6  0  40 o 8  248.431 2.90122 1094.54     36.0977  1094.54     36.0977  144.188    60          52.6624     240         
1 1 1 6  0  41 o 9  369.641 3.50139 2422.65     64.8345  2422.65     64.8345  329.202    120         150.896     120         
1 1 1 6  0  42 o 10 1425.96 12.787  36146.1     913.433  36146.1     913.433  994.093    180         34.7489     180         
1 1 1 6  0  43 o 10 79.6143 2.57345 113.022     10.2185  113.022     10.2185  16.7744    240         90.5439     240         
1 1 1 6  0  44 o 19 29.4196 3.41079 16.5221     4.62292  16.5221     4.62292  135.481    120         289.24      120         
1 1 1 6  0  45 o 11 84.2596 2.15036 126.297     9.05326  126.297     9.05326  3.44079    2.38376e-05 49.46       180         
1 1 1 6  0  46 o 12 80.4548 2.45135 115.345     9.84181  115.345     9.84181  1.85282    240         10.0015     59.9999     
1 1 1 6  0  47 o 18 404.151 3.78239 2896.81     76.5771  2896.81     76.5771  380.834    120         214.783     120         
1 1 1 6  0  48 o 8  8.70346 3.97457 -0.111661   4.04392  -0.111661   4.04392  55.6888    360         112.165     360         
1 1 1 6  0  49 o 13 111.819 2.44645 222.222     13.6795  222.222     13.6795  44.9993    60          41.2241     240         
1 1 1 6  0  50 o 7  181.987 2.88225 587.878     26.2566  587.878     26.2566  144.394    300         46.6958     300         
1 1 1 6  0  51 o 12 34.437  3.107   22.0241     5.12366  22.0241     5.12366  37.268     8.65186e-06 88.4643     8.65186e-06 
1 1 1 6  0  52 o 4  694.955 7.35943 8583.32     256.178  8583.32     256.178  530.535    240         133.456     240         
1 1 1 6  0  53 f 0  532.009 5.75479 5026.2      153.348  5026.2      153.348  356.595    300         0           0           
1 1 1 6  0  54 o 6  114.991 2.9133  235.287     16.7395  235.287     16.7395  51.8447    360         34.8718     360         
1 1 1 6  0  55 o 4  25.6807 4.84837 13.923      5.39108  13.923      5.39108  65.3959    60          146.938     60          
1 1 1 6  0  56 o 19 252.033 3.59569 1127.66     45.3734  1127.66     45.3734  152.87     300         26.6769     120         
1 1 1 6  0  57 o 2  103.533 2.71586 190.786     14.047   190.786     14.047   4.14709    0.000141249 2.49996     0.000141249 
1 1 1 6  0  58 o 15 104.943 2.72205 196.006     14.2718  196.006     14.2718  30.5838    60          75.4015     240         
1 1 1 6  0  59 o 13 16.5687 6.01352 7.12955     6.34796  7.12955     6.34796  39.599     120         83.1612     120         
1 1 1 6  0  60 o 16 165.402 2.51532 485.61      20.8277  485.61      20.8277  141.494    180         68.1979     180         
1 1 1 6  0  61 o 5  209.996 2.92403 782.738     30.7449  782.738     30.7449  184.003    60          95.4879     60          
1 1 1 6  0  62 o 8  171.99  2.85742 525.327     24.5978  525.327     24.5978  55.6511    300         111.147     120         
1 1 1 6  0  63 o 13 123.102 2.77463 269.511     17.0778  269.511     17.0778  73.0459    180         12.4137     8.63049e-06 
1 1 1 6  0  64 o 9  67.8262 2.48612 82.2172     8.39833  82.2172     8.39833  14.7945    60          54.437      240         
1 1 1 6  0  65 o 16 114.206 2.49041 231.924     14.2228  231.924     14.2228  47.4621    120         51.236      300         
1 1 1 6  0  66 o 12 292.359 3.45088 1518.18     50.5281  1518.18     50.5281  197.433    180         22.0472     180         
1 1 1 6  0  67 o 15 182.42  2.69382 591.04      24.6021  591.04      24.6021  128.279    240         24.7883     240         
1 1 1 6  0  68 o 16 59.3276 3.1151  63.4945     9.1416   63.4945     9.1416   10.9779    120         51.3726     300         
1 1 1 6  0  69 o 13 46.6325 3.61299 39.9954     8.18577  39.9954     8.18577  6.18023    1.30413e-07 39.6918     180         
1 1 1 6  0  70 o 12 95.0477 2.83857 161.225     13.4658  161.225     13.4658  51.2757    240         16.8203     60          
1 1 1 6  0  71 o 3  61.4176 3.1057  68.0271     9.44448  68.0271     9.44448  14.1827    120         47.8775     300         
1 1 1 6  0  72 o 8  15.4807 5.8477  6.15237     6.18529  6.15237     6.18529  16.9414    180         38.5441     180         
1 1 1 6  0  73 o 9  30.0683 5.25743 18.7835     6.85726  18.7835     6.85726  0.055453   240         1.3544      60.0001     
1 1 1 6  0  74 o 12 18.9487 6.20121 9.39458     6.49829  9.39458     6.49829  7.71533    300         24.4988     300         
1 1 1 6  0  75 o 13 12.5273 5.31465 2.90037     5.98538  2.90037     5.98538  2.57035    180         6.32774     180         
1 1 1 6  0  76 o 4  215.271 3.0012  825.638     32.349   825.638     32.349   149.86     60          35.769      60          
1 1 1 6  0  77 o 19 48.5029 3.51634 43.2484     8.32379  43.2484     8.32379  34.7173    120         12.2303     120         
1 1 1 6  0  78 o 13 63.4618 3.12683 72.8062     9.83152  72.8062     9.83152  38.9114    360         0.679947    360         
1 1 1 6  0  79 o 2  28.5747 5.79692 17.8489     7.19573  17.8489     7.19573  8.42416    240         11.9042     60          
1 1 1 6  0  80 f 0  14.3292 6.16317 3.55262     8.28052  3.55262     8.28052  4.58232    120         0           0           
1 1 1 6  0  81 o 3  35.3477 5.63765 25.627      8.71271  25.627      8.71271  15.6589    4.81453e-06 9.72758     180         
1 1 1 6  0  82 o 1  9.78396 4.69816 -3.55674    6.94598  -3.55674    6.94598  6.58368    60          15.9124     60          
1 1 1 6  0  83 f 0  25.1799 6.93171 15.8131     8.33626  15.8131     8.33626  1.7727     120         0           0           
1 1 1 6  0  84 o 8  15.9432 6.48923 6.09915     8.30934  6.09915     8.30934  1.01163    360         10.166      360         
1 1 1 6  0  85 o 15 105.702 3.29088 201.513     17.3552  201.513     17.3552  76.2802    60          28.0435     60          
1 1 1 6  0  86 o 4  28.9939 7.68037 21.0101     10.4103  21.0101     10.4103  12.0229    300         8.47985     120         
1 1 1 6  0  87 o 11 15.79   6.99653 3.53295     11.4594  3.53295     11.4594  6.39772    180         27.1534     180         
1 1 1 6  0  88 o 10 115.062 4.94407 245.056     28.265   245.056     28.265   75.4183    240         17.2243     240         
1 1 1 6  0  89 o 5  11.9872 6.025   -19.0415    15.5338  -19.0415    15.5338  1.39919    120         4.01789     120         
1 1 1 6  0  90 x 19 ?       ?       ?           ?        ?           ?        15.3189    1.45349e-06 0           0           
1 1 1 6  0  91 x 15 ?       ?       ?           ?        ?           ?        27.9252    240         0           0           
1 1 1 6  0  92 x 17 ?       ?       ?           ?        ?           ?        3.69418    300         0           0           
1 1 1 6  0  93 x 19 ?       ?       ?           ?        ?           ?        53.0179    4.79771e-06 0           0           
1 1 1 6  0  94 x 2  ?       ?       ?           ?        ?           ?        10.4238    60          0           0           
1 1 1 6  0  95 x 19 ?       ?       ?           ?        ?           ?        1.41506    300         0           0           
1 1 1 6  0  96 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 6  1  0  o 6  154.044 2.18594 420.962     16.8596  420.962     16.8596  2.00753    360         17.3096     360         
1 1 1 6  1  1  o 6  272.935 2.899   1307.69     41.1318  1332.48     38.0829  46.5494    58.1667     247.314     238.167     
1 1 1 6  1  2  o 15 423.343 3.72878 3173.71     79.1066  3178.52     79.1093  186.362    117.543     198.498     297.543     
1 1 1 6  1  3  o 12 1204.98 11.3976 25486.8     688.207  26073.9     688.257  1039.54    259.904     366.884     259.904     
1 1 1 6  1  4  o 12 196.069 2.58818 675.436     24.8762  687.006     25.9819  27.3991    332.357     82.4074     152.357     
1 1 1 6  1  5  o 9  935.727 8.15613 15459.6     397.996  15601.8     366.118  708.438    313.793     94.1172     313.793     
1 1 1 6  1  6  f 0  796.089 6.2817  11250.4     258.828  11222.4     242.135  467.365    238.696     0           0           
1 1 1 6  1  7  o 9  936.123 7.35483 15503.1     350.899  15579.5     339.043  808.807    81.1396     299.086     81.1396     
1 1 1 6  1  8  o 19 181.578 2.17407 586.976     20.1226  581.475     19.4408  65.6289    85.4827     335.732     85.4827     
1 1 1 6  1  9  f 0  748.669 6.02477 9985.02     229.917  9890.53     222.135  475.832    194.603     0           0           
1 1 1 6  1  10 o 8  449.441 3.86936 3644.85     88.6578  3515.81     85.6514  302.37     127.633     3.66242     127.633     
1 1 1 6  1  11 o 14 1080.12 9.16174 20623       485.91   20790.5     505.8    699.159    288.566     135.613     108.566     
1 1 1 6  1  12 o 7  993.903 8.12842 17538.4     412.28   17517.8     397.32   785.275    171.589     165.855     171.589     
1 1 1 6  1  13 o 18 879.672 7.38009 13797.3     325.33   13659.6     325.351  714.56     328.204     192.049     328.204     
1 1 1 6  1  14 o 9  419.053 3.80547 3175.59     78.3791  3050.14     81.3429  322.197    231.545     98.1401     231.545     
1 1 1 6  1  15 o 18 675.64  5.74302 8166.9      194.443  8024.87     194.453  459.865    342.763     23.1618     162.763     
1 1 1 6  1  16 o 12 573.837 4.90679 5939.38     138.404  5738.64     143.638  388.44     200.682     16.0139     20.6824     
1 1 1 6  1  17 o 6  831.177 6.85873 12379.1     280.277  12138.7     290.882  681.313    283.174     197.905     283.174     
1 1 1 6  1  18 o 13 517.066 4.49656 4780.12     114.31   4700.22     118.64   327.843    81.4605     55.0854     261.461     
1 1 1 6  1  19 o 11 753.362 6.24998 10214.7     231.462  9922.47     240.216  598.597    239.038     145.483     239.038     
1 1 1 6  1  20 o 10 557.032 4.7805  5566.77     130.911  5436.27     135.867  303.331    93.5736     166.063     273.574     
1 1 1 6  1  21 o 9  262.679 2.76432 1207.5      35.7076  1238.2      37.0711  45.349     234.105     29.7194     234.105     
1 1 1 6  1  22 o 3  487.174 4.24937 4234.23     101.784  4179.9      105.643  294.645    330.576     79.3763     150.576     
1 1 1 6  1  23 o 12 255.169 2.76958 1163.81     34.0096  1143.9      36.7444  153.086    196.778     82.3706     196.778     
1 1 1 6  1  24 o 18 446.458 4.12496 3573.69     90.4022  3492.13     94.0914  236.038    155.793     139.434     335.793     
1 1 1 6  1  25 o 1  816.328 7.07017 11854.5     289.224  11780.2     289.249  532.958    284.367     76.4827     104.367     
1 1 1 6  1  26 o 14 389.38  3.69525 2671.77     70.6513  2702.12     73.5484  205.225    321.798     117.854     141.798     
1 1 1 6  1  27 o 9  815.412 7.04869 11727.1     288.011  11851.7     288.054  762.699    210.77      393.652     210.77      
1 1 1 6  1  28 o 16 193.237 2.48225 662.886     24.0366  660.429     24.0391  58.4538    152.802     25.0015     152.802     
1 1 1 6  1  29 o 1  627.278 5.53177 6978.03     173.887  6971.36     173.901  317.408    230.827     235.789     50.8269     
1 1 1 6  1  30 o 18 49.5989 2.18276 44.5675     5.4107   42.9582     5.38549  44.0559    4.99666     99.3738     4.99666     
1 1 1 6  1  31 o 9  447.842 4.48061 3595.15     102.955  3514.4      98.1507  417.519    20.9909     240.389     20.9909     
1 1 1 6  1  32 o 2  474.239 4.86    3990.89     121.15   3981.77     109.58   269.28     344.977     110.27      164.977     
1 1 1 6  1  33 o 3  1032.57 10.2781 18871.8     531.847  18975.7     531.866  797.382    316.234     162.204     316.234     
1 1 1 6  1  34 o 2  854.27  8.58172 12878.5     367.386  13014.3     367.392  695.868    169.986     213.672     169.986     
1 1 1 6  1  35 o 11 944.655 9.45605 15897       447.659  15776.2     447.647  649.245    314.75      5.87684     134.75      
1 1 1 6  1  36 o 7  538.611 5.43541 5228.82     139.06   5057.83     153.724  380.291    287.941     31.5648     287.941     
1 1 1 6  1  37 o 3  92.2496 2.33018 141.194     10.6927  161.115     10.788   48.5208    239.035     155.12      239.035     
1 1 1 6  1  38 o 10 1608.45 14.7702 46976.1     1161.15  45162.8     1217.82  1186.26    47.4817     154.969     47.4818     
1 1 1 6  1  39 o 19 246.296 2.8426  1071.67     35.0801  1078.38     35.0915  133.412    220.34      39.6507     40.3402     
1 1 1 6  1  40 o 16 799.233 6.86462 11296.2     280.359  11369.6     269.389  688.096    79.583      288.16      79.583      
1 1 1 6  1  41 f 0  546.802 4.9851  5258.52     136.589  5345.2      136.613  377.417    299.125     0           0           
1 1 1 6  1  42 o 4  144.187 2.35008 370.077     17.3369  366.787     16.6211  32.3566    275.969     102.941     95.9686     
1 1 1 6  1  43 o 5  82.4911 2.32137 109.387     9.35754  132.749     9.76388  3.27213    25.9597     39.1473     25.9597     
1 1 1 6  1  44 o 18 362.949 3.57986 2308.01     62.3585  2362.92     67.812   180.613    140.826     123.659     320.826     
1 1 1 6  1  45 o 12 204.813 2.70011 733.188     27.71    753.924     27.7141  128.413    98.9858     0.420644    98.9853     
1 1 1 6  1  46 o 18 601.255 5.95389 6432.24     179.397  6403.89     179.4    422.668    0.434124    36.1028     0.434125    
1 1 1 6  1  47 o 10 301.204 3.50373 1613.6      52.9038  1603.79     52.8706  198.171    255.592     1.62209     255.592     
1 1 1 6  1  48 o 16 372.155 4.6763  2475.68     84.7675  2439.68     89.5558  282.724    144.244     75.0608     144.244     
1 1 1 6  1  49 o 8  279.451 3.84309 1402.19     55.8883  1368.28     51.7163  167.879    196.629     27.9456     16.6294     
1 1 1 6  1  50 o 1  333.462 4.2049  2010.11     70.7876  1936.15     69.7472  238.791    270.546     40.7248     270.546     
1 1 1 6  1  51 o 4  80.7423 3.05374 114.863     13.2778  117.003     11.2361  13.2814    189.418     114.321     189.418     
1 1 1 6  1  52 o 15 448.517 5.29528 3694.38     114.909  3454.2      122.646  311.903    211.003     30.3329     211.003     
1 1 1 6  1  53 o 19 507.611 6.03089 4649.97     168.289  4513.61     137.402  361.543    132.985     51.6852     132.985     
1 1 1 6  1  54 f 0  200.99  3.43757 712.268     37.0048  721.476     31.993   200.379    71.9531     0           0           
1 1 1 6  1  55 o 11 171.64  3.47724 553.585     32.4231  493.472     27.3357  50.3053    70.2739     118.422     250.274     
1 1 1 6  1  56 o 18 248.552 3.40399 1108.78     43.6594  1083.39     41.1277  157.598    63.9506     4.34053     243.951     
1 1 1 6  1  57 o 19 493.529 5.37765 4425.48     136.939  4237.18     129.076  369.597    279.479     94.9603     279.479     
1 1 1 6  1  58 o 1  190.307 2.97415 666.707     28.484   618.583     28.2247  100.129    200.111     39.8351     20.111      
1 1 1 6  1  59 o 17 264.137 3.35943 1280.89     44.5626  1195.88     44.3429  203.727    48.4504     71.9434     48.4504     
1 1 1 6  1  60 o 19 74.5828 2.74389 97.9021     10.4258  99.961      10.0052  21.1939    2.69609     11.0667     182.696     
1 1 1 6  1  61 o 11 118.431 2.62961 254.09      15.7774  243.992     15.3982  49.4474    5.04268     42.1332     185.043     
1 1 1 6  1  62 o 7  245.482 3.17904 1131.25     40.2637  1009.55     37.9566  172.315    189.896     34.4694     189.896     
1 1 1 6  1  63 o 13 108.14  2.58277 214.381     14.5415  201.125     13.4148  60.7954    319.315     3.53725     139.315     
1 1 1 6  1  64 o 19 166.562 2.78689 497.147     25.0637  487.934     21.3204  119.009    131.369     32.5519     131.369     
1 1 1 6  1  65 o 13 104.428 2.57185 195.355     14.736   192.184     12.023   68.7922    301.291     17.2047     301.291     
1 1 1 6  1  66 o 19 234.864 3.05451 1016.72     39.49    943.876     32.2797  169.317    359.38      43.9513     359.38      
1 1 1 6  1  67 o 4  213.084 2.85413 814.13      33.1348  799.102     27.6182  134.572    192.527     2.68304     192.527     
1 1 1 6  1  68 o 9  85.331  2.61419 132.839     11.8794  126.357     10.4078  53.7409    57.9608     13.4362     57.9608     
1 1 1 6  1  69 o 4  182.13  2.66993 601.351     25.5266  577.801     23.1948  102.244    77.164      21.3804     257.164     
1 1 1 6  1  70 o 5  85.9064 2.9096  127.349     12.2225  135.918     12.7588  30.5528    302.547     40.3737     122.547     
1 1 1 6  1  71 o 9  95.3142 2.67233 169.669     12.9664  154.241     12.5081  27.617     236.84      58.9867     56.8404     
1 1 1 6  1  72 o 1  133.49  2.89763 318.155     19.0515  317.205     19.6653  86.4004    163.611     11.9965     163.611     
1 1 1 6  1  73 o 4  96.0194 2.8628  165.091     13.5319  164.05      13.9526  68.3116    29.0774     24.8863     29.0774     
1 1 1 6  1  74 o 13 22.9275 5.25305 12.5128     6.47507  4.11635     8.28923  1.39966    41.4367     10.9401     41.4367     
1 1 1 6  1  75 o 11 94.5733 3.06405 151.749     13.2396  168.703     15.7199  43.5147    126.338     26.793      306.338     
1 1 1 6  1  76 o 11 142.274 2.9112  359.569     19.8611  364.391     21.5823  97.6625    248.657     23.1804     248.657     
1 1 1 6  1  77 o 5  39.0858 4.29918 25.4146     7.85097  31.2073     8.42911  16.9451    36.5624     5.4344      216.562     
1 1 1 6  1  78 o 8  37.9182 4.44694 22.7864     7.82406  30.9898     8.44046  16.9086    227.027     3.54404     47.0273     
1 1 1 6  1  79 o 12 83.3151 3.12261 125.667     13.2975  124.157     12.6804  52.7895    298.325     7.95714     298.325     
1 1 1 6  1  80 f 0  19.5122 5.28041 2.44725     7.53339  6.99224     7.14012  6.03966    245.868     0           0           
1 1 1 6  1  81 o 19 58.3779 3.72126 60.2897     11.028   63.9316     10.4755  37.7494    227.666     10.2969     227.666     
1 1 1 6  1  82 o 14 39.9026 4.8591  23.8623     9.47661  36.7426     8.94274  12.186     40.5878     19.4822     220.588     
1 1 1 6  1  83 f 0  24.7566 5.70186 10.3152     8.44019  12.16       7.85182  16.218     162.352     0           0           
1 1 1 6  1  84 o 19 27.2304 5.67475 17.3539     8.60091  11.2716     8.11783  1.11841    41.639      26.1955     221.639     
1 1 1 6  1  85 o 14 28.434  6.52186 19.9704     8.90453  6.33212     15.0096  7.37624    248.393     13.8069     68.3934     
1 1 1 6  1  86 o 12 58.8421 5.2001  63.5157     11.8334  69.151      17.6118  34.7655    11.8339     3.49888     11.8339     
1 1 1 6  1  87 o 18 65.4714 5.76583 74.3327     16.8818  93.6187     20.1857  43.0515    27.4047     12.9097     27.4047     
1 1 1 6  1  88 o 9  24.3701 7.36305 11.3345     16.0677  -7.50515    17.2363  5.38331    144.368     4.79832     324.368     
1 1 1 6  1  89 o 18 18.2855 6.25238 -23.3194    15.334   -18.2389    18.9054  4.81394    285.342     23.5642     285.342     
1 1 1 6  1  90 o 10 40.2041 17.8105 0           0        34.9539     50.2906  12.5331    114.262     12.6215     294.262     
1 1 1 6  1  91 x 3  ?       ?       ?           ?        ?           ?        19.886     112.555     0           0           
1 1 1 6  1  92 x 16 ?       ?       ?           ?        ?           ?        24.7365    72.0306     0           0           
1 1 1 6  1  93 x 17 ?       ?       ?           ?        ?           ?        15.7263    196.387     0           0           
1 1 1 6  1  94 x 14 ?       ?       ?           ?        ?           ?        13.5608    348.002     0           0           
1 1 1 6  1  95 x 3  ?       ?       ?           ?        ?           ?        5.32234    185.396     0           0           
1 1 1 6  1  96 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 6  2  0  o 5  808.647 7.36566 11597.1     298.379  11597.1     298.379  613.704    1.61454e-05 63.6459     1.61454e-05 
1 1 1 6  2  1  o 7  656.385 5.99213 7715.22     201.382  7561.73     192.808  689.932    125.983     517.876     125.983     
1 1 1 6  2  2  o 14 361.575 3.67572 2301.05     68.0244  2332.86     65.1303  267.307    115.885     116.789     115.885     
1 1 1 6  2  3  o 1  499.257 4.80905 4419.29     114.724  4416.93     125.668  365.565    226.955     57.8254     226.955     
1 1 1 6  2  4  o 15 659.095 6.24891 7677.82     186.741  7726.37     224.45   452.16     301.658     14.8884     121.658     
1 1 1 6  2  5  o 13 224.585 2.93334 884.308     35.263   903.359     30.5438  70.5172    338.339     51.7201     158.339     
1 1 1 6  2  6  f 0  549.552 4.95075 5327.54     127.936  5379.24     144.337  216.239    71.6509     0           0           
1 1 1 6  2  7  o 4  577.371 5.05286 5936.43     140.44   5882.18     151.693  480.805    306.558     174.818     306.558     
1 1 1 6  2  8  f 0  576.202 5.01327 5881.59     139.084  5889.28     150.233  236.582    153.19      0           0           
1 1 1 6  2  9  o 1  345.413 3.36838 2120.75     56.0125  2108.12     60.501   225.873    31.0131     21.5338     31.0131     
1 1 1 6  2  10 o 5  1145.62 9.75784 23288.3     525.524  23315.7     592.906  857.679    337.392     87.0183     337.392     
1 1 1 6  2  11 o 12 599.738 5.2199  6450.97     150.655  6303.31     162.728  416.279    112.693     1.37223     112.694     
1 1 1 6  2  12 o 14 448.841 4.06073 3570.29     87.7532  3571.5      94.7906  281.642    309.918     43.4544     129.918     
1 1 1 6  2  13 o 6  647.643 5.57542 7463.47     173.826  7412.28     187.767  538.738    218.692     181.898     218.692     
1 1 1 6  2  14 o 2  148.68  2.28824 391.679     17.0485  391.778     17.0506  44.8725    149.241     231.154     149.241     
1 1 1 6  2  15 o 12 657.385 5.65859 7762.86     179.001  7566.53     193.351  538.898    109.541     166.592     109.541     
1 1 1 6  2  16 o 3  256.994 2.78554 1171.49     34.4654  1169.49     37.2293  80.9286    69.9331     158.988     249.933     
1 1 1 6  2  17 o 18 661.948 5.56288 7806.06     181.061  7736.47     187.916  494.176    118.814     66.8778     118.814     
1 1 1 6  2  18 o 9  308.37  3.03537 1654.78     46.0351  1716.14     47.7843  113.766    258.332     177.968     78.3321     
1 1 1 6  2  19 o 16 190.928 2.3586  642.093     22.1448  649.905     22.987   32.3164    175.954     147.868     355.954     
1 1 1 6  2  20 o 14 207.401 2.50506 761.829     25.011   762.724     27.0252  85.125     214.235     38.9922     34.2352     
1 1 1 6  2  21 f 0  565.846 5.02514 5731.9      139.575  5621.48     145.296  389.009    108.405     0           0           
1 1 1 6  2  22 o 12 575.072 4.99287 5895.68     143.872  5829.88     143.905  393.213    184.157     9.8144      4.15724     
1 1 1 6  2  23 o 18 1353.74 11.3829 33166.9     756.209  31946.1     787.165  983.338    48.5257     55.1096     48.5257     
1 1 1 6  2  24 o 12 227.168 2.57964 927.511     28.8004  901.489     29.904   35.359     19.1269     220.871     199.127     
1 1 1 6  2  25 o 17 1196.38 9.80761 25852.2     587.909  24951.4     587.993  789.969    139.515     104.537     319.515     
1 1 1 6  2  26 o 13 968.486 7.9932  16753       387.926  16517.1     387.957  563.941    78.3295     231.714     258.329     
1 1 1 6  2  27 o 5  1038.43 9.09526 19115.2     483.448  19142.8     462.954  810.567    110.803     166.53      110.803     
1 1 1 6  2  28 o 17 507.765 4.74285 4533.66     123.244  4605.73     118.028  319.288    68.2113     59.9795     248.211     
1 1 1 6  2  29 o 11 748.96  6.82671 9867.53     267.481  10023.7     244.258  529.339    356.232     17.3232     356.232     
1 1 1 6  2  30 o 4  459.072 4.67983 3735.81     107.655  3734.68     107.673  255.988    211.14      116.88      31.1404     
1 1 1 6  2  31 o 15 413.687 4.58662 3006.11     100.168  3060.42     89.6143  271.043    102.852     18.2913     282.852     
1 1 1 6  2  32 o 19 687.516 6.60877 8308.38     227.675  8453.64     227.713  582.386    18.7985     218.26      18.7985     
1 1 1 6  2  33 o 14 656.286 6.22407 7596.12     209.478  7676.47     199.761  387.979    136.419     129.284     316.419     
1 1 1 6  2  34 o 7  152.62  2.4671  399.138     18.8486  426.58      18.8753  38.0189    97.7661     67.1841     277.766     
1 1 1 6  2  35 o 14 143.187 2.42282 355.894     18.1337  371.031     16.5457  16.3539    34.6572     102.317     214.657     
1 1 1 6  2  36 f 0  631.644 5.90064 7059.19     195.069  7088.81     178.068  404.81     144.521     0           0           
1 1 1 6  2  37 o 16 515.721 5.02602 4722.41     132.966  4707.63     126.763  280.396    5.29524     138.338     185.295     
1 1 1 6  2  38 o 4  324.119 3.57226 1865.54     59.3992  1858.26     56.6208  210.348    202.764     1.09195     202.764     
1 1 1 6  2  39 o 3  232.243 2.98124 991.449     34.7981  920.953     34.5698  150.571    83.4014     96.6151     83.4014     
1 1 1 6  2  40 o 10 697.419 6.97204 8766.09     237.069  8495.97     249.87   491.791    226.328     33.2034     226.328     
1 1 1 6  2  41 o 18 640.365 6.19299 7179.37     198.559  7371.28     198.902  505.5      100.344     141.954     100.344     
1 1 1 6  2  42 o 8  247.423 3.10754 1075.56     37.6278  1094.6      39.4278  164.765    126.372     14.909      126.372     
1 1 1 6  2  43 o 15 274.031 3.19288 1306.92     42.6913  1355.45     45.0039  164.457    22.3269     28.7463     202.327     
1 1 1 6  2  44 o 7  171.226 2.69319 518.711     23.0398  520.578     23.18    92.802     59.1237     20.3693     239.124     
1 1 1 6  2  45 o 12 167.001 2.636   512.835     22.6372  476.161     21.4897  67.8619    151.613     72.0854     331.613     
1 1 1 6  2  46 o 8  223.532 3.08453 887.621     35.4673  884         33.6182  100.755    152.08      88.1829     332.08      
1 1 1 6  2  47 o 16 231.392 3.09917 948.312     37.2638  950.205     34.5584  194.662    316.193     105.478     316.193     
1 1 1 6  2  48 o 18 659.281 7.12781 7662.15     255.243  7796.43     213.492  532.426    1.18859     181.616     1.18859     
1 1 1 6  2  49 o 17 367.774 4.25539 2388.07     82.3571  2411.61     74.2501  280.593    64.1671     77.4737     64.1671     
1 1 1 6  2  50 o 17 128.345 2.83755 306.931     19.7498  278.094     16.6959  36.9078    77.5391     80.3188     257.539     
1 1 1 6  2  51 o 19 270.08  3.89548 1281.64     62.2932  1306.62     40.697   175.098    36.4294     1.80605     216.43      
1 1 1 6  2  52 o 19 150.837 2.66521 382.271     20.5734  425.347     19.5908  58.8022    45.8787     73.0879     225.879     
1 1 1 6  2  53 o 17 359.28  4.42647 2332.68     79.6739  2250.77     79.7036  220.497    246.431     32.1152     66.4307     
1 1 1 6  2  54 o 8  439.615 5.18613 3488.73     106.761  3379.45     121.047  353.412    170.771     129.17      170.771     
1 1 1 6  2  55 o 18 286.873 4.49003 1459.94     69.6833  1462.92     58.9562  173.082    197.787     26.7778     17.7867     
1 1 1 6  2  56 o 6  256.105 3.63733 1202.19     43.611   1126.29     49.3526  88.5346    326.661     155.405     146.661     
1 1 1 6  2  57 f 0  153.852 2.88446 427.014     21.661   413.287     22.7435  57.808     89.0507     0           0           
1 1 1 6  2  58 o 2  150.087 2.93415 406.588     20.7217  393.211     23.2529  63.19      48.4652     59.6998     228.465     
1 1 1 6  2  59 o 5  120.942 2.93631 277.268     16.674   242.842     18.6211  78.0552    233.608     22.6702     233.608     
1 1 1 6  2  60 o 3  277.5   3.69061 1413.46     47.9883  1321.47     54.2155  198.58     247.158     43.179      247.158     
1 1 1 6  2  61 o 8  63.2363 3.0613  78.8796     9.44405  64.082      9.72363  26.2664    347.234     122.039     347.234     
1 1 1 6  2  62 o 15 340.312 4.02599 2125.91     66.5962  1990.74     70.4858  208.347    278.857     19.419      98.8569     
1 1 1 6  2  63 o 12 170.995 2.8685  533.076     23.9384  504.934     25.1612  108.939    231.595     5.47941     231.595     
1 1 1 6  2  64 o 5  61.1064 3.10854 64.2584     9.29761  69.0693     9.613    3.82152    323.968     75.9015     323.968     
1 1 1 6  2  65 o 11 190.942 3.16263 679.627     28.244   616.831     31.906   138.578    61.6803     39.1449     61.6803     
1 1 1 6  2  66 o 5  181.146 2.87733 607.102     26.1151  559.026     26.093   115.815    60.8667     6.00377     60.8667     
1 1 1 6  2  67 o 6  151.994 2.75604 417.573     20.972   403.749     20.9746  80.5933    272.154     26.7998     92.1542     
1 1 1 6  2  68 o 4  120.985 2.65081 268.816     17.4133  251.906     14.6483  49.6845    192.627     48.6058     12.6268     
1 1 1 6  2  69 o 7  74.2613 2.73471 100.684     10.7522  95.9404     9.51927  44.4224    122.3       10.041      122.3       
1 1 1 6  2  70 o 4  47.129  3.58868 36.5655     8.73768  43.7219     7.73773  7.59868    36.7705     30.4273     216.771     
1 1 1 6  2  71 o 15 106.788 2.61008 204.064     15.2567  202.121     12.5108  62.1053    282.313     2.73347     102.313     
1 1 1 6  2  72 o 16 50.9257 3.27058 48.2026     8.75519  45.099      7.75133  8.04481    25.6439     38.2225     205.644     
1 1 1 6  2  73 o 17 55.728  3.21332 50.9952     9.29192  60.8009     8.31435  31.2339    233.301     7.12033     233.301     
1 1 1 6  2  74 f 0  199.215 2.85596 716.811     29.3091  698.767     27.7098  105.061    81.7174     0           0           
1 1 1 6  2  75 o 2  75.0857 2.68508 107.796     11.0133  94.0421     9.13263  38.8418    275.552     11.121      95.5522     
1 1 1 6  2  76 o 18 63.2332 2.89479 77.5066     9.72596  66.2087     8.53447  35.8622    358.659     1.06197     178.659     
1 1 1 6  2  77 o 5  52.1326 3.50258 47.4212     9.18665  51.1204     8.86569  15.3725    301.811     29.185      121.811     
1 1 1 6  2  78 o 3  104.816 3.01615 196.907     16.4815  197.494     15.1043  75.7574    347.695     27.1546     347.695     
1 1 1 6  2  79 o 18 52.767  3.81827 47.2705     10.5843  54.4306     9.07264  26.3139    168.776     6.77549     348.776     
1 1 1 6  2  80 o 12 90.8168 3.02381 156.903     14.7104  140.033     12.7434  43.8248    107.376     19.7423     287.376     
1 1 1 6  2  81 o 7  70.0213 3.51982 96.8683     12.5307  81.3271     11.9782  39.3003    96.193      2.42576     276.193     
1 1 1 6  2  82 o 12 53.0142 4.03549 50.9498     11.0359  52.41       10.0156  13.8697    215.239     33.2504     35.2391     
1 1 1 6  2  83 o 13 28.3344 5.61431 11.0595     9.09748  19.4717     8.02818  1.8874     327.579     26.0856     147.579     
1 1 1 6  2  84 o 17 32.0378 5.71586 24.4139     9.476    16.0534     9.05969  13.3691    186.445     5.67272     6.44501     
1 1 1 6  2  85 o 11 23.5844 5.46875 3.79821     9.0008   14.5468     7.26803  5.76575    207.259     0.472458    27.2594     
1 1 1 6  2  86 o 14 47.0359 5.66203 43.3772     11.1087  43.2118     14.3928  26.5238    95.0498     1.78162     95.0498     
1 1 1 6  2  87 o 5  52.7654 5.89384 52.7021     14.3277  57.2248     15.8109  37.0209    142.479     17.6685     142.479     
1 1 1 6  2  88 o 4  70.6867 5.027   96.0092     17.6667  95.3607     17.4653  46.6651    266.415     14.3788     266.415     
1 1 1 6  2  89 o 19 28.418  8.4384  0.097899    16.887   21.7102     23.7967  5.83751    196.442     14.2741     16.4416     
1 1 1 6  2  90 o 8  42.5757 12.3039 64.0317     59.0057  36.381      27.1223  20.2053    227.181     2.18579     47.1809     
1 1 1 6  2  91 x 8  ?       ?       ?           ?        ?           ?        9.22403    284.781     0           0           
1 1 1 6  2  92 x 5  ?       ?       ?           ?        ?           ?        4.81212    216.82      0           0           
1 1 1 6  2  93 x 0  ?       ?       ?           ?        ?           ?        11.7258    349.458     0           0           
1 1 1 6  2  94 x 6  ?       ?       ?           ?        ?           ?        2.05285    246.651     0           0           
1 1 1 6  2  95 x 19 ?       ?       ?           ?        ?           ?        16.6315    19.1407     0           0           
1 1 1 6  2  96 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 6  3  0  o 18 157.666 2.47096 441.118     19.5021  441.118     19.5021  2.63426    2.91286e-05 79.3786     2.91286e-05 
1 1 1 6  3  1  o 14 907.354 8.07045 14616.5     374.867  14593.2     358.919  654.74     359.435     23.7649     359.435     
1 1 1 6  3  2  o 16 423.746 4.15006 3163.1      90.0107  3201.94     86.1803  288.744    233.733     16.7619     233.733     
1 1 1 6  3  3  o 19 269.805 3.12001 1291.75     42.1865  1288.29     42.1852  116.893    68.1475     42.3367     68.1475     
1 1 1 6  3  4  o 8  443.064 4.40769 3525.2      93.2549  3434.02     102.148  392.603    200.57      235.538     200.57      
1 1 1 6  3  5  o 9  459.145 4.6187  3725.77     108.766  3747.85     103.708  265.675    273.129     93.3358     93.1287     
1 1 1 6  3  6  o 14 438.109 4.32393 3397.61     94.9333  3406.57     94.9343  173.543    51.9168     253.335     231.917     
1 1 1 6  3  7  o 13 232.997 2.76031 980.401     32.2281  943.829     32.2245  70.6189    122.183     6.77824     122.183     
1 1 1 6  3  8  o 10 251.478 2.86959 1121.56     36.1642  1119.87     36.1644  117.349    277.108     13.2586     277.108     
1 1 1 6  3  9  f 0  534.893 4.79296 4994.06     125.906  5150.62     131.056  287.304    139.414     0           0           
1 1 1 6  3  10 o 8  291.175 3.05726 1504.39     43.7092  1500.69     45.4939  58.5601    297.507     263.118     117.507     
1 1 1 6  3  11 o 11 399.527 3.7839  2865.44     74.2087  2793.32     77.2356  147.191    301.864     249.645     121.864     
1 1 1 6  3  12 f 0  370.536 3.6719  2423.14     65.2902  2444.03     70.9819  187.883    152.368     0           0           
1 1 1 6  3  13 o 4  206.742 2.53964 767.471     25.7751  747.509     26.8222  57.0123    103.017     9.86213     283.017     
1 1 1 6  3  14 o 10 508.94  4.60114 4649.56     114.946  4535.47     119.64   263.849    287.445     176.93      107.445     
1 1 1 6  3  15 o 7  737.395 6.36942 9636.19     230.615  9657.32     240.05   472.023    289.283     92.8546     109.283     
1 1 1 6  3  16 o 11 579.123 5.05572 5999.35     140.92   5895.13     152.212  235.602    154.811     339.396     334.811     
1 1 1 6  3  17 o 16 891.026 7.4528  13955.3     319.821  14227.2     345.486  691.828    274.07      128.052     274.07      
1 1 1 6  3  18 o 7  290.607 2.99584 1489.3      41.924   1504.17     45.2869  190.974    64.2652     30.2724     64.2652     
1 1 1 6  3  19 f 0  99.6911 2.03223 187.651     9.70602  165.214     10.4824  219.263    166.167     0           0           
1 1 1 6  3  20 o 7  476.86  4.28454 4080.83     98.3193  3981.16     106.199  365.177    8.08602     81.9405     8.08602     
1 1 1 6  3  21 o 13 1133.72 9.40001 22774.5     513.121  22861.8     554.291  837.668    340.883     73.5668     340.883     
1 1 1 6  3  22 o 2  173.862 2.29669 540.304     19.2171  530.995     20.7605  46.1641    112.625     12.5563     292.625     
1 1 1 6  3  23 o 16 434.591 4.05845 3376.59     86.5842  3318.31     90.124   361.764    270.806     141.27      270.806     
1 1 1 6  3  24 o 15 608.44  5.49242 6603.44     160.292  6521.57     174.268  463.772    89.6186     83.9773     89.6186     
1 1 1 6  3  25 o 7  447.721 4.4185  3624.67     94.4172  3481.46     103.442  377.979    302.848     152.806     302.848     
1 1 1 6  3  26 o 15 516.435 4.88606 4689.05     120.595  4765.38     132.137  368.413    72.7531     26.2048     72.7531     
1 1 1 6  3  27 o 17 984.65  8.90551 17350.9     418.777  17045.3     458.808  628.22     267.755     124.53      87.7553     
1 1 1 6  3  28 o 14 572.666 5.37183 5842.6      154.147  5783.47     154.178  316.287    239.31      161.516     59.3104     
1 1 1 6  3  29 o 5  491.406 4.82095 4267.14     121.495  4292.93     115.865  258.606    295.712     160.018     115.712     
1 1 1 6  3  30 o 14 691.442 6.49656 8469.96     219.663  8482.81     230.44   613.309    250.003     272.112     250.003     
1 1 1 6  3  31 o 1  509.622 4.83688 4607.21     123.516  4599.54     123.545  456.158    263.451     221.469     263.451     
1 1 1 6  3  32 o 16 170.948 2.58517 522.15      21.9592  513.542     22.329   64.9936    232.705     52.0079     52.7052     
1 1 1 6  3  33 o 18 976.554 8.58747 16812.6     429.176  17024.5     411.029  738.057    296.202     121.576     296.202     
1 1 1 6  3  34 o 8  835.979 7.565   12466.3     316.909  12324.8     316.946  647.156    228.201     140.934     228.201     
1 1 1 6  3  35 o 17 691.425 6.26278 8637.24     216.989  8318.17     216.967  441.185    207.947     67.1569     27.9465     
1 1 1 6  3  36 o 7  968.837 9.14892 16666.5     444.2    16654.2     444.205  648.1      295.759     39.778      115.759     
1 1 1 6  3  37 o 19 779.764 7.45501 10821.1     291.321  10752.7     291.319  537.218    206.542     4.94035     206.542     
1 1 1 6  3  38 f 0  773.606 7.56705 10650       301.001  10588.1     285.566  444.758    61.706      0           0           
1 1 1 6  3  39 o 2  339.7   3.88867 2033.23     67.9028  2057.75     64.4287  136.479    20.2315     180.649     200.231     
1 1 1 6  3  40 f 0  250.233 3.1363  1121.78     39.3275  1097.88     39.3291  232.409    135.242     0           0           
1 1 1 6  3  41 o 3  542.589 5.41339 5225.26     147.196  5218.25     147.2    426.514    297.53      119.415     297.53      
1 1 1 6  3  42 o 17 77.5296 2.52045 109.582     10.0127  103.96      9.52217  7.10163    226.281     43.8084     226.281     
1 1 1 6  3  43 o 15 317.694 3.59825 1784.41     57.2805  1794.22     57.2946  186.441    160.314     48.4858     340.315     
1 1 1 6  3  44 o 2  105.969 2.44507 209.221     12.9383  189.492     12.9703  14.4873    327.853     82.4505     147.853     
1 1 1 6  3  45 o 15 293.997 3.38915 1531.29     51.1097  1533.58     48.7276  213.23     154.606     41.4134     154.606     
1 1 1 6  3  46 o 17 458.008 4.59882 3732.61     103.003  3710.69     108.032  391.12     35.6544     171.886     35.6544     
1 1 1 6  3  47 o 4  216.59  3.03222 809.264     34.488   854.443     31.1424  124.437    72.7888     27.7931     252.789     
1 1 1 6  3  48 o 19 53.1805 3.02223 45.6304     7.19543  55.545      8.79759  20.1427    188.489     61.2833     188.489     
1 1 1 6  3  49 o 10 282.421 3.30859 1416.36     45.6723  1412.52     47.9514  195.711    277.868     23.8419     277.868     
1 1 1 6  3  50 f 0  55.7279 2.69999 52.2464     7.27527  58.4747     7.71465  79.0147    313.91      0           0           
1 1 1 6  3  51 o 6  320.377 3.8058  1773.13     61.0697  1869.43     61.1068  250.739    204.89      81.5453     204.89      
1 1 1 6  3  52 o 19 395.135 4.35148 2800.18     83.8407  2742.73     88.3795  311.798    235.974     102.09      235.974     
1 1 1 6  3  53 o 6  42.8084 2.95925 32.8331     5.91754  32.783      6.59532  14.8595    303.104     49.4971     303.104     
1 1 1 6  3  54 o 1  45.8386 2.86779 36.9737     6.42799  38.1362     6.61214  14.7221    159.611     54.5031     159.611     
1 1 1 6  3  55 o 3  194.542 3.30699 638.303     34.3456  705.828     29.6256  104.742    56.0289     38.5769     236.029     
1 1 1 6  3  56 o 11 274.781 3.6066  1365.69     46.9437  1314.34     52.1349  176.109    86.9943     3.08848     266.994     
1 1 1 6  3  57 o 6  218.905 3.09848 874.161     32.9042  826.325     34.9681  133.308    349.1       12.4329     169.1       
1 1 1 6  3  58 o 18 209.293 2.88425 785.171     30.314   768.807     30.1877  147.179    262.851     30.9834     262.851     
1 1 1 6  3  59 o 17 275.871 3.35297 1390.01     46.3994  1311.63     46.2843  172.683    57.0962     8.66458     237.096     
1 1 1 6  3  60 o 3  152.196 2.75197 390.431     21.9832  432.167     19.7574  50.4435    39.2139     89.1738     219.214     
1 1 1 6  3  61 o 9  74.2162 2.80398 99.191      10.5615  96.8057     10.2205  18.9107    21.2955     35.8753     201.295     
1 1 1 6  3  62 o 13 187.818 2.85338 642.456     27.6543  609.661     26.064   121.225    110.72      7.50319     110.72      
1 1 1 6  3  63 o 9  78.173  2.7721  111.674     11.2336  105.804     10.4175  11.889     335.331     66.588      155.331     
1 1 1 6  3  64 o 10 174.407 2.82887 542.109     25.4609  537.804     23.9725  142.148    45.2795     69.3867     45.2795     
1 1 1 6  3  65 o 7  32.2632 4.28268 21.8739     6.95233  16.5611     6.38929  39.0309    225.991     108.677     225.991     
1 1 1 6  3  66 o 12 244.998 3.08543 1052.06     39.7202  1081.28     35.8883  162.33     72.185      15.9603     72.185      
1 1 1 6  3  67 o 1  64.485  3.03814 73.4536     9.91512  75.0321     9.60189  27.9625    70.1414     9.55387     250.141     
1 1 1 6  3  68 o 9  40.3401 3.74151 25.1989     7.58844  34.1119     6.86087  0.394324   54.5504     33.9553     54.5505     
1 1 1 6  3  69 o 3  109.291 2.59253 212.703     14.9131  212.361     13.4054  46.2694    108.738     40.1098     288.738     
1 1 1 6  3  70 o 11 178.916 2.78867 588.856     26.3181  550.562     23.6872  125.281    355.321     30.234      355.321     
1 1 1 6  3  71 f 0  134.209 2.67312 329.226     18.0256  312.423     17.8902  111.949    56.0243     0           0           
1 1 1 6  3  72 o 18 86.7504 2.7169  150.259     12.7708  119.15      10.8203  26.7423    234.271     49.9859     54.2711     
1 1 1 6  3  73 o 14 86.207  2.65826 140.652     12.4795  124.813     10.4329  66.5563    281.04      34.51       281.04      
1 1 1 6  3  74 o 2  145.291 2.69247 392.524     20.506   360.88      18.6769  99.6869    244.999     22.0149     244.999     
1 1 1 6  3  75 o 15 90.7085 2.74941 155.487     13.5915  138.943     11.3407  63.8831    113.648     20.1224     113.648     
1 1 1 6  3  76 o 19 77.3013 2.87123 110.921     12.0979  103.332     10.0325  40.1497    210.434     11.2427     30.4337     
1 1 1 6  3  77 o 10 58.4197 3.36589 75.0043     11.6059  49.6655     8.03032  38.787     114.157     12.5531     114.157     
1 1 1 6  3  78 o 18 23.8173 5.47035 13.647      8.55129  6.98177     6.53696  1.10469    353.553     15.2328     173.553     
1 1 1 6  3  79 o 2  56.2795 3.67932 62.6709     11.6423  52.7964     8.86072  32.5662    255.726     1.67865     255.726     
1 1 1 6  3  80 o 5  35.4539 4.26315 44.6927     8.83967  8.27281     5.83248  2.8407     116.072     45.1296     116.072     
1 1 1 6  3  81 o 15 41.99   4.32241 34.63       10.1987  30.9249     7.33108  25.1146    169.309     7.42603     169.309     
1 1 1 6  3  82 o 17 32.9729 5.03811 5.20783     10.367   35.5087     7.58435  16.2298    339.776     1.73799     339.776     
1 1 1 6  3  83 o 18 26.7288 5.75999 6.78815     8.97136  19.5334     8.90829  9.7591     312.031     2.041       132.031     
1 1 1 6  3  84 o 10 61.5286 3.97849 71.3121     12.1714  68.5338     12.0896  42.6931    206.27      15.8795     206.27      
1 1 1 6  3  85 o 8  66.7272 3.82231 80.5695     12.7087  83.7515     12.6298  47.8543    254.056     20.1911     254.056     
1 1 1 6  3  86 o 6  42.4462 5.42616 36.6587     10.1488  33.7627     11.9607  15.161     230.414     16.4606     50.4136     
1 1 1 6  3  87 o 12 20.5358 6.30462 1.2119      10.4654  0.487397    13.5887  1.38941    36.7894     12.3315     216.789     
1 1 1 6  3  88 o 17 56.6562 5.91404 66.6584     15.9817  60.5004     16.5116  31.3412    67.8326     0.337652    67.8325     
1 1 1 6  3  89 o 18 29.4472 8.64916 11.3695     17.0158  14.5722     25.0067  9.25807    266.613     0.809231    266.613     
1 1 1 6  3  90 o 19 33.0737 9.62055 -3.47437    29.0418  32.8549     26.0888  8.00213    28.1702     4.32267     28.1702     
1 1 1 6  3  91 x 6  ?       ?       ?           ?        ?           ?        36.9923    236.632     0           0           
1 1 1 6  3  92 x 2  ?       ?       ?           ?        ?           ?        14.9447    50.9301     0           0           
1 1 1 6  3  93 x 13 ?       ?       ?           ?        ?           ?        16.4108    126.382     0           0           
1 1 1 6  3  94 x 13 ?       ?       ?           ?        ?           ?        14.4649    19.1748     0           0           
1 1 1 6  3  95 x 11 ?       ?       ?           ?        ?           ?        11.4241    222.924     0           0           
1 1 1 6  3  96 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 6  4  0  o 9  391.053 3.81484 2711.45     74.7284  2711.45     74.7284  353.923    360         155.854     360         
1 1 1 6  4  1  f 0  105.227 2.22136 193.138     11.4449  199.655     11.9575  250.181    162.049     0           0           
1 1 1 6  4  2  o 10 450.04  4.59576 3571.9      110.76   3608.54     95.9299  304.36     121.172     2.00335     121.171     
1 1 1 6  4  3  o 12 465.45  4.5533  3863.72     106.209  3816.88     106.205  372.491    279.584     125.57      279.584     
1 1 1 6  4  4  o 4  647.165 6.03497 7347.47     186.698  7506.6      204.523  380.513    240.153     147.795     60.1533     
1 1 1 6  4  5  o 1  375.341 3.86226 2444.51     72.6313  2550.04     72.6422  242.67     259.924     4.3715      79.924      
1 1 1 6  4  6  o 6  565.937 5.48908 5737.82     151.886  5620.32     159.293  393.635    276.203     3.5103      276.204     
1 1 1 6  4  7  o 18 795.325 7.26353 11193.3     289.499  11251.1     289.505  662.355    33.8076     206.336     33.8076     
1 1 1 6  4  8  o 3  231.602 2.74816 949.68      31.8966  951.474     31.8968  70.6864    2.98316     14.4514     2.98316     
1 1 1 6  4  9  o 4  315.976 3.2799  1765.27     51.936   1773.75     51.9374  220.479    81.6298     73.008      81.6298     
1 1 1 6  4  10 o 8  684.142 6.05396 8338.9      207.56   8265.07     207.559  526.105    129.905     95.276      129.905     
1 1 1 6  4  11 o 19 701.559 6.19381 8739.23     217.759  8722.17     217.765  480.609    177.107     24.4566     357.107     
1 1 1 6  4  12 f 0  278.719 3.03296 1391.66     42.3621  1362.03     42.3615  83.3653    225.265     0           0           
1 1 1 6  4  13 o 2  401.616 3.88628 2859.27     78.2167  2859.17     78.2188  323.089    162.882     124.592     162.882     
1 1 1 6  4  14 o 4  70.5628 2.06854 86.7156     7.30117  90.0678     7.29449  76.0434    192.081     177.416     192.081     
1 1 1 6  4  15 o 10 355.036 3.47309 2269.5      60.5237  2199.18     62.9899  193.864    6.8832      84.5922     186.883     
1 1 1 6  4  16 o 1  279.476 3.04076 1409.01     40.7421  1359.8      44.2869  87.8697    325.5       188.551     145.5       
1 1 1 6  4  17 o 16 735.783 6.33358 9618.29     228.809  9587.77     238.159  496.096    162.58      42.2941     342.58      
1 1 1 6  4  18 f 0  276.776 2.96571 1391.62     40.2792  1324.01     41.9159  61.9526    57.7913     0           0           
1 1 1 6  4  19 o 13 261.327 2.91706 1219.28     38.2008  1201.24     38.2023  110.555    29.6036     111.556     209.604     
1 1 1 6  4  20 o 19 383.812 3.82539 2647.92     71.9365  2574.13     75.1307  225.214    165.087     68.3374     345.087     
1 1 1 6  4  21 o 11 887.697 8.23281 13956.7     357.413  14004.1     374.899  676.359    114.41      103.071     114.41      
1 1 1 6  4  22 o 9  1252.66 11.2118 27932       703.813  27796.4     703.853  966.998    225.92      162.867     225.92      
1 1 1 6  4  23 f 0  160.329 2.42442 464.847     19.04    446.235     19.8867  140.279    1.61941     0           0           
1 1 1 6  4  24 o 11 874.546 8.09069 13424.6     346.11   13705.7     363.019  597.146    170.286     34.8448     350.286     
1 1 1 6  4  25 o 10 1117.2  9.88938 22318.6     516.009  21974.3     588.384  834.417    122.465     96.0555     122.465     
1 1 1 6  4  26 o 14 129.616 2.19774 301.833     13.9771  293.575     14.5583  12.8104    289.657     34.1538     109.657     
1 1 1 6  4  27 o 2  350.893 3.5201  2183.19     61.896   2180.69     61.9038  199.846    73.5329     73.0173     253.533     
1 1 1 6  4  28 o 18 816.894 6.98646 11717.5     280.264  11947.2     291.734  626.107    276.8       112.225     276.8       
1 1 1 6  4  29 o 7  853.552 7.41143 12708.4     303.679  13132.3     330.185  694.806    119.588     199.847     119.588     
1 1 1 6  4  30 o 13 567.663 5.13303 5742.53     139.765  5681.36     151.96   431.122    101.714     80.3016     101.714     
1 1 1 6  4  31 o 18 1398.36 12.1869 34611.8     835.253  34850       872.512  1006.48    84.9151     57.682      84.9151     
1 1 1 6  4  32 o 2  570.775 5.23173 5796.8      152.866  5753.15     146.382  461.967    101.968     143.512     101.968     
1 1 1 6  4  33 o 18 674.515 6.21835 8099.07     210.193  8034.69     210.199  454.092    19.2927     21.5266     199.293     
1 1 1 6  4  34 o 6  533.387 5.3234  5021.14     149.194  5066.04     134.976  306.61     325.996     115.595     145.996     
1 1 1 6  4  35 o 4  752.347 7.60192 10074       286.62   10007.9     286.611  462.75     115.485     110.398     295.485     
1 1 1 6  4  36 o 10 631.575 6.47654 7126.12     204.988  7022.4      204.98   450.437    102.395     38.4452     102.395     
1 1 1 6  4  37 o 1  422.216 4.65488 3173.83     92.8514  3146.65     103.781  325.871    333.091     90.5085     333.091     
1 1 1 6  4  38 o 16 848.377 8.78883 12900.9     362.415  12658.8     384.353  683.523    305.574     203.376     305.574     
1 1 1 6  4  39 o 17 571.078 6.13094 5859.24     170.168  5711.46     180.452  446.689    53.5942     118.094     53.5942     
1 1 1 6  4  40 o 3  316.476 3.71306 1775.82     60.4041  1775.07     57.3344  240.856    229.016     68.0982     229.016     
1 1 1 6  4  41 o 15 62.8144 2.66729 69.5508     8.52587  70.8128     8.18191  32.2043    220.796     96.3529     220.796     
1 1 1 6  4  42 o 5  356.605 4.01492 2276.33     73.6158  2233.23     69.8671  270.362    219.585     67.4608     219.585     
1 1 1 6  4  43 o 18 184.514 2.8955  607.238     26.7404  599.699     26.8064  130.466    316.579     45.7371     316.579     
1 1 1 6  4  44 o 2  138.864 2.63231 336.06      18.722   348.061     17.8515  78.154     199.09      22.5822     199.09      
1 1 1 6  4  45 o 18 133.975 2.51186 318.52      16.7926  318.216     16.9068  62.415     275.776     24.8994     95.7758     
1 1 1 6  4  46 o 13 234.707 3.3264  994.486     40.2299  959.19      38.0204  158.242    288.842     15.5808     288.842     
1 1 1 6  4  47 o 9  531.009 5.6485  5042.31     141.634  4972.74     158.397  403.318    342.1       95.0876     342.1       
1 1 1 6  4  48 o 9  342.518 4.14326 2094.51     68.9377  2068.35     73.2069  251.362    331.057     51.6103     331.057     
1 1 1 6  4  49 o 5  55.3615 2.74376 49.1233     7.21777  60.3756     7.90385  28.243     327.064     96.0225     327.064     
1 1 1 6  4  50 o 14 639.85  6.14227 7227.23     201.534  7328.22     192.193  484.631    230.267     113.835     230.267     
1 1 1 6  4  51 o 8  85.4018 2.34911 120.748     9.72871  138.533     10.3374  31.6834    139.376     4.96751     319.376     
1 1 1 6  4  52 o 2  98.5548 2.48756 170.313     12.7986  174.543     11.6934  38.7519    118.336     33.9393     298.336     
1 1 1 6  4  53 o 14 250.913 3.1311  1121.93     40.2868  1111.35     38.4425  239.207    131.577     161.782     131.577     
1 1 1 6  4  54 o 7  350.012 3.78346 2171.74     61.4741  2176.46     70.9249  253.496    77.2103     48.4921     77.2103     
1 1 1 6  4  55 o 6  565.51  5.58718 5783.5      158.365  5591.63     158.285  383.022    219.736     20.5565     219.736     
1 1 1 6  4  56 o 3  333.499 3.61951 1976.92     61.8953  1970.73     59.0615  205.108    246.241     24.5113     66.241      
1 1 1 6  4  57 o 18 198.859 2.77623 727.48      27.0607  675.716     28.1914  75.5319    276.832     103.479     96.832      
1 1 1 6  4  58 o 8  193.966 2.65073 709.659     27.0884  626.126     24.4659  111.396    224.265     22.3103     44.2651     
1 1 1 6  4  59 o 5  134.977 2.43488 348.052     16.965   299.244     15.9507  82.9326    165.612     5.15702     165.612     
1 1 1 6  4  60 o 1  219.936 2.80551 904.202     32.3661  813.201     29.4985  163.359    279.386     49.8348     279.386     
1 1 1 6  4  61 o 8  53.8771 2.82132 57.8197     7.97361  46.0795     7.14982  0.165402   3.144       39.3848     183.144     
1 1 1 6  4  62 o 17 101.6   2.62619 196.85      13.8571  170.397     12.8425  55.2399    295.98      6.18018     115.98      
1 1 1 6  4  63 o 7  246.137 3.21564 1141.16     41.644   1012.46     37.7166  201.629    236.083     92.1753     236.083     
1 1 1 6  4  64 o 7  199.725 2.9581  738.168     30.4511  679.083     28.7721  140.642    249.887     30.3351     249.887     
1 1 1 6  4  65 o 15 245.489 3.3715  1124.36     42.7697  1019.48     40.1974  155.655    196.756     0.641049    196.756     
1 1 1 6  4  66 o 12 153.063 2.89827 444.55      24.3116  389.438     20.1171  107.309    247.832     26.2974     247.832     
1 1 1 6  4  67 o 6  89.5629 2.76473 143.358     13.3066  142.241     11.3816  46.864     273.189     10.7506     93.189      
1 1 1 6  4  68 f 0  186.823 2.85032 653.181     28.8513  588.794     24.5146  100.983    190.898     0           0           
1 1 1 6  4  69 o 9  76.0597 2.80376 109.195     11.4901  97.3246     9.81365  44.9407    110.119     6.31669     110.119     
1 1 1 6  4  70 o 3  72.8596 2.8348  99.4286     10.8526  90.2149     9.77488  33.9773    99.8778     14.1791     279.878     
1 1 1 6  4  71 o 11 190.269 2.85335 654.726     28.711   634.78      25.6587  123.74     297.228     12.858      297.228     
1 1 1 6  4  72 o 11 109.646 2.57544 217.831     14.5717  210.65      13.6902  64.6809    345.745     2.6218      165.745     
1 1 1 6  4  73 o 6  102.311 2.55299 192.522     13.8169  180.835     12.3152  47.8632    287.625     28.4517     107.625     
1 1 1 6  4  74 o 7  33.8278 4.32725 15.0473     7.17556  28.1566     6.6482   10.7472    75.2595     8.81033     255.26      
1 1 1 6  4  75 f 0  22.4704 3.56575 22.2522     6.28654  -6.15039    4.76747  25.4656    78.6647     0           0           
1 1 1 6  4  76 o 12 33.606  4.58704 18.3527     7.61675  24.029      7.22498  6.83985    137.492     20.7072     317.492     
1 1 1 6  4  77 o 5  21.6793 5.08665 10.8186     6.80824  5.42845     6.32578  2.67573    239.291     21.469      239.291     
1 1 1 6  4  78 o 7  25.6172 5.18281 12.6581     7.19238  12.0451     6.78828  1.54755    122.868     19.4876     302.869     
1 1 1 6  4  79 o 19 53.8456 3.62926 55.7483     10.2442  49.8671     9.11298  24.232     324.816     12.9774     144.816     
1 1 1 6  4  80 o 4  17.3195 4.95077 5.648       7.27914  -1.2378     6.37935  2.21269    8.08737     11.6086     8.08737     
1 1 1 6  4  81 o 9  98.1097 2.89128 182.111     14.8402  164.373     13.5374  69.6129    108.266     23.8478     108.266     
1 1 1 6  4  82 o 9  24.0998 5.6721  8.48078     8.24185  12.3199     7.94501  3.01245    161.72      16.5198     341.72      
1 1 1 6  4  83 o 19 76.0228 3.17674 111.646     12.7377  98.2337     11.3716  43.5401    148.615     1.41224     328.615     
1 1 1 6  4  84 o 4  20.8789 5.48356 9.38013     8.18355  4.05459     7.28329  3.51323    76.0418     8.11736     256.042     
1 1 1 6  4  85 o 14 47.582  4.63366 43.5117     10.4022  42.3222     11.0793  30.3261    62.6037     8.82579     62.6037     
1 1 1 6  4  86 o 15 68.9208 4.35019 81.3957     15.6158  96.9432     13.7161  38.7249    44.7496     1.18768     224.75      
1 1 1 6  4  87 o 2  15.0411 5.00617 -10.1064    10.0078  -7.81363    9.44507  0.488432   143.46      2.81143     143.46      
1 1 1 6  4  88 f 0  33.9947 7.38056 16.483      13.3961  32.3947     14.8866  26.963     319.456     0           0           
1 1 1 6  4  89 o 3  25.2031 7.85357 0.481447    16.2057  4.85429     22.1058  4.27373    48.341      13.2342     228.341     
1 1 1 6  4  90 o 2  45.7295 10.8608 37.0208     31.529   67.2764     29.8484  26.1216    138.517     5.40609     138.517     
1 1 1 6  4  91 o 15 46.6125 20.4264 0           0        77.838      64.4879  11.9869    25.8641     23.0674     205.864     
1 1 1 6  4  92 x 18 ?       ?       ?           ?        ?           ?        22.3143    245.331     0           0           
1 1 1 6  4  93 x 19 ?       ?       ?           ?        ?           ?        17.1127    14.7026     0           0           
1 1 1 6  4  94 x 0  ?       ?       ?           ?        ?           ?        11.1303    184.237     0           0           
1 1 1 6  4  95 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 6  5  0  o 6  68.0693 2.05791 82.549      6.99076  82.549      6.99076  15.5058    180         35.1645     180         
1 1 1 6  5  1  o 6  358.502 3.64676 2284.3      64.0731  2271.65     66.9229  232.124    40.6497     0.466657    220.648     
1 1 1 6  5  2  o 7  650.571 6.05486 7588.42     206.278  7424.59     188.301  493.914    97.7672     78.1301     97.7672     
1 1 1 6  5  3  o 19 793.714 7.08671 11072.6     275.731  11282.1     287.998  604.62     142.623     87.7985     142.623     
1 1 1 6  5  4  f 0  522.144 4.86564 4892.98     130.088  4774.76     124.541  428.364    195.461     0           0           
1 1 1 6  5  5  o 14 493.381 4.77419 4328.02     112.537  4303.59     123.274  294.831    232.06      91.4849     52.0597     
1 1 1 6  5  6  o 13 733.058 6.88603 9471.23     258.87   9598.07     246.836  439.069    300.957     158.663     120.957     
1 1 1 6  5  7  o 15 236.337 2.96974 970.562     35.9756  1009.44     34.3078  81.8781    283.499     113.466     103.499     
1 1 1 6  5  8  o 14 273.083 3.00713 1301.42     41.1485  1342.09     41.1514  143.014    50.6423     42.8635     230.642     
1 1 1 6  5  9  o 1  94.2855 2.13211 154.5       10.0592  160.917     10.0604  48.0035    148.138     131.314     148.138     
1 1 1 6  5  10 o 5  671.389 5.93161 8008.31     199.575  7982.94     199.576  697.564    28.0178     478.455     28.0178     
1 1 1 6  5  11 o 2  603.593 5.39246 6487.95     163.114  6434.5      163.112  476.988    100.752     115.338     100.752     
1 1 1 6  5  12 o 13 280.465 3.04914 1399.83     42.8567  1388.44     42.8558  157.882    357.592     29.258      177.592     
1 1 1 6  5  13 o 1  471.51  4.38839 3936.22     103.694  3946.74     103.695  351.591    322.056     60.6285     322.056     
1 1 1 6  5  14 o 19 480.045 4.44699 4140.83     106.977  4030.46     106.971  293.372    287.029     75.5934     107.029     
1 1 1 6  5  15 o 6  130.022 2.32296 293.528     15.127   305.898     15.1277  4.33013    1.23319     60.5827     1.23319     
1 1 1 6  5  16 o 4  793.243 7.20745 11159.2     286.512  11169.6     286.52   586.065    90.8714     53.6223     90.8714     
1 1 1 6  5  17 o 17 207.411 2.77795 752.53      29.5387  772.268     28.1732  32.8852    359.634     189.175     179.634     
1 1 1 6  5  18 o 17 381.229 4.0865  2573.9      78.0724  2578.18     78.0726  224.167    129.442     67.495      309.442     
1 1 1 6  5  19 o 12 787.995 7.34348 11090       282.957  10938.2     296.756  583.168    236.334     57.0172     236.334     
1 1 1 6  5  20 o 8  930.771 8.57228 15429.6     390.176  15312.2     409.224  716.827    331.005     119.716     331.005     
1 1 1 6  5  21 o 11 635.145 5.76527 7227.93     179.427  7075.84     187.401  468.253    272.794     49.5451     272.794     
1 1 1 6  5  22 o 8  923.709 8.1198  15004.5     367.653  15263.1     384.034  674.226    48.6458     45.9076     48.6457     
1 1 1 6  5  23 o 18 393.308 3.99169 2755.85     78.6774  2727.15     78.6759  195.46     20.1654     148.09      200.165     
1 1 1 6  5  24 o 3  393.682 3.91782 2768.23     75.5834  2725.15     78.94    288.792    35.828      46.292      35.828      
1 1 1 6  5  25 o 1  658.219 5.72405 7689.68     192.556  7670.36     185.006  556.574    27.8984     198.336     27.8984     
1 1 1 6  5  26 o 5  615.502 5.49363 6722.08     169.452  6708.56     169.454  435.665    111.073     15.1524     111.073     
1 1 1 6  5  27 o 19 418.206 4.09909 3095.06     87.752   3104.15     84.0196  256.216    100.952     59.583      280.952     
1 1 1 6  5  28 o 1  1355.3  11.5732 32557.1     786.042  32669.6     786.057  1035.97    44.0065     167.202     44.0065     
1 1 1 6  5  29 o 16 1261.1  11.0392 28071.7     682.397  28397.5     712.766  948.239    274.345     127.554     274.345     
1 1 1 6  5  30 o 16 1036.4  9.11072 18912.8     462.848  19203       483.455  693.671    251.35      61.9638     71.3501     
1 1 1 6  5  31 o 13 183.705 2.59612 600.32      22.7775  595.708     24.9647  3.92007    333.324     222.22      153.324     
1 1 1 6  5  32 o 11 1136.73 9.75636 22809.7     532.208  23058.4     578.619  776.69     256.818     31.3868     76.8181     
1 1 1 6  5  33 o 3  387.342 4.01887 2667.84     70.5438  2650.44     84.7804  316.552    144.764     126.013     144.764     
1 1 1 6  5  34 f 0  549.389 5.4747  5189.58     146.759  5515.16     154.734  339.74     182.334     0           0           
1 1 1 6  5  35 o 13 686.935 6.96918 8405.18     239.958  8334.55     239.869  465.876    260.699     11.9043     80.6989     
1 1 1 6  5  36 o 17 715.11  6.95011 8973.99     255.266  9169.23     242.557  432.496    148.748     118.858     328.748     
1 1 1 6  5  37 o 5  1382.02 13.2282 33700.4     939.688  34303.1     891.511  1075.31    120.24      239.154     120.24      
1 1 1 6  5  38 o 4  761.03  7.68603 10381.5     293.131  10179.3     293.114  609.774    116.537     176.195     116.537     
1 1 1 6  5  39 o 17 267.453 3.42443 1264.82     45.9002  1270.97     45.8961  166.578    170.093     14.2787     350.093     
1 1 1 6  5  40 o 16 1051.94 10.4634 19730.5     551.59   19645.8     551.615  807.68     70.553      170.66      70.553      
1 1 1 6  5  41 o 11 56.7618 2.6589  56.8282     7.47076  57.8804     7.57094  63.1545    76.8981     167.614     76.8981     
1 1 1 6  5  42 o 2  315.008 3.52539 1755.46     54.3119  1762.93     56.9681  200.913    220.436     16.7026     40.4358     
1 1 1 6  5  43 o 13 122.899 2.45985 274.389     14.7608  261.515     15.4764  3.49644    73.0892     141.627     253.089     
1 1 1 6  5  44 o 11 103.664 2.41348 185.504     12.2057  195.91      12.8385  13.2305    49.655      0.922983    229.655     
1 1 1 6  5  45 o 2  122.944 2.44302 267.898     14.6678  268.358     15.3981  51.8199    211.799     27.0013     31.7987     
1 1 1 6  5  46 o 4  554.405 5.68869 5482.53     162.178  5434.19     153.85   366.038    136.24      14.9877     316.24      
1 1 1 6  5  47 o 14 61.8234 2.62765 60.6099     7.63967  75.8177     8.56758  35.6906    158.45      121.064     158.45      
1 1 1 6  5  48 o 4  132.769 2.68583 311.394     17.8145  314.132     17.8896  53.5758    161.483     50.2378     341.483     
1 1 1 6  5  49 o 3  185.61  2.80407 619.785     26.766   601.906     25.3969  101.35     218.859     33.685      38.8593     
1 1 1 6  5  50 o 17 129.48  2.44498 286.082     16.1374  308.969     15.5158  82.2628    62.6361     15.274      62.6361     
1 1 1 6  5  51 o 16 317.788 3.53905 1782.35     57.6479  1800.71     55.0305  211.433    126.049     3.11891     126.049     
1 1 1 6  5  52 o 7  94.7852 2.43103 167.616     12.0859  151.565     10.9783  46.3609    235.833     5.04078     235.833     
1 1 1 6  5  53 o 14 170.33  2.57517 506.785     22.0019  522.1       21.9567  67.5059    207.506     83.033      27.5057     
1 1 1 6  5  54 o 11 82.7073 2.49054 130.111     10.3846  113.198     10.1882  11.6519    344.269     67.637      164.269     
1 1 1 6  5  55 o 7  104.763 2.61783 188.438     14.3776  201.404     12.9709  24.2642    110.288     76.4528     290.288     
1 1 1 6  5  56 o 5  165.882 2.54421 502.232     21.6665  473.874     20.6378  109.238    152.804     13.2426     152.804     
1 1 1 6  5  57 o 11 289.318 3.46993 1513.02     50.3138  1458.17     50.294   219.374    25.682      66.0327     25.682      
1 1 1 6  5  58 o 5  121.905 2.24536 264.263     13.7204  263.078     13.6909  64.55      284.793     14.8789     104.793     
1 1 1 6  5  59 o 18 268.492 3.01635 1288.42     40.6043  1269.62     40.5659  180.201    115.888     15.9735     115.888     
1 1 1 6  5  60 o 9  360.153 3.59537 2308.02     63.461   2298.13     66.2859  298.485    85.9638     133.65      85.9638     
1 1 1 6  5  61 o 8  111.024 2.42528 217.834     13.276   219.848     13.678   47.4079    130.106     38.2336     310.106     
1 1 1 6  5  62 o 10 101.123 2.49819 177.835     12.5327  185.479     12.7479  69.6967    161.499     31.8366     161.499     
1 1 1 6  5  63 o 9  167.966 2.62518 500.272     21.8519  501.072     22.3405  110.758    354.935     11.4317     354.935     
1 1 1 6  5  64 o 12 26.7703 4.64437 11.4306     6.19598  15.1506     6.22305  10.6244    294.556     30.0414     294.556     
1 1 1 6  5  65 o 3  51.8538 3.17669 51.6476     8.15129  44.7619     8.15897  12.9334    10.2571     14.8288     190.257     
1 1 1 6  5  66 o 8  240.261 3.07434 1036.56     37.5322  1015.78     36.5014  141.754    68.5095     20.0622     248.509     
1 1 1 6  5  67 o 5  70.6619 2.78447 92.2626     9.98681  85.8233     9.65515  29.7117    109.569     19.5969     289.569     
1 1 1 6  5  68 o 17 70.2136 2.96627 88.9337     10.5668  87.0915     10.2126  26.5194    342.089     27.0005     162.089     
1 1 1 6  5  69 o 19 56.3913 3.02636 62.1812     8.79685  51.9226     8.17175  21.4305    152.381     14.3176     332.381     
1 1 1 6  5  70 o 5  71.8188 2.6211  97.5541     9.65488  86.6181     9.1468   26.7795    159.636     28.7847     339.636     
1 1 1 6  5  71 o 16 133.485 2.50603 311.621     17.1311  322.878     16.3394  68.8919    67.9067     25.5344     247.907     
1 1 1 6  5  72 f 0  73.3076 3.09754 102.594     11.8829  90.0492     10.7814  32.8347    253.009     0           0           
1 1 1 6  5  73 o 7  129.993 2.51988 294.145     15.9414  308.292     16.861   87.1314    220.091     15.2543     220.091     
1 1 1 6  5  74 o 1  72.9415 3.04228 90.4901     11.132   100.438     10.9772  50.651     310.54      16.4168     310.54      
1 1 1 6  5  75 o 16 45.2681 3.77751 39.1762     8.48596  35.5364     8.31304  10.3402    286.921     30.768      106.921     
1 1 1 6  5  76 o 3  26.8849 5.08643 11.5024     7.14494  15.7464     6.94129  5.99854    205.432     39.4165     205.432     
1 1 1 6  5  77 f 0  89.8701 2.9535  146.463     13.3256  143.534     13.2052  45.9569    195.991     0           0           
1 1 1 6  5  78 f 0  44.9987 3.90698 39.8003     8.70258  34.5612     8.52094  29.1185    327.3       0           0           
1 1 1 6  5  79 o 4  53.9834 3.61174 48.3379     9.68523  57.9561     9.53368  30.668     106.31      0.519944    106.31      
1 1 1 6  5  80 o 13 25.5077 5.30805 14.0639     7.33317  10.4332     7.23322  5.43855    233.099     8.69167     53.0986     
1 1 1 6  5  81 o 2  58.9873 3.40433 62.9693     10.0553  63.5049     9.8952   25.767     299.844     16.7805     119.844     
1 1 1 6  5  82 o 19 49.4752 3.79432 47.757      9.37028  42.3729     9.12779  18.4501    9.98528     19.7749     189.985     
1 1 1 6  5  83 o 4  60.6905 3.61421 70.3357     11.4496  64.7447     10.3339  40.2845    22.2877     11.4336     22.2878     
1 1 1 6  5  84 o 8  30.7884 5.37131 25.1547     9.00121  12.5885     7.83762  13.2217    194.066     4.40307     14.0656     
1 1 1 6  5  85 o 2  27.8179 6.11162 22.9254     10.4389  6.55413     9.76202  9.58328    16.0317     7.17488     196.032     
1 1 1 6  5  86 o 18 64.8508 4.50051 75.6387     15.2512  82.9911     13.3939  41.8921    183.398     10.5685     183.398     
1 1 1 6  5  87 o 11 45.9005 6.09503 41.9858     13.5761  42.5698     13.4337  26.6122    223.851     4.53096     223.851     
1 1 1 6  5  88 o 13 15.0036 5.13579 -46.1921    13.4168  -6.04122    12.0561  0.243872   85.6015     1.09235     85.6015     
1 1 1 6  5  89 o 12 21.1534 6.78984 -5.86495    15.8218  -3.07786    15.4695  3.81026    65.8024     27.2927     65.8024     
1 1 1 6  5  90 o 16 25.7322 12.081  0           0        -13.0179    27.9677  5.5471     91.8684     3.66224     271.868     
1 1 1 6  5  91 o 16 36.9313 15.4696 0           0        30.7245     34.0201  11.7495    191.733     11.7227     11.7327     
1 1 1 6  5  92 x 9  ?       ?       ?           ?        ?           ?        10.7233    305.183     0           0           
1 1 1 6  5  93 x 10 ?       ?       ?           ?        ?           ?        20.022     216.552     0           0           
1 1 1 6  5  94 x 4  ?       ?       ?           ?        ?           ?        8.19341    6.95087     0           0           
1 1 1 6  5  95 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 6  6  0  o 3  358.731 5.08016 2283.3      91.2459  2283.3      91.2459  219.828    5.51577e-06 31.5894     180         
1 1 1 6  6  1  o 10 797.544 6.93974 11283.6     277.275  11283.6     277.275  678.687    210         207.407     210         
1 1 1 6  6  2  o 1  214.381 2.73751 815.196     29.3888  815.196     29.3888  42.1526    240         7.46939     240         
1 1 1 6  6  3  o 18 242.242 2.9442  1040.78     35.7181  1040.78     35.7181  147.07     270         17.3322     270         
1 1 1 6  6  4  o 4  482.729 4.47987 4132.22     108.333  4132.22     108.333  490.718    120         287.254     120         
1 1 1 6  6  5  o 11 814.189 7.39212 11761.4     301.504  11761.4     301.504  631.142    150         89.0964     150         
1 1 1 6  6  6  o 6  227.372 2.84396 916.968     32.3828  916.968     32.3828  12.7163    180         4.87836     180         
1 1 1 6  6  7  o 2  215.61  2.71048 824.549     29.2662  824.549     29.2662  21.5761    30          259.213     210         
1 1 1 6  6  8  f 0  98.3278 2.24526 171.854     11.0376  171.854     11.0376  282.938    240         0           0           
1 1 1 6  6  9  o 10 79.6049 2.11294 112.76      8.40224  112.76      8.40224  61.6888    270         153.543     270         
1 1 1 6  6  10 o 16 554.06  5.23751 5444.38     145.368  5444.38     145.368  638.307    300         482.307     300         
1 1 1 6  6  11 o 9  501.719 5.02054 4464.43     126.176  4464.43     126.176  490.405    330         259.986     330         
1 1 1 6  6  12 o 3  768.547 7.33109 10479.4     282.242  10479.4     282.242  532.804    180         38.1781     9.5216e-06  
1 1 1 6  6  13 f 0  54.0316 2.3623  52.3211     6.33987  52.3211     6.33987  180.767    210         0           0           
1 1 1 6  6  14 o 14 416.201 4.30644 3071.91     89.7786  3071.91     89.7786  399.539    240         203.571     240         
1 1 1 6  6  15 o 13 1255.64 11.6568 27996       733.223  27996       733.223  1002.8     270         206.291     270         
1 1 1 6  6  16 o 3  752.091 7.56617 10034.6     285.042  10034.6     285.042  623.636    300         170.459     300         
1 1 1 6  6  17 o 12 75.3822 2.37286 101.286     8.92343  101.286     8.92343  21.5825    150         55.8239     150         
1 1 1 6  6  18 o 2  471.792 4.82642 3947.17     114.06   3947.17     114.06   354.649    180         35.0757     180         
1 1 1 6  6  19 o 7  85.3362 2.18428 129.539     9.31339  129.539     9.31339  47.7296    210         141.042     210         
1 1 1 6  6  20 o 1  504.598 4.82302 4514.68     121.912  4514.68     121.912  408.408    240         97.2239     240         
1 1 1 6  6  21 o 8  316.451 3.38963 1775.68     53.7273  1775.68     53.7273  294.472    270         143.669     270         
1 1 1 6  6  22 o 11 991.729 8.90473 17444.9     442.402  17444.9     442.402  741.619    300         72.2414     300         
1 1 1 6  6  23 o 18 1035.32 9.22306 19012.6     478.362  19012.6     478.362  908.774    150         346.356     150         
1 1 1 6  6  24 f 0  1150.29 9.75319 23470.2     562.048  23470.2     562.048  746.431    180         0           0           
1 1 1 6  6  25 o 18 65.7036 2.25069 77.0281     7.37099  77.0281     7.37099  113.985    30          281.844     30          
1 1 1 6  6  26 o 16 919.344 8.26431 14990.2     380.616  14990.2     380.616  858.805    240         416.523     240         
1 1 1 6  6  27 o 10 816.383 7.10839 11818.8     290.722  11818.8     290.722  639.534    270         125.385     270         
1 1 1 6  6  28 o 10 37.3539 2.51357 25.3884     4.60137  25.3884     4.60137  18.4574    120         39.6033     120         
1 1 1 6  6  29 o 9  178.657 2.72638 566.352     24.3842  566.352     24.3842  16.8609    330         7.376       330         
1 1 1 6  6  30 o 8  340.153 3.75793 2051.8      64.0243  2051.8      64.0243  194.686    180         89.043      360         
1 1 1 6  6  31 o 15 318.471 3.42464 1798.46     54.6284  1798.46     54.6284  200.294    210         46.4747     30          
1 1 1 6  6  32 o 11 1082.56 9.71286 20793.4     526.746  20793.4     526.746  668.484    60          180.441     240         
1 1 1 6  6  33 o 8  255.624 2.93036 1158.77     37.5168  1158.77     37.5168  58.2962    270         42.8688     270         
1 1 1 6  6  34 o 2  98.2356 2.18404 171.499     10.7279  171.499     10.7279  6.5741     300         32.0881     300         
1 1 1 6  6  35 o 16 343.366 3.61725 2090.68     62.2127  2090.68     62.2127  336.848    150         197.909     150         
1 1 1 6  6  36 o 11 131.37  2.32061 306.375     15.2562  306.375     15.2562  28.6907    360         77.7313     180         
1 1 1 6  6  37 o 3  365.472 3.62345 2368.47     66.3353  2368.47     66.3353  292.637    30          77.8638     30          
1 1 1 6  6  38 o 14 71.2232 2.46277 90.5313     8.74218  90.5313     8.74218  35.8325    240         118.859     240         
1 1 1 6  6  39 o 2  363.225 4.14931 2340.17     75.4843  2340.17     75.4843  251.111    270         0.0400085   270         
1 1 1 6  6  40 o 12 384.417 4.00113 2620.88     77.0431  2620.88     77.0431  277.746    300         25.1684     300         
1 1 1 6  6  41 o 14 308.212 3.58081 1684.98     55.2749  1684.98     55.2749  284.953    330         145.708     330         
1 1 1 6  6  42 o 9  727.581 7.03856 9396.72     256.533  9396.72     256.533  587.937    360         176.679     360         
1 1 1 6  6  43 o 11 112.929 2.63888 226.74      14.8973  226.74      14.8973  37.8627    210         5.68403     210         
1 1 1 6  6  44 o 12 302.849 3.53123 1627.02     53.5606  1627.02     53.5606  208.419    60          2.90486     60.0001     
1 1 1 6  6  45 o 11 467.071 5.03448 3871.37     117.78   3871.37     117.78   418.51     270         200.195     270         
1 1 1 6  6  46 o 15 515.599 5.53762 4718.88     143.011  4718.88     143.011  340.109    300         21.0051     120         
1 1 1 6  6  47 o 19 67.8756 2.60616 82.3704     8.80479  82.3704     8.80479  4.72514    330         49.6688     330         
1 1 1 6  6  48 o 9  511.915 5.49368 4652.23     140.863  4652.23     140.863  309.994    360         72.6179     180         
1 1 1 6  6  49 o 13 452.476 4.47321 3632.86     101.388  3632.86     101.388  310.784    30          11.021      29.9999     
1 1 1 6  6  50 o 7  50.0227 2.91019 45.2466     7.1779   45.2466     7.1779   1.21602    240         9.34845     240         
1 1 1 6  6  51 o 13 14.8372 5.22774 5.74342     4.72017  5.74342     4.72017  0.382951   269.996     0.796593    269.996     
1 1 1 6  6  52 o 16 101.346 2.52354 182.722     12.7807  182.722     12.7807  46.3876    120         39.4026     300         
1 1 1 6  6  53 o 9  28.9171 4.11951 16.5072     5.29093  16.5072     5.29093  4.67318    330         11.138      330         
1 1 1 6  6  54 o 7  322.287 3.26534 1842.67     52.7146  1842.67     52.7146  253.741    6.35878e-07 78.75       6.35878e-07 
1 1 1 6  6  55 o 10 178.78  2.78436 567.408     24.9189  567.408     24.9189  48.9277    30          139.256     210         
1 1 1 6  6  56 o 12 40.3509 3.27046 29.9866     6.38845  29.9866     6.38845  0.571239   239.999     1.85677     239.999     
1 1 1 6  6  57 o 5  102.152 2.59503 185.689     13.2457  185.689     13.2457  55.7058    270         18.7005     90          
1 1 1 6  6  58 o 5  6.57007 3.25258 -4.16145    4.00593  -4.16145    4.00593  19.0527    300         38.4151     300         
1 1 1 6  6  59 o 11 141.663 2.30296 356.285     16.3299  356.285     16.3299  69.7701    330         45.9706     150         
1 1 1 6  6  60 o 7  10.1856 4.50042 1.04541     4.70608  1.04541     4.70608  44.8529    180         91.7861     180         
1 1 1 6  6  61 o 19 419.753 3.92569 3128.19     82.5465  3128.19     82.5465  352.78     30          159.458     30          
1 1 1 6  6  62 o 19 174.807 2.41264 542.386     21.1174  542.386     21.1174  113.915    60          1.1759      59.9999     
1 1 1 6  6  63 f 0  154.506 2.50185 423.964     19.3487  423.964     19.3487  83.9033    270         0           0           
1 1 1 6  6  64 o 3  65.2302 2.85649 76.342      9.25477  76.342      9.25477  6.30961    120         96.2836     120         
1 1 1 6  6  65 o 4  130.763 2.66564 304.065     17.4353  304.065     17.4353  81.6669    150         4.43526     330         
1 1 1 6  6  66 f 0  95.3117 2.47366 161.789     11.7792  161.789     11.7792  71.1911    180         0           0           
1 1 1 6  6  67 o 8  84.2886 2.55896 126.75      10.7637  126.75      10.7637  66.3668    210         28.1928     210         
1 1 1 6  6  68 o 8  46.4613 2.63662 39.0448     6.04526  39.0448     6.04526  14.1891    60          18.705      240         
1 1 1 6  6  69 o 11 265.173 3.33813 1250.98     44.3284  1250.98     44.3284  226.014    270         116.81      270         
1 1 1 6  6  70 o 16 21.6696 6.07213 11.5622     6.35436  11.5622     6.35436  12.5674    120         34.3482     120         
1 1 1 6  6  71 o 2  159.939 2.50784 454.889     20.0785  454.889     20.0785  123.068    330         45.5084     330         
1 1 1 6  6  72 o 5  159.005 2.8941  450.296     23.0268  450.296     23.0268  103.764    0           8.85942     0           
1 1 1 6  6  73 o 8  90.7336 2.86214 147.251     12.9551  147.251     12.9551  66.7195    30          20.5252     30          
1 1 1 6  6  74 o 4  7.14426 3.58122 -6.96248    5.35946  -6.96248    5.35946  0.128072   59.9995     0.27227     59.9995     
1 1 1 6  6  75 o 7  28.6371 5.96471 18.0581     7.43959  18.0581     7.43959  3.71381    90          24.3079     270         
1 1 1 6  6  76 o 2  23.1584 6.4723  13.3151     7.22629  13.3151     7.22629  5.204      300         35.1237     300         
1 1 1 6  6  77 o 2  14.6557 5.87209 5.17054     6.6541   5.17054     6.6541   1.4114     330         4.46768     330         
1 1 1 6  6  78 o 13 56.9223 3.50807 59.1861     9.82483  59.1861     9.82483  26.5469    180         16.278      360         
1 1 1 6  6  79 o 7  58.9025 3.47479 63.2797     10.0869  63.2797     10.0869  34.0268    210         3.41897     30          
1 1 1 6  6  80 o 16 10.5663 4.89589 -0.778983   6.45683  -0.778983   6.45683  5.85326    60          14.721      60          
1 1 1 6  6  81 o 9  67.8947 3.36253 83.6698     11.3097  83.6698     11.3097  50.3002    90          18.9374     90          
1 1 1 6  6  82 o 5  16.8439 6.37651 7.55409     7.36874  7.55409     7.36874  0.864975   120         13.7269     120         
1 1 1 6  6  83 f 0  23.4038 6.82202 14.1001     7.92556  14.1001     7.92556  11.8584    330         0           0           
1 1 1 6  6  84 o 16 12.7985 5.72702 1.5697      7.88819  1.5697      7.88819  5.46472    8.66935e-06 19.0467     8.66935e-06 
1 1 1 6  6  85 o 11 65.0863 5.07534 80.2074     16.0416  80.2074     16.0416  28.7112    210         19.4397     30          
1 1 1 6  6  86 o 4  93.0321 4.26629 159.143     19.6959  159.143     19.6959  71.0201    60          32.6944     60          
1 1 1 6  6  87 o 12 38.0834 8.23357 33.9291     13.7275  33.9291     13.7275  2.84958    90          38.8352     270         
1 1 1 6  6  88 o 11 12.0538 6.02161 -15.8778    14.7225  -15.8778    14.7225  0.2623     120         0.787286    120         
1 1 1 6  6  89 o 19 21.2797 8.99203 11.3574     17.0024  11.3574     17.0024  14.5489    150         53.4943     150         
1 1 1 6  6  90 o 15 25.3335 11.1984 15.7878     29.1718  15.7878     29.1718  8.98107    360         0.140266    360         
1 1 1 6  6  91 o 13 35.8626 13.384  45.5623     32.075   45.5623     32.075   18.1558    30          3.96198     210         
1 1 1 6  6  92 x 15 ?       ?       ?           ?        ?           ?        24.7569    60          0           0           
1 1 1 6  6  93 x 5  ?       ?       ?           ?        ?           ?        17.471     90          0           0           
1 1 1 6  6  94 x 15 ?       ?       ?           ?        ?           ?        10.1448    120         0           0           
1 1 1 6  6  95 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  0  0  o 18 209.263 4.56546 778.172     47.775   778.172     47.775   53.1008    180         262.394     180         
1 1 1 7  0  1  o 9  800.333 6.30974 11356.9     253      11356.9     253      602.425    60          53.2036     60          
1 1 1 7  0  2  o 6  45.2701 1.84387 36.6722     4.15112  36.6722     4.15112  242.633    120         505.02      120         
1 1 1 7  0  3  o 6  1623.33 24.1123 46979.1     1959.63  46979.1     1959.63  1410.41    180         485.445     180         
1 1 1 7  0  4  o 2  225.129 2.50438 898.715     28.239   898.715     28.239   31.27      240         2.66401     60          
1 1 1 7  0  5  o 1  1675.73 35.2214 50417.1     2951.9   50417.1     2951.9   1410.2     300         410.703     300         
1 1 1 7  0  6  o 1  85.4088 1.87182 129.623     7.99431  129.623     7.99431  27.7767    180         66.669      180         
1 1 1 7  0  7  o 8  1083.62 8.02048 20824.1     435.442  20824.1     435.442  1010.16    60          463.096     60          
1 1 1 7  0  8  o 10 301.742 2.8084  1614.15     42.4508  1614.15     42.4508  180.271    120         97.4476     120         
1 1 1 7  0  9  o 1  1521    15.0792 41105.9     1148.88  41105.9     1148.88  1045.1     180         93.6318     1.89261e-06 
1 1 1 7  0  10 o 13 98.6622 1.86747 172.848     9.21852  172.848     9.21852  36.6299    60          98.1657     60          
1 1 1 7  0  11 o 1  144.453 2.11112 370.208     15.2679  370.208     15.2679  11.9584    300         96.1989     300         
1 1 1 7  0  12 o 19 1148.79 9.51464 23417.5     547.594  23417.5     547.594  1000       1.82238e-07 353.466     1.82238e-07 
1 1 1 7  0  13 o 4  393.07  3.45694 2739.2      68.0724  2739.2      68.0724  161.926    60          239.083     240         
1 1 1 7  0  14 o 2  505.96  4.34586 4538.95     110.156  4538.95     110.156  504.464    120         285.929     120         
1 1 1 7  0  15 o 8  33.9575 1.97615 20.8442     3.30872  20.8442     3.30872  103.357    180         212.681     180         
1 1 1 7  0  16 o 6  48.408  1.9496  41.9244     4.6942   41.9244     4.6942   11.6378    240         24.7865     240         
1 1 1 7  0  17 o 1  67.263  1.88589 80.5438     6.33425  80.5438     6.33425  103.382    120         236.223     120         
1 1 1 7  0  18 o 18 430.141 3.8096  3280.5      82.0913  3280.5      82.0913  421.921    1.20356e-05 233.568     1.20356e-05 
1 1 1 7  0  19 o 13 322.893 3.04776 1848.53     49.2977  1848.53     49.2977  189.665    240         79.4857     60          
1 1 1 7  0  20 o 5  140.205 2.10815 348.785     14.7973  348.785     14.7973  74.6088    300         325.774     300         
1 1 1 7  0  21 o 14 228.543 2.5302  926.201     28.9629  926.201     28.9629  143.685    180         13.3951     180         
1 1 1 7  0  22 o 2  288.13  2.91852 1471.98     42.1222  1471.98     42.1222  225.625    60          53.0567     60          
1 1 1 7  0  23 o 18 128.546 1.99021 293.205     12.807   293.205     12.807   18.1633    120         160.28      120         
1 1 1 7  0  24 o 6  2005.12 17.1288 71456.7     1720.62  71456.7     1720.62  1441.45    5.64948e-07 43.1013     5.64947e-07 
1 1 1 7  0  25 o 7  68.1202 1.98136 82.6374     6.73788  82.6374     6.73788  31.5484    240         78.4789     240         
1 1 1 7  0  26 o 3  488.46  4.19012 4229.83     102.535  4229.83     102.535  207.127    120         275.629     300         
1 1 1 7  0  27 o 1  325.588 3.05992 1879.37     49.9076  1879.37     49.9076  95.2915    180         268.591     360         
1 1 1 7  0  28 o 12 118.528 2.35002 249.515     13.9342  249.515     13.9342  1.51719    240         97.9012     240         
1 1 1 7  0  29 o 2  192.052 2.61735 654.275     25.1697  654.275     25.1697  118.302    300         11.2057     300         
1 1 1 7  0  30 o 17 254.739 3.14402 1150.9      40.1091  1150.9      40.1091  226.5      2.41941e-06 125.673     2.41941e-06 
1 1 1 7  0  31 o 9  222.017 3.31045 874.585     36.7957  874.585     36.7957  137.448    240         30.6894     60          
1 1 1 7  0  32 o 17 146.545 2.76217 381.336     20.2527  381.336     20.2527  2.97826    120.001     0.252258    300.001     
1 1 1 7  0  33 o 6  921.543 9.77593 15068.9     451.247  15068.9     451.247  585.701    180         115.38      8.98292e-06 
1 1 1 7  0  34 o 19 1015.89 10.722  18315.9     545.586  18315.9     545.586  830.785    60          245.678     60          
1 1 1 7  0  35 o 10 283.186 3.39654 1422.26     48.1711  1422.26     48.1711  223.378    120         56.8689     120         
1 1 1 7  0  36 o 13 420.838 4.20006 3140.36     88.5392  3140.36     88.5392  292.177    180         0.0794067   180         
1 1 1 7  0  37 f 0  594.581 5.60151 6269.24     166.841  6269.24     166.841  268.568    60          0           0           
1 1 1 7  0  38 o 5  543.646 5.18833 5241.09     141.295  5241.09     141.295  380.834    300         9.96872     300         
1 1 1 7  0  39 o 10 437.954 4.17597 3401.01     91.6154  3401.01     91.6154  317.395    180         30.5171     180         
1 1 1 7  0  40 o 10 862.843 7.24279 13206.8     313.083  13206.8     313.083  686.292    240         184.663     240         
1 1 1 7  0  41 o 4  124.982 2.36316 277.384     14.7775  277.384     14.7775  40.487     300         39.0653     120         
1 1 1 7  0  42 o 6  1250.59 10.2963 27776.5     645.093  27776.5     645.093  924.924    360         135.883     360         
1 1 1 7  0  43 o 11 557.842 4.89533 5518.94     136.806  5518.94     136.806  419.761    240         76.7781     240         
1 1 1 7  0  44 o 2  532.471 4.8902  5028.85     130.442  5028.85     130.442  515.59     300         304.876     300         
1 1 1 7  0  45 o 17 135.944 2.54172 328.185     17.2887  328.185     17.2887  65.1366    180         47.8503     8.65159e-06 
1 1 1 7  0  46 o 19 765.954 7.30899 10416.8     280.441  10416.8     280.441  625.403    240         211.209     240         
1 1 1 7  0  47 o 14 313.545 4.10405 1744.61     64.4373  1744.61     64.4373  257.971    300         91.4723     300         
1 1 1 7  0  48 o 9  172.048 2.87908 525.494     24.7921  525.494     24.7921  15.2411    360         201.805     180         
1 1 1 7  0  49 o 1  417.806 4.85753 3098.17     101.645  3098.17     101.645  337.937    60          113.253     60          
1 1 1 7  0  50 o 10 617.259 6.69067 6767.64     206.856  6767.64     206.856  452.837    120         76.7376     120         
1 1 1 7  0  51 o 14 224.331 3.11155 893.049     34.9503  893.049     34.9503  152.116    360         3.81216     360         
1 1 1 7  0  52 o 18 1207.09 13.5835 26054.7     821.229  26054.7     821.229  847.202    60          82.474      60          
1 1 1 7  0  53 o 3  384.7   4.33476 2626.59     83.5218  2626.59     83.5218  350.72     300         189.208     300         
1 1 1 7  0  54 o 7  225.232 3.30625 900.501     37.2825  900.501     37.2825  160.774    360         22.5352     360         
1 1 1 7  0  55 o 9  157.935 3.1361  443.233     24.7772  443.233     24.7772  146.152    60          87.5285     59.9999     
1 1 1 7  0  56 o 17 127.878 2.41298 290.457     15.4387  290.457     15.4387  68.3639    120         31.4154     300         
1 1 1 7  0  57 f 0  59.8872 2.61662 64.2967     7.78352  64.2967     7.78352  19.8875    180         0           0           
1 1 1 7  0  58 o 17 113.865 2.49392 230.473     14.2     230.473     14.2     82.7845    60          42.8748     60          
1 1 1 7  0  59 o 2  96.3154 2.71566 165.228     13.0604  165.228     13.0604  52.811     300         20.5928     300         
1 1 1 7  0  60 o 19 29.6153 5.24134 18.1935     6.72919  18.1935     6.72919  42.0905    180         101.773     180         
1 1 1 7  0  61 o 9  44.0476 3.72543 35.8599     7.91287  35.8599     7.91287  18.5248    60          71.0793     60          
1 1 1 7  0  62 o 10 35.0002 4.65799 23.9064     7.32507  23.9064     7.32507  30.7853    300         87.6058     300         
1 1 1 7  0  63 o 4  85.8092 2.65746 131.301     11.3777  131.301     11.3777  50.2284    180         25.1318     180         
1 1 1 7  0  64 o 2  367.365 4.12869 2397.48     75.9667  2397.48     75.9667  265.313    240         58.5681     240         
1 1 1 7  0  65 o 3  109.458 2.87171 213.375     15.7031  213.375     15.7031  75.0879    300         10.253      300         
1 1 1 7  0  66 o 9  101.888 2.926   185.072     14.8842  185.072     14.8842  89.1969    180         53.9458     180         
1 1 1 7  0  67 o 10 175.98  2.89724 550.363     25.5198  550.363     25.5198  131.142    60          38.5955     60          
1 1 1 7  0  68 o 14 100.985 2.77049 181.764     13.9728  181.764     13.9728  79.955     300         32.708      300         
1 1 1 7  0  69 o 15 224.235 3.3534  894.268     37.6453  894.268     37.6453  144.825    180         6.76044     180         
1 1 1 7  0  70 o 5  180.791 2.7743  581.064     25.109   581.064     25.109   132.677    60          38.145      60          
1 1 1 7  0  71 o 1  15.6904 5.96936 6.28027     6.48696  6.28027     6.48696  2.1177     300         4.84466     300         
1 1 1 7  0  72 o 13 54.6446 3.35015 54.2722     9.00896  54.2722     9.00896  29.1668    360         2.15366     360         
1 1 1 7  0  73 o 6  147.773 2.73176 388.718     20.1989  388.718     20.1989  123.658    240         63.7926     240         
1 1 1 7  0  74 o 14 54.5571 3.36936 54.1628     9.0435   54.1628     9.0435   25.642     120         16.0728     300         
1 1 1 7  0  75 o 11 9.54864 4.50013 -1.80591    5.83779  -1.80591    5.83779  8.94849    3.59725e-05 19.9591     3.59725e-05 
1 1 1 7  0  76 o 10 54.0715 3.45022 53.3585     9.16547  53.3585     9.16547  27.6043    240         11.0468     60          
1 1 1 7  0  77 f 0  64.9204 3.01526 76.0173     9.71146  76.0173     9.71146  35.6985    300         0           0           
1 1 1 7  0  78 o 13 58.2953 3.29684 61.757      9.48542  61.757      9.48542  25.2426    4.36096e-06 20.4157     180         
1 1 1 7  0  79 o 17 167.331 2.76206 499.445     23.1332  499.445     23.1332  129.498    60          56.3539     60          
1 1 1 7  0  80 o 5  12.5216 5.40819 2.54755     6.43447  2.54755     6.43447  7.45872    120         19.9569     120         
1 1 1 7  0  81 o 1  33.9656 5.2626  23.4774     7.84253  23.4774     7.84253  13.8654    180         11.7762     8.36306e-06 
1 1 1 7  0  82 o 6  32.2372 5.61651 21.8003     7.85558  21.8003     7.85558  17.1779    60          1.14051     240         
1 1 1 7  0  83 o 7  53.8762 3.62377 53.4127     9.56813  53.4127     9.56813  42.9141    300         21.8232     300         
1 1 1 7  0  84 o 17 38.8126 5.66467 30.5581     9.72813  30.5581     9.72813  23.8114    180         2.02268     180         
1 1 1 7  0  85 f 0  52.1334 4.24464 50.9898     10.7083  50.9898     10.7083  13.9608    240         0           0           
1 1 1 7  0  86 o 14 62.0419 4.20244 71.54       12.7733  71.54       12.7733  43.8509    120         14.9291     120         
1 1 1 7  0  87 o 4  46.2663 5.70491 42.6071     12.024   42.6071     12.024   25.0208    180         3.95122     8.65789e-06 
1 1 1 7  0  88 o 6  89.1275 4.48668 146.835     19.8021  146.835     19.8021  44.1799    60          15.1836     240         
1 1 1 7  0  89 o 15 22.9324 9.4922  14.3514     18.258   14.3514     18.258   1.40875    120         26.8056     120         
1 1 1 7  0  90 o 10 22.4715 9.98292 10.0421     23.492   10.0421     23.492   1.51121    7.05048e-07 0.726528    180         
1 1 1 7  0  91 x 12 ?       ?       ?           ?        ?           ?        16.9581    60          0           0           
1 1 1 7  0  92 x 12 ?       ?       ?           ?        ?           ?        5.80606    300         0           0           
1 1 1 7  0  93 x 19 ?       ?       ?           ?        ?           ?        10.1646    180         0           0           
1 1 1 7  0  94 x 18 ?       ?       ?           ?        ?           ?        9.4325     60          0           0           
1 1 1 7  0  95 x 6  ?       ?       ?           ?        ?           ?        9.77496    300         0           0           
1 1 1 7  0  96 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  1  0  o 7  687.102 5.69988 8370.69     196.206  8370.69     196.206  592.586    180         196.161     180         
1 1 1 7  1  1  o 10 393.634 3.60284 2778.88     74.9626  2713.33     67.0478  187.308    227.608     151.424     47.608      
1 1 1 7  1  2  o 15 943.416 7.47915 15800       359.646  15770.7     347.466  726.991    1.58814     117.994     1.58813     
1 1 1 7  1  3  o 8  1161.74 9.53279 23804       584.789  24100.4     523.075  946.73     46.322      240.346     46.322      
1 1 1 7  1  4  o 12 631.24  5.24572 7042.77     165.936  7084.35     165.949  579.614    92.3437     298.531     92.3437     
1 1 1 7  1  5  o 2  1417.63 13.396  35429.4     997.643  36025.3     902.486  1106.53    156.548     188.068     156.548     
1 1 1 7  1  6  o 7  527.891 4.67275 4886.46     128.22   4992.91     118.718  436.913    0.529844    162.652     0.529844    
1 1 1 7  1  7  o 12 740.077 5.86869 9661.07     224.75   9761.16     210.248  631.902    293.737     231.764     293.737     
1 1 1 7  1  8  o 8  603.747 4.82702 6444.69     150.82   6478.37     141.087  249.55     23.4532     347.513     203.453     
1 1 1 7  1  9  o 8  1263.99 10.2817 28336.8     663.191  28408.4     639.124  905.812    353.715     9.90302     353.715     
1 1 1 7  1  10 o 3  672.63  5.36343 8007.01     186.702  8036.01     174.659  570.287    166.033     208.41      166.033     
1 1 1 7  1  11 o 1  159.838 2.15322 450.869     17.5402  454.569     16.9474  7.45785    270.886     140.476     270.886     
1 1 1 7  1  12 o 12 240.324 2.53747 1032.63     31.086   1014.38     30.0333  85.827     141.801     22.8786     141.801     
1 1 1 7  1  13 o 2  92.4411 1.9407  149.079     8.97914  154.055     8.98018  112.815    31.7862     286.919     31.7862     
1 1 1 7  1  14 o 11 496.941 4.15744 4407.75     105.311  4347.87     101.751  391.474    86.8029     110.864     86.8029     
1 1 1 7  1  15 o 19 295.322 2.93532 1584.4      42.5991  1507.47     44.2102  81.662     250.775     223.353     70.7753     
1 1 1 7  1  16 o 11 181.996 2.31488 596.843     20.7071  577.18      21.4941  11.0611    30.6052     5.43346     210.605     
1 1 1 7  1  17 o 14 169.794 2.26905 505.012     18.9449  516.81      19.6699  6.62763    33.0196     194.086     33.0197     
1 1 1 7  1  18 o 14 151.865 2.23346 412.355     16.9903  405.046     17.0044  10.9825    259.313     63.5456     79.3133     
1 1 1 7  1  19 o 15 633.026 5.44892 7144.46     166.032  7067.64     179.353  459.154    36.2154     37.9128     36.2154     
1 1 1 7  1  20 o 15 297.358 2.98577 1559.96     43.6579  1574.1      45.3202  127.288    250.677     133.968     70.6769     
1 1 1 7  1  21 o 16 491.059 4.27015 4380.37     103.045  4169.62     106.943  312.365    247.031     50.23       67.0314     
1 1 1 7  1  22 o 12 611.242 5.17906 6682.92     155.638  6564.38     161.534  392.439    157.83      65.7571     337.83      
1 1 1 7  1  23 o 18 922.342 7.54362 15231.2     342.074  14947.8     355.029  781.479    219.566     269.477     219.566     
1 1 1 7  1  24 o 7  1174.51 9.71388 24648.3     549.149  24313.7     593.182  799.54     195.014     56.3664     15.0142     
1 1 1 7  1  25 o 3  720.79  6.26267 9233.33     212.172  9188.41     239.378  524.4      10.4604     43.2659     10.4603     
1 1 1 7  1  26 o 19 659.251 5.98141 7727.02     193.253  7682.11     201.852  476.32     264.903     36.3218     264.903     
1 1 1 7  1  27 o 5  947.365 8.57355 16075.4     387.907  15762.7     424.936  692.604    348.19      58.8489     348.19      
1 1 1 7  1  28 o 16 964.413 9.15426 16699.1     419.402  16300.6     463.759  712.791    236.714     76.8603     236.714     
1 1 1 7  1  29 o 5  492.782 5.10353 4296.26     122.666  4312.14     129.325  389.206    68.4572     106.577     68.4572     
1 1 1 7  1  30 o 18 475.396 5.08044 4031.36     121.029  3980.47     121.041  224.164    355.342     205.835     175.342     
1 1 1 7  1  31 o 12 422.857 4.51093 3189.73     98.0795  3148.64     93.0674  367.245    124.512     170.052     124.512     
1 1 1 7  1  32 o 6  837.139 7.75351 12546.5     317.336  12312.1     332.868  530.352    162.306     101.722     342.306     
1 1 1 7  1  33 o 9  313.314 3.37164 1720.06     52.9298  1759.33     52.9447  178.725    13.8835     54.25       193.884     
1 1 1 7  1  34 o 11 737.171 6.56876 9521.94     247.794  9750.29     237.277  402.106    356.452     213.527     176.452     
1 1 1 7  1  35 o 5  783.449 7.07797 10746.6     295.187  11025.4     258.913  506.914    175.985     65.1341     355.985     
1 1 1 7  1  36 o 19 695.375 6.35854 8476.46     235.399  8673.32     206.464  437.34     72.9845     78.098      252.984     
1 1 1 7  1  37 o 6  1267.79 11.4003 28333       756.204  28788.3     690.337  877.796    205.075     5.73768     205.076     
1 1 1 7  1  38 o 12 1084.73 9.73011 20672.7     528.904  21120.7     528.915  708.965    182.346     75.1212     2.34625     
1 1 1 7  1  39 o 10 245.775 2.79601 1036.69     34.361   1104.84     34.4926  72.1865    21.8966     173.942     201.897     
1 1 1 7  1  40 o 8  454.648 4.36966 3636.55     92.8751  3692.69     105.912  287.874    73.5916     36.8517     253.592     
1 1 1 7  1  41 o 8  711.637 6.64825 8995.43     214.425  8978.02     257.734  550.669    138.596     132.593     138.596     
1 1 1 7  1  42 o 18 152.21  2.65387 431.108     19.6518  390.867     20.7121  40.6742    326.506     274.635     326.506     
1 1 1 7  1  43 o 17 279.554 3.31451 1363.2      45.3078  1407.65     47.5622  259.871    92.1079     178.829     92.1079     
1 1 1 7  1  44 f 0  114.603 2.37978 246.927     13.6936  219.419     13.5823  45.2084    249.835     0           0           
1 1 1 7  1  45 o 5  244.194 3.00724 1080.28     35.9419  1034.09     37.5928  136.919    289.181     43.9934     109.181     
1 1 1 7  1  46 o 4  459.833 4.53511 3712.59     101.994  3789.79     107.004  308.683    91.8766     1.35968     91.8766     
1 1 1 7  1  47 o 11 403.178 4.73714 2904.83     103.881  2864.13     86.9039  294.857    99.7222     54.1623     99.7222     
1 1 1 7  1  48 o 8  477.67  4.87726 4105.15     122.538  3994.65     110.814  345.365    252.904     54.0027     252.904     
1 1 1 7  1  49 o 10 378.837 4.39808 2556.28     83.5121  2537.06     83.4832  304.081    248.149     109.645     248.149     
1 1 1 7  1  50 o 2  55.274  2.82787 54.956      7.93024  53.9483     7.6296   18.5655    284.077     69.6145     284.077     
1 1 1 7  1  51 o 5  404.298 4.46929 2972.32     90.617   2830.94     90.4518  245.235    209.729     45.4522     29.7295     
1 1 1 7  1  52 o 9  575.293 6.6274  5909.25     184.538  5867.38     197.337  435.937    267.075     107.534     267.075     
1 1 1 7  1  53 o 12 159.762 2.88814 448.305     25.0346  457.294     20.9608  130.771    141.053     74.0708     141.053     
1 1 1 7  1  54 o 7  584.639 6.26329 6143.75     188.857  6019.35     178.092  366.798    260.06      39.44       80.0596     
1 1 1 7  1  55 o 18 442.308 5.96034 3583.8      158.808  3378.38     100.453  324.942    279.98      69.6172     279.98      
1 1 1 7  1  56 o 14 221.608 3.25497 888.028     37.2701  854.607     35.0253  124.649    237.908     34.7646     57.9079     
1 1 1 7  1  57 o 10 351.761 4.06335 2218.97     75.5575  2174.94     67.5512  229.294    116.242     1.50966     116.242     
1 1 1 7  1  58 o 10 113.854 2.59238 241.847     15.2149  218.678     14.3324  59.0291    16.3568     11.6212     196.357     
1 1 1 7  1  59 o 12 200.145 2.99915 705.472     30.0753  715.796     30.0872  83.2392    249.318     87.9647     69.3178     
1 1 1 7  1  60 o 14 463.954 4.93059 3844.25     114.641  3810.74     114.636  346.746    120.94      93.5029     120.94      
1 1 1 7  1  61 o 5  189.253 2.98247 650.036     28.2975  621.128     28.2651  101.957    349.639     33.7901     169.639     
1 1 1 7  1  62 o 9  429.962 4.58954 3417.61     93.1178  3160.42     103.834  347.207    52.5964     142.567     52.5964     
1 1 1 7  1  63 f 0  202.123 3.22348 735.52      30.4637  715.296     34.6407  82.8879    358.52      0           0           
1 1 1 7  1  64 o 12 306.814 4.03915 1710.26     57.4207  1638.28     66.2566  196.059    9.20509     1.22995     9.20529     
1 1 1 7  1  65 o 2  139.051 2.86925 365.344     19.4767  322.556     20.3451  76.4208    220.691     18.4726     40.6913     
1 1 1 7  1  66 o 7  102.121 2.84045 198.298     14.8215  173.145     14.1807  49.378     186.768     23.1258     6.76805     
1 1 1 7  1  67 o 19 219.155 3.26809 890.891     33.6315  818.05      37.8024  121.173    53.3359     32.7138     233.336     
1 1 1 7  1  68 o 14 30.1563 4.90106 13.589      7.3103   20.3437     7.28589  18.9217    158.028     61.5907     158.028     
1 1 1 7  1  69 o 12 192.462 3.23712 635.722     30.1431  683.565     32.3114  118.915    321.191     1.22873     141.191     
1 1 1 7  1  70 o 17 130.967 2.91853 311.621     18.7807  299.557     19.4563  91.8805    247.189     25.9125     247.189     
1 1 1 7  1  71 o 13 152.992 2.91808 404.452     21.2888  429.965     23.4149  85.0542    33.3168     17.2684     213.317     
1 1 1 7  1  72 o 5  111.024 3.04843 227.99      15.9466  212.238     17.7748  72.118     341.135     12.1327     341.135     
1 1 1 7  1  73 o 16 137.147 2.91506 320.878     19.0369  350.698     20.9973  100.757    141.932     35.4404     141.932     
1 1 1 7  1  74 f 0  128.737 2.8962  275.458     17.7199  317.162     19.6184  81.6693    267.117     0           0           
1 1 1 7  1  75 o 7  17.9795 4.95191 6.27246     6.26478  -0.620668   7.20692  11.9744    151.992     37.1507     151.991     
1 1 1 7  1  76 o 18 109.227 2.97354 210.552     16.2444  216.763     16.2454  73.3003    100.209     15.5498     100.209     
1 1 1 7  1  77 f 0  22.4466 5.24929 11.8393     6.70173  4.73113     7.68197  19.4835    127.961     0           0           
1 1 1 7  1  78 o 16 73.0508 3.1682  92.1224     11.2207  100.167     11.8673  28.5742    148.98      29.0911     328.98      
1 1 1 7  1  79 o 7  32.9614 5.06238 25.1834     7.72222  16.2169     8.58702  13.2488    17.5757     0.346785    197.576     
1 1 1 7  1  80 f 0  40.3873 4.76519 30.2741     9.3977   30.8406     9.20921  23.3176    293.221     0           0           
1 1 1 7  1  81 o 1  19.4994 5.28986 2.99502     6.70932  7.02067     7.86174  2.06433    56.1237     17.6637     56.1237     
1 1 1 7  1  82 o 13 95.4097 3.06639 169.481     13.8596  158.919     15.2874  65.9751    219.64      20.2249     219.64      
1 1 1 7  1  83 o 4  70.231  3.66973 86.9841     13.2002  93.2348     12.3877  37.5997    91.0749     6.20466     271.075     
1 1 1 7  1  84 o 8  60.7324 3.71588 78.9837     11.9311  57.3743     10.4305  41.2451    307.911     13.8722     307.911     
1 1 1 7  1  85 o 18 32.074  5.77855 27.9496     10.8532  13.762      8.09816  4.21355    59.3977     26.2186     239.398     
1 1 1 7  1  86 o 8  71.1696 3.68505 99.605      13.1687  87.336      12.9043  34.4677    232.556     12.7034     52.5562     
1 1 1 7  1  87 o 17 30.7207 6.76898 21.5282     12.1948  16.8918     10.9193  10.6288    248.424     8.82473     68.4236     
1 1 1 7  1  88 o 15 28.0436 7.18635 11.5846     12.9636  17.8761     13.2467  7.14514    187.206     11.4285     7.20579     
1 1 1 7  1  89 o 12 44.5948 8.72504 40.7438     19.788   49.0161     20.6181  23.6916    333.326     16.7439     333.326     
1 1 1 7  1  90 o 8  20.086  6.85335 -26.512     19.7341  -20.7798    21.4998  1.23734    307.621     11.6263     127.621     
1 1 1 7  1  91 x 7  ?       ?       ?           ?        ?           ?        20.343     259.195     0           0           
1 1 1 7  1  92 x 1  ?       ?       ?           ?        ?           ?        16.4623    238.1       0           0           
1 1 1 7  1  93 x 10 ?       ?       ?           ?        ?           ?        15.4997    144.92      0           0           
1 1 1 7  1  94 x 19 ?       ?       ?           ?        ?           ?        14.1715    198.736     0           0           
1 1 1 7  1  95 x 16 ?       ?       ?           ?        ?           ?        9.039      155.001     0           0           
1 1 1 7  1  96 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  2  0  o 16 169.484 2.39137 509.584     20.293   509.584     20.293   6.41328    180         32.2308     9.83652e-06 
1 1 1 7  2  1  o 2  126.045 2.1433  285.325     13.5374  277.737     13.5377  75.6504    24.7059     245.674     24.7059     
1 1 1 7  2  2  o 19 553.982 4.84784 5494.89     134.582  5385.59     134.583  339.97     154.889     87.6415     334.889     
1 1 1 7  2  3  o 4  483.052 4.51349 4190.09     109.255  4082.23     109.254  366.847    156.038     84.2208     156.038     
1 1 1 7  2  4  o 8  141.729 2.25673 350.119     15.0497  361.816     16.9783  10.7355    287.3       68.9053     287.3       
1 1 1 7  2  5  o 2  189.417 2.58482 623.361     22.9071  648.342     26.1164  29.8024    12.8848     93.3939     192.885     
1 1 1 7  2  6  f 0  960.304 9.19133 16227.3     463.7    16511.2     419.436  526.725    224.311     0           0           
1 1 1 7  2  7  f 0  312.997 3.15614 1734.74     47.5644  1737.6      51.3771  313.581    194.062     0           0           
1 1 1 7  2  8  o 17 363.693 3.4958  2347.15     61.2112  2341.4      66.1181  287.918    55.6774     151.228     55.6774     
1 1 1 7  2  9  o 7  191.085 2.42711 667.335     22.2977  627.066     24.0802  10.77      230.81      236.473     230.81      
1 1 1 7  2  10 o 5  145.936 2.2165  372.326     15.5796  382.504     16.8316  4.99578    240.595     71.4116     240.595     
1 1 1 7  2  11 o 8  570.168 4.96631 5766.86     136.33   5761.09     147.263  416.655    79.8349     45.608      79.8349     
1 1 1 7  2  12 o 11 471.109 4.35046 3963.09     96.3044  3906.27     108.652  388.491    301.513     148.248     301.513     
1 1 1 7  2  13 o 3  761.888 6.41164 10203.7     235.262  10392.3     254.141  465.689    24.2521     143.019     204.252     
1 1 1 7  2  14 o 8  167.574 2.25656 486.807     18.5959  508.554     19.3066  46.7505    328.274     283.277     328.274     
1 1 1 7  2  15 o 5  48.8036 1.95522 40.3306     4.66216  44.4009     4.86181  110.078    314.85      235.089     314.85      
1 1 1 7  2  16 o 18 576.53  4.8274  5887.88     139.462  5899.17     139.487  341.638    316.792     119.782     136.792     
1 1 1 7  2  17 o 8  74.7912 2.00566 103.334     7.19093  95.2773     7.77164  46.3077    199.99      112.502     199.99      
1 1 1 7  2  18 o 19 183.357 2.25991 594.464     20.7631  597.057     20.7684  34.4247    197.747     126.423     17.7474     
1 1 1 7  2  19 o 4  297.481 2.92557 1561.75     43.6089  1574.88     43.6195  189.267    44.7544     5.0288      44.7544     
1 1 1 7  2  20 o 1  300.513 3.01109 1574.56     44.499   1626.51     46.1977  203.184    47.9171     30.1691     47.9171     
1 1 1 7  2  21 o 17 400.011 3.60867 2879.08     70.9549  2792.9      73.6467  357.852    144.175     199.816     144.175     
1 1 1 7  2  22 o 14 821.346 7.19788 12120.9     283.468  11809.4     308.198  586.948    1.62273     20.4612     1.62272     
1 1 1 7  2  23 o 18 273.503 3.02403 1344.86     40.5139  1306.45     42.3301  160.794    172.441     25.1699     352.441     
1 1 1 7  2  24 o 10 403.514 4.10127 2919.34     79.02    2852.23     86.5811  349.033    322.211     164.738     322.211     
1 1 1 7  2  25 o 11 835.797 7.61136 12486.8     303.824  12289.1     332.872  700.7      169.455     232.788     169.455     
1 1 1 7  2  26 o 13 1006.3  9.2172  17935.3     453.58   17992.6     475.831  640.062    226.873     133.698     46.8729     
1 1 1 7  2  27 o 2  568.781 5.41481 5824.39     147.032  5645.15     161.087  379.558    163.642     28.2393     343.642     
1 1 1 7  2  28 o 18 931.34  8.25264 15801.6     376.382  14971.6     393.128  676.309    60.3152     49.9113     60.3153     
1 1 1 7  2  29 o 11 621.71  5.73443 6837.37     178.65   6866.3      178.679  388.696    203.83      85.0363     23.8304     
1 1 1 7  2  30 o 13 775.617 6.62305 10703.1     262.534  10629.4     252.265  536.694    48.6481     5.75302     228.648     
1 1 1 7  2  31 o 13 377.166 3.8446  2490.09     72.6495  2552.23     72.6786  264.611    315.122     23.7965     315.122     
1 1 1 7  2  32 f 0  299.015 3.21893 1591.58     49.2688  1577.32     47.188   200.23     210.179     0           0           
1 1 1 7  2  33 o 17 407.361 3.97104 2868.63     82.7301  3014.25     79.2428  358.773    87.1499     183.878     87.1499     
1 1 1 7  2  34 o 9  107.594 2.30464 202.675     12.6561  207.981     12.155   87.8784    68.8291     289.188     68.8291     
1 1 1 7  2  35 o 5  993.219 8.90216 17333.8     443.04   17679.4     443.127  635.939    2.46132     101.764     182.461     
1 1 1 7  2  36 o 5  541.868 5.11446 5168.97     132.453  5241.79     145.111  437.319    310.144     144.514     310.144     
1 1 1 7  2  37 o 11 720.988 6.63136 9163.47     228.497  9276.24     250.336  505.218    80.6642     23.1858     80.6642     
1 1 1 7  2  38 f 0  431.172 4.30093 3248.22     88.6574  3343.2      97.1246  356.043    341.744     0           0           
1 1 1 7  2  39 o 3  666.264 6.8632  7993.31     241.753  7759.61     216.188  450.978    193.07      7.6794      13.0697     
1 1 1 7  2  40 o 11 715.979 7.08062 9089.96     260.658  9105.55     247.269  498.373    350.676     18.8527     350.676     
1 1 1 7  2  41 o 17 348.92  3.78379 2197.97     66.1549  2118.84     66.154   209.72     319.065     45.7926     139.065     
1 1 1 7  2  42 o 10 374.356 4.00644 2536.6      71.4283  2433.32     78.5555  274.965    243.217     51.5892     243.217     
1 1 1 7  2  43 o 8  256.237 3.01982 1194.56     40.3181  1133.46     37.2373  207.691    229.246     91.848      229.246     
1 1 1 7  2  44 o 6  265.657 3.48105 1284.12     48.9073  1218.71     43.7474  168.338    271.656     10.5109     91.6559     
1 1 1 7  2  45 o 5  314.754 3.74271 1766.83     57.4507  1746.67     60.561   190.016    325.606     37.1311     145.606     
1 1 1 7  2  46 f 0  627.261 6.06874 6958.93     186.187  7016.33     195.277  321.292    258.13      0           0           
1 1 1 7  2  47 f 0  390.674 4.12027 2674.19     80.3177  2740.91     81.0163  191.599    117.453     0           0           
1 1 1 7  2  48 o 4  317.125 3.83008 1784.91     59.0543  1782.76     62.6294  215.396    191.955     14.5204     191.955     
1 1 1 7  2  49 o 12 110.532 2.62869 219.518     14.1922  214.159     14.8698  38.9219    70.2115     39.8736     250.212     
1 1 1 7  2  50 o 6  402.903 4.63675 2879.71     90.8254  2883.14     96.3391  292.153    194.539     50.5007     194.539     
1 1 1 7  2  51 o 2  273.323 3.55958 1302.08     50.1282  1348.42     47.2826  171.116    36.1209     15.8589     216.121     
1 1 1 7  2  52 o 4  429.779 4.94611 3333.06     103.28   3228.35     109.564  315.679    78.0498     62.3891     78.0498     
1 1 1 7  2  53 o 2  374.659 4.60587 2523.74     86.4648  2461.46     86.4818  251.585    25.2881     9.56963     25.2881     
1 1 1 7  2  54 o 10 571.437 6.79019 5759.63     194.401  5870.5      194.489  432.721    48.1407     110.565     48.1407     
1 1 1 7  2  55 o 1  359.648 5.4964  2432.73     112.42   2170.66     85.1209  275.034    70.689      80.7393     70.689      
1 1 1 7  2  56 o 4  149.13  3.04204 413.801     21.8799  376.275     23.4036  78.7213    169.191     26.4901     349.191     
1 1 1 7  2  57 o 4  57.4049 3.03266 54.8251     8.78291  62.8761     8.48052  1.17247    36.3235     13.8011     216.324     
1 1 1 7  2  58 o 1  205.607 3.26099 778.38      33.5665  722.31      33.5984  97.4581    192.476     67.0463     12.4758     
1 1 1 7  2  59 o 2  216.007 3.264   822.414     35.3011  833.484     35.3639  155.824    96.3856     39.6413     96.3856     
1 1 1 7  2  60 o 6  233.028 3.30137 944.734     37.3983  982.865     39.7081  106.424    279.823     84.9675     99.8235     
1 1 1 7  2  61 o 2  188.272 2.82876 642.443     26.8308  615.442     26.5445  129.355    169.002     24.2198     169.002     
1 1 1 7  2  62 o 14 69.2424 2.84063 91.274      9.74938  79.65       9.83733  21.0374    163.766     23.4827     343.766     
1 1 1 7  2  63 o 9  212.705 2.90121 812.882     31.0686  793.268     30.7817  162.19     101.923     57.2244     101.923     
1 1 1 7  2  64 o 6  163.006 2.67206 486.479     21.9902  456.927     21.6585  74.5433    224.784     55.3805     44.7844     
1 1 1 7  2  65 o 7  144.044 2.62981 370.776     19.1464  366.375     18.789   101.053    259.232     25.9842     259.232     
1 1 1 7  2  66 o 17 141.281 2.62038 363.728     18.711   345.707     18.3608  71.4182    222.112     31.8309     42.1125     
1 1 1 7  2  67 o 15 172.823 2.69471 538.228     23.4922  522.979     23.1848  97.4982    182.528     20.2409     2.52834     
1 1 1 7  2  68 o 3  24.5852 4.74019 10.0298     6.35578  12.1864     5.70993  9.80298    291.96      28.3902     291.96      
1 1 1 7  2  69 o 8  74.4971 2.87692 100.731     10.8427  97.2998     10.5576  13.1546    236.723     61.5182     56.7226     
1 1 1 7  2  70 o 18 178.128 2.68962 588.844     25.2986  540.496     22.7284  126.776    166.995     34.2946     166.995     
1 1 1 7  2  71 o 4  187.534 2.79666 660.207     27.034   592.912     25.5347  119.825    189.04      8.55356     189.04      
1 1 1 7  2  72 o 11 35.9787 4.40383 25.7415     7.52183  22.0677     7.74629  6.06662    337.407     47.0667     337.407     
1 1 1 7  2  73 f 0  85.9827 2.71506 135.888     12.2936  128.12      11.0406  45.8769    337.864     0           0           
1 1 1 7  2  74 o 7  81.3453 2.91353 118.359     11.8747  118.401     11.8021  68.0838    350.154     43.4435     350.154     
1 1 1 7  2  75 o 18 27.9446 4.83524 5.93918     7.74238  22.8264     6.91272  2.2164     25.2276     20.2074     205.228     
1 1 1 7  2  76 o 18 31.5175 4.83571 21.3535     7.26878  16.1287     7.58977  4.61406    316.657     22.0902     136.657     
1 1 1 7  2  77 o 9  34.8701 4.5617  19.5765     7.52997  26.0983     7.79853  5.80352    117.191     25.3894     297.191     
1 1 1 7  2  78 o 19 15.0168 4.49811 -5.54925    5.77274  3.93169     6.59742  1.52467    93.9308     4.91945     93.9308     
1 1 1 7  2  79 o 3  63.2551 3.37773 74.3399     10.1633  70.4905     11.0394  50.8745    85.5359     33.8799     85.5359     
1 1 1 7  2  80 o 4  56.4941 3.47409 54.1271     9.80682  61.9079     9.61348  28.6143    295.815     7.14382     115.815     
1 1 1 7  2  81 o 4  90.9614 2.8616  154.049     13.055   143.585     12.9591  58.2399    316.386     9.65422     316.386     
1 1 1 7  2  82 o 10 109.82  2.92769 237.91      16.7454  197.388     15.4131  64.1504    51.5436     1.46819     231.544     
1 1 1 7  2  83 o 12 76.5724 3.34118 109.499     13.0329  103.631     12.4867  52.0387    212.976     15.4706     212.976     
1 1 1 7  2  84 o 18 89.1735 3.14154 156.903     14.6739  132.247     13.3219  45.1035    66.2981     13.9802     246.298     
1 1 1 7  2  85 o 4  32.4736 5.56953 27.2748     9.49775  14.8079     8.77637  9.69957    207.379     14.9488     27.3786     
1 1 1 7  2  86 o 9  63.8866 3.87022 75.4833     12.1475  75.8888     12.395   37.5494    345.037     2.68113     345.037     
1 1 1 7  2  87 o 4  54.8653 5.62832 54.996      15.5685  62.8614     14.2448  37.0503    348.737     14.5376     348.737     
1 1 1 7  2  88 o 19 23.301  6.528   5.69928     12.3599  9.15257     10.5037  2.86787    330.229     1.77581     150.229     
1 1 1 7  2  89 o 8  25.9588 7.26939 -3.53342    17.57    16.9443     13.3243  5.43994    32.9924     11.5264     212.992     
1 1 1 7  2  90 o 4  28.0937 8.3291  17.6455     17.9994  -7.11977    24.7626  8.6708     52.8261     2.03203     52.8261     
1 1 1 7  2  91 x 16 ?       ?       ?           ?        ?           ?        26.3117    50.2287     0           0           
1 1 1 7  2  92 x 14 ?       ?       ?           ?        ?           ?        20.1044    357.129     0           0           
1 1 1 7  2  93 x 2  ?       ?       ?           ?        ?           ?        7.32482    0.145892    0           0           
1 1 1 7  2  94 x 11 ?       ?       ?           ?        ?           ?        6.62975    92.2287     0           0           
1 1 1 7  2  95 x 11 ?       ?       ?           ?        ?           ?        4.43779    203.945     0           0           
1 1 1 7  2  96 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  3  0  o 3  707.547 6.5146  8878.76     230.907  8878.76     230.907  615.427    180         211.643     180         
1 1 1 7  3  1  o 6  243.667 2.89135 1054.6      36.0678  1049.77     34.5325  107.164    213.84      4.02642     213.84      
1 1 1 7  3  2  o 5  1111.85 9.58142 22064.9     533.869  21833       533.863  777.773    343.879     31.0087     163.88      
1 1 1 7  3  3  o 15 119.519 2.3537  247.461     14.4065  259.264     13.7317  46.3801    301.892     156.585     301.892     
1 1 1 7  3  4  o 5  894.58  8.40636 14235.5     348.859  14170.2     402.803  739.442    14.081      213.485     14.081      
1 1 1 7  3  5  o 17 516.458 5.10374 4600.63     122.487  4858.92     141.463  308.367    112.105     97.312      292.105     
1 1 1 7  3  6  o 9  554.123 5.74411 5437.99     171.624  5451.69     146.361  537.172    76.6463     337.154     76.6463     
1 1 1 7  3  7  o 7  483.063 4.52035 4192.99     104.708  4080.8      113.823  469.567    291.699     356.814     291.699     
1 1 1 7  3  8  o 5  354.584 3.46564 2258.72     60.3209  2198.32     62.7794  97.572     204.64      284.436     24.6404     
1 1 1 7  3  9  o 19 95.2066 2.0891  157.236     9.95409  164.356     9.95307  53.5179    353.638     144.136     353.638     
1 1 1 7  3  10 o 7  432.883 4.03842 3351.55     85.8206  3292.13     89.3233  282.494    176.818     19.9976     356.818     
1 1 1 7  3  11 o 9  469.684 4.38671 3904.21     103.253  3917.71     103.254  242.064    1.13442     163.594     181.134     
1 1 1 7  3  12 o 1  352.285 3.44702 2226.99     59.609   2172.61     62.0401  228.344    40.2523     1.32242     220.251     
1 1 1 7  3  13 o 6  762.617 6.44307 10360.4     236.537  10276.4     255.497  586.154    255.221     99.7929     255.221     
1 1 1 7  3  14 o 1  670.921 5.73579 7983.63     185.279  7984        200.138  488.593    28.4778     37.9303     28.4778     
1 1 1 7  3  15 o 5  210.322 2.51051 791.853     25.4143  776.019     27.4462  58.5207    151.492     124.738     331.492     
1 1 1 7  3  16 o 14 374.366 3.55727 2502.34     64.0988  2465.94     69.2379  278.25     41.6776     66.6013     41.6776     
1 1 1 7  3  17 o 18 593.465 5.14814 6198.46     147.134  6291.47     158.941  363.195    45.6665     102.385     225.667     
1 1 1 7  3  18 o 5  237.015 2.72649 1008.9      31.7192  982.222     33.0153  69.3329    320.053     159.486     140.053     
1 1 1 7  3  19 o 8  443.119 4.20964 3486.78     89.491   3474.1      97.294   195.047    273.977     221.814     93.977      
1 1 1 7  3  20 o 11 394.685 3.88388 2744.23     75.133   2777.68     78.4895  325.517    167.994     131.037     167.994     
1 1 1 7  3  21 o 4  1032.63 9.10252 18984.5     460.64   18861.5     481.165  679.184    229.186     101.371     49.1864     
1 1 1 7  3  22 o 15 685.833 6.21012 8391.71     208.708  8287.51     218.009  418.335    86.5742     124.79      266.574     
1 1 1 7  3  23 o 9  361.696 3.6929  2329.43     65.4549  2307.49     68.3738  192.641    216.63      104.647     36.6302     
1 1 1 7  3  24 o 12 310.942 3.28054 1726.05     48.9257  1700.69     53.1902  221.596    254.259     40.705      254.259     
1 1 1 7  3  25 f 0  1237.02 11.4372 27470.7     655.796  26858.3     757.35   814.294    333.501     0           0           
1 1 1 7  3  26 o 4  530.383 5.00756 5042.56     124.009  4929.76     141.41   355.082    268.298     23.1467     88.2981     
1 1 1 7  3  27 o 3  822.366 7.39341 12183.4     283.797  11802.1     323.603  619.02     357.403     88.4167     357.403     
1 1 1 7  3  28 f 0  177.83  2.51555 552.427     20.9093  568.353     23.8679  142.481    336.735     0           0           
1 1 1 7  3  29 o 17 467.115 4.34531 3885.87     97.3487  3848.49     105.869  236.268    42.4139     171.11      222.414     
1 1 1 7  3  30 o 13 97.9927 2.22233 170.766     10.6255  169.889     11.165   3.75128    84.6842     30.0324     84.6842     
1 1 1 7  3  31 o 9  712.098 6.24101 9002.31     222.696  8978.38     222.74   438.94     240.422     110.557     60.4224     
1 1 1 7  3  32 o 7  291.501 3.15026 1535.18     47.0139  1476.73     45.0305  230.115    117.473     102.087     117.473     
1 1 1 7  3  33 o 1  421.187 3.96544 3116.41     83.6779  3171.84     83.7183  291.175    181.487     16.5987     181.487     
1 1 1 7  3  34 o 11 839.868 7.59433 12359       333.582  12666.1     304.647  542.987    89.6516     75.3354     269.652     
1 1 1 7  3  35 o 12 841.641 7.58726 12428.3     319.941  12704.4     320.064  558.449    310.63      43.9592     130.63      
1 1 1 7  3  36 o 17 270.858 3.27965 1310.19     46.7081  1290.22     42.247   190.448    149.88      52.4006     149.88      
1 1 1 7  3  37 o 15 223.59  2.87936 878.529     33.007   893.415     31.4873  75.1346    320.158     131.906     140.158     
1 1 1 7  3  38 o 1  1064.39 9.99967 20275.6     533.345  19984       533.416  670.672    168.74      125.719     348.741     
1 1 1 7  3  39 o 1  803.54  7.61816 11534.2     306.807  11388.3     306.731  563.79     220.61      25.7207     220.61      
1 1 1 7  3  40 o 4  520.388 5.21398 4814.69     135.974  4790.8      135.974  391.99     86.8677     78.8461     86.8677     
1 1 1 7  3  41 o 16 525.294 5.23003 4931.62     137.678  4857.09     137.674  504.003    132.64      303.012     132.64      
1 1 1 7  3  42 o 12 626.998 6.15019 6973.79     193.251  6980.3      193.245  459.854    355.815     67.5531     355.815     
1 1 1 7  3  43 o 12 369.649 4.0972  2429.42     73.861   2416.59     77.8733  236.912    358.043     21.0247     178.043     
1 1 1 7  3  44 o 5  474.232 4.97089 4049.58     114.927  3931.08     121.152  296.794    164.329     46.3973     344.329     
1 1 1 7  3  45 o 17 174.268 3.22087 538.359     25.0499  538.933     30.8705  118.264    53.2606     30.3861     53.2606     
1 1 1 7  3  46 o 1  190.613 3.11831 673.398     26.8451  616.021     32.1748  118.646    100.808     0.284697    100.807     
1 1 1 7  3  47 o 12 221.019 3.14942 808.48      33.8105  925.794     35.9488  141.81     155.566     2.08455     155.566     
1 1 1 7  3  48 o 9  336.276 4.13091 1997.28     63.1643  2015.21     75.5637  177.018    75.2592     91.8964     255.259     
1 1 1 7  3  49 o 14 141.005 2.74142 362.18      19.4951  343.466     19.208   69.054     233.769     30.8024     53.7687     
1 1 1 7  3  50 o 8  519.106 5.47439 4919.65     142.391  4656.16     142.357  399.381    26.9322     106.674     26.9322     
1 1 1 7  3  51 o 6  242.354 3.1363  1037.75     39.0889  1045.52     37.0588  208.13     241.249     104.834     241.249     
1 1 1 7  3  52 o 5  181.985 2.76365 601.969     25.5142  572.702     24.8948  113.449    266.029     4.81605     86.0291     
1 1 1 7  3  53 o 3  131.601 2.59299 295.86      18.2871  318.793     15.6727  40.9705    225.577     82.2346     45.5775     
1 1 1 7  3  54 o 8  585.814 5.98114 6103.73     180.09   6106.44     170.971  415.616    228.831     56.4911     228.831     
1 1 1 7  3  55 o 16 114.057 2.70856 244.4       16.3004  217.89      14.6317  58.148     310.539     15.1374     130.539     
1 1 1 7  3  56 o 14 83.5759 3.02421 122.004     13.9813  126.464     11.0283  10.9389    28.5374     70.6788     208.537     
1 1 1 7  3  57 o 18 132.977 2.63418 323.126     18.0375  304.682     17.0402  80.5377    140.758     3.69123     140.758     
1 1 1 7  3  58 o 17 346.153 3.98834 2116.61     74.3805  2138.66     63.5023  232.985    31.4681     17.3911     31.4681     
1 1 1 7  3  59 o 1  428.991 4.35961 3319.9      98.4316  3219.84     88.9043  325.496    263.063     94.8139     263.063     
1 1 1 7  3  60 o 6  265.31  3.25014 1256.13     45.3948  1242.32     40.9395  167.758    109.694     4.01222     289.694     
1 1 1 7  3  61 o 8  173.15  2.88748 549.454     25.862   514.772     24.2554  123.388    6.51589     32.8947     6.51589     
1 1 1 7  3  62 o 18 41.6056 3.57779 29.2393     7.60497  33.2242     6.90181  5.45256    133.296     31.7207     133.296     
1 1 1 7  3  63 o 8  74.8697 2.75534 105.63      10.4193  94.0437     10.1719  34.7014    99.3434     8.96416     279.343     
1 1 1 7  3  64 o 12 201.073 3.01263 766.87      29.5768  670.717     30.9288  126.948    55.7438     0.387833    55.7441     
1 1 1 7  3  65 o 3  58.2487 3.11036 66.6425     9.39362  54.8958     8.62387  10.7365    278.612     39.5892     98.612      
1 1 1 7  3  66 o 5  357.577 4.15339 2289.99     78.4475  2266.7      70.2153  276.254    306.936     99.0537     306.936     
1 1 1 7  3  67 o 18 186.185 2.79678 644.224     26.9272  588.424     25.2722  128.7      29.0385     25.5565     29.0385     
1 1 1 7  3  68 o 17 105.381 2.65651 209.729     14.5275  185.857     13.491   54.1011    15.5888     18.7674     195.589     
1 1 1 7  3  69 o 3  50.2402 3.29758 52.5374     8.51105  38.6867     7.83647  13.1659    295.369     0.910097    295.369     
1 1 1 7  3  70 o 18 30.5818 4.45501 20.4993     6.95421  14.4412     6.27374  11.0117    60.2973     45.0176     60.2973     
1 1 1 7  3  71 o 12 97.3651 2.64309 177.133     13.5573  160.972     12.1949  63.6135    64.5184     13.7151     64.5184     
1 1 1 7  3  72 o 16 169.807 2.66705 548.045     23.9099  479.969     21.503   107.335    64.9156     5.82718     64.9156     
1 1 1 7  3  73 o 2  156.031 2.60862 465.385     21.5166  403.064     19.2989  100.703    92.7187     9.84777     92.7187     
1 1 1 7  3  74 o 12 58.1314 3.04358 58.4252     9.22477  62.9937     8.30707  14.6912    100.105     39.0739     280.105     
1 1 1 7  3  75 o 1  75.453  2.83181 108.134     11.6859  95.9762     9.64692  34.1837    263.166     21.4968     83.1656     
1 1 1 7  3  76 o 1  21.4425 5.02755 8.66423     6.65759  7.4047      5.94143  3.07667    216.14      21.1957     216.14      
1 1 1 7  3  77 o 7  75.2129 2.95652 109.283     11.8071  94.242      10.4067  38.7406    257.598     11.3673     77.5976     
1 1 1 7  3  78 o 6  68.9418 3.27001 83.699      11.0618  87.8818     11.4037  43.5664    184.106     7.27749     184.106     
1 1 1 7  3  79 o 16 29.1505 4.93902 9.23129     7.37256  23.3875     7.48358  7.57609    255.148     46.6191     255.148     
1 1 1 7  3  80 o 14 56.899  3.83589 61.053      11.3368  57.2252     10.2728  28.754     103.949     7.47558     283.949     
1 1 1 7  3  81 o 13 27.5945 5.34142 7.32295     9.18707  20.3116     7.30152  3.43677    325.552     20.7783     145.552     
1 1 1 7  3  82 o 10 85.4539 3.45694 145.779     14.8676  120.027     14.5356  52.6198    236.987     5.08381     236.987     
1 1 1 7  3  83 o 4  54.4769 4.13753 52.2583     12.0797  57.7169     9.82842  25.1081    9.82745     12.1303     189.827     
1 1 1 7  3  84 o 5  85.3111 3.72855 129.39      17.1402  137.682     14.3231  61.9092    308.766     25.06       308.766     
1 1 1 7  3  85 o 15 60.5356 4.3229  71.2989     13.4843  65.9045     12.3896  34.8196    59.3223     0.857977    59.3222     
1 1 1 7  3  86 o 4  58.8842 4.47039 57.1        13.2809  74.0923     12.2521  42.0449    219.295     18.986      219.295     
1 1 1 7  3  87 o 11 65.1255 5.16857 100.554     16.5767  64.3629     15.9019  32.1465    213.771     9.40618     33.7712     
1 1 1 7  3  88 o 6  22.6078 6.50403 5.11355     12.405   6.98703     10.802   2.09761    125.881     13.4031     305.881     
1 1 1 7  3  89 o 17 31.3188 7.60704 0.555221    17.7258  32.381      15.626   11.2941    306.763     4.47594     306.763     
1 1 1 7  3  90 o 2  27.9282 8.45415 11.8314     17.7473  1.4109      25.5691  9.73541    52.9236     4.97666     232.924     
1 1 1 7  3  91 o 12 66.1753 23.425  0           0        174.656     68.6609  40.0212    143.899     15.4534     143.899     
1 1 1 7  3  92 x 8  ?       ?       ?           ?        ?           ?        22.2664    210.566     0           0           
1 1 1 7  3  93 x 1  ?       ?       ?           ?        ?           ?        13.3321    244.888     0           0           
1 1 1 7  3  94 x 14 ?       ?       ?           ?        ?           ?        3.2774     197.271     0           0           
1 1 1 7  3  95 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  4  0  o 18 498.206 4.57184 4401.23     114.103  4401.23     114.103  317.825    180         82.3494     360         
1 1 1 7  4  1  o 6  434.777 4.22777 3338.4      90.0972  3363.37     94.1067  268.318    264.06      53.8045     84.0601     
1 1 1 7  4  2  o 13 680.92  6.17341 8214.67     215.18   8232.34     206.029  549.865    234.045     146.864     234.045     
1 1 1 7  4  3  o 15 378.468 3.79251 2540.77     73.4796  2537.03     70.3504  273.389    342.288     56.0936     342.288     
1 1 1 7  4  4  o 5  553.921 5.36846 5424.35     145.446  5457.33     152.539  251.067    60.0182     274.367     240.018     
1 1 1 7  4  5  o 13 736.589 6.77688 9512.72     238.629  9740.1      261.411  367.245    7.50573     309.936     187.506     
1 1 1 7  4  6  o 15 805.215 7.33837 11583.6     296.115  11429.4     296.12   589.736    127.847     40.1727     127.847     
1 1 1 7  4  7  o 16 367.673 3.81515 2367.09     73.3751  2425.57     66.9865  290.704    27.0093     120.833     27.0093     
1 1 1 7  4  8  o 3  105.116 2.21137 202.6       11.3719  189.465     11.8682  3.79186    26.9808     12.0539     26.9808     
1 1 1 7  4  9  o 10 262.176 2.91889 1227.36     38.3502  1209.06     38.349   145.491    271.706     7.87639     91.7061     
1 1 1 7  4  10 o 15 580.166 5.33275 5996.83     158.392  5941.68     151.657  389.517    260.703     30.1219     80.7035     
1 1 1 7  4  11 f 0  458.243 4.38666 3663.32     102.851  3782.88     98.4871  349.937    256.567     0           0           
1 1 1 7  4  12 o 10 221.256 2.67042 866.126     29.608   869.008     29.6115  55.8447    257.407     154.254     77.4074     
1 1 1 7  4  13 o 15 809.905 6.91052 11656.3     274.804  11622.3     286.032  562.423    53.9224     20.5198     233.922     
1 1 1 7  4  14 o 13 940.181 8.11423 15759.5     382.31   15625.8     382.311  759.206    159.901     187.021     159.901     
1 1 1 7  4  15 o 18 259.644 3.03376 1195.33     39.474   1194.22     39.4757  163.425    183.762     66.7504     183.762     
1 1 1 7  4  16 o 2  905.954 8.37339 14511.3     371.009  14627.2     389.163  681.214    261.362     80.5352     261.362     
1 1 1 7  4  17 o 7  477.223 4.62608 4047.01     110.632  4027.48     110.638  307.257    288.902     43.4828     108.902     
1 1 1 7  4  18 o 17 695.005 6.56102 8685.16     222.92   8448.72     233.802  660.941    257.079     356.014     257.079     
1 1 1 7  4  19 o 15 524.327 5.13202 4875.03     131.595  4872.18     138.026  369.991    94.0208     13.9132     94.0207     
1 1 1 7  4  20 o 19 297.582 3.35148 1592.71     48.7575  1546.16     51.1326  188.276    25.0222     7.65603     205.022     
1 1 1 7  4  21 o 4  708.158 6.35535 8873.04     220.588  8909.85     230.411  441.509    40.3358     112.316     220.336     
1 1 1 7  4  22 o 9  483.438 4.41973 4119.04     104.73   4165.42     109.397  449.019    38.5254     244.486     38.5254     
1 1 1 7  4  23 o 16 38.5486 2.31984 28.9842     4.20817  24.1722     4.59057  79.4818    333.107     169.025     333.107     
1 1 1 7  4  24 o 19 615.53  5.5336  6752.89     163.384  6679.06     177.624  486.343    201.876     117.038     201.876     
1 1 1 7  4  25 o 13 872.917 7.59559 13504.9     318.124  13519.4     345.857  764.85     204.745     306.793     204.745     
1 1 1 7  4  26 o 16 273.266 2.94876 1354.09     39.5386  1292.78     41.1551  187.295    18.4682     27.7579     18.4682     
1 1 1 7  4  27 o 17 221.812 2.64643 906.186     28.0943  838.14      30.5595  147.863    136.664     56.0387     136.664     
1 1 1 7  4  28 o 17 600.202 5.64849 6332.4      162.042  6439.81     177.524  365.955    148.536     102.603     328.536     
1 1 1 7  4  29 o 6  520.065 4.88477 4781.28     118.727  4806.79     135.39   374.709    249.924     33.2858     249.924     
1 1 1 7  4  30 o 16 541.557 5.24541 5267.32     128.589  5130.72     154.577  500.181    100.669     263.484     100.669     
1 1 1 7  4  31 o 17 937.961 8.56467 15652.1     364.006  15563.1     437.564  742.963    270.022     180.185     270.022     
1 1 1 7  4  32 o 19 150.411 2.5493  398.333     18.2337  403.461     20.1616  37.4512    32.242      28.2998     212.242     
1 1 1 7  4  33 o 2  333.824 3.72522 1998.82     55.7851  1951.33     68.091   160.348    187.846     123         7.84562     
1 1 1 7  4  34 o 16 416.475 4.45003 3003.39     90.4266  3146.41     95.3408  353.002    32.0365     160.199     32.0365     
1 1 1 7  4  35 o 10 567.589 5.58274 5669.8      158.773  5754.37     158.814  403.754    55.833      33.798      55.8329     
1 1 1 7  4  36 o 3  598.033 5.83089 6359.7      174.724  6324.45     174.777  405.494    293.532     6.75842     113.532     
1 1 1 7  4  37 o 5  414.379 4.22982 3042.97     89.8789  3044.72     85.7462  268.225    9.89735     20.8928     189.897     
1 1 1 7  4  38 f 0  56.1635 2.58796 54.4537     7.26848  57.847      7.21294  58.2163    335.149     0           0           
1 1 1 7  4  39 o 1  82.3628 2.39483 118.069     10.2148  122.794     9.48095  17.8931    41.4273     88.9583     41.4273     
1 1 1 7  4  40 o 2  559.687 5.68699 5575.39     155.203  5538.75     163.674  421.274    250.153     81.2947     250.153     
1 1 1 7  4  41 o 7  134.626 2.53775 306.877     17.0042  336.347     17.1888  24.208     295.022     9.06537     295.022     
1 1 1 7  4  42 o 9  395.216 4.30025 2823.7      82.8368  2716.64     87.3335  223.989    93.0614     84.9184     273.061     
1 1 1 7  4  43 o 10 129.761 2.58161 312.379     16.2403  285.286     17.2168  37.0775    166.901     78.6861     346.901     
1 1 1 7  4  44 o 3  598.662 5.949   6434.65     169.212  6292.39     187.077  477.043    359.849     143.954     359.849     
1 1 1 7  4  45 o 3  151.091 2.59702 393.175     18.646   416.296     20.6758  88.8087    184.21      4.75647     184.21      
1 1 1 7  4  46 o 3  234.877 3.08835 977.608     36.3611  978.622     36.3426  188.335    258.927     81.2496     258.927     
1 1 1 7  4  47 o 13 116.028 2.68025 241.147     15.5452  236.69      15.5809  4.01505    20.3464     147.364     20.3464     
1 1 1 7  4  48 o 16 309.457 3.56888 1705.53     55.336   1691.47     55.357   214.279    227.587     21.1355     227.587     
1 1 1 7  4  49 o 9  349.263 3.8549  2168.9      67.4746  2159.27     67.4701  204.594    354.728     54.8465     174.728     
1 1 1 7  4  50 o 8  187.049 2.67251 630.075     25.044   610.619     25.0543  159.312    50.4925     89.6426     50.4925     
1 1 1 7  4  51 o 17 418.298 4.19029 3116.9      87.8445  3094.18     87.8341  346.666    349.957     138.763     349.957     
1 1 1 7  4  52 o 12 23.5618 3.98941 11.761      4.92132  8.814       4.40105  39.9311    242.01      88.5258     242.01      
1 1 1 7  4  53 o 12 204.47  2.9553  757.211     33.1997  725.893     27.1816  175.087    31.7787     94.7757     31.7787     
1 1 1 7  4  54 o 14 158.571 2.84338 448.812     23.15    443.368     22.0125  70.5763    319.378     59.0677     139.378     
1 1 1 7  4  55 o 17 348.468 3.96038 2163.63     75.362   2147.66     62.3931  213.705    21.492      29.0447     201.492     
1 1 1 7  4  56 o 15 341.993 4.32421 2133.97     84.5822  2021.36     62.5367  228.424    22.4293     10.905      22.4293     
1 1 1 7  4  57 o 10 67.1053 2.78598 84.5347     9.96002  75.8701     8.70065  4.9856     291.3       77.9968     291.3       
1 1 1 7  4  58 o 2  238.204 3.0299  1038.49     37.3723  975.279     34.9746  150.154    80.3383     4.64251     260.338     
1 1 1 7  4  59 o 6  124.766 2.56524 298.51      17.1574  254.974     14.9106  61.2474    348.284     27.4497     168.284     
1 1 1 7  4  60 o 16 349.982 3.92535 2236.33     75.5986  2116.02     61.7348  253.498    233.142     55.7783     233.142     
1 1 1 7  4  61 o 9  135.478 2.61789 346.61      18.7854  305.749     16.746   96.4219    247.138     31.5111     247.138     
1 1 1 7  4  62 o 4  178.486 2.78329 576.804     26.8959  554.033     22.8007  113.208    94.9973     2.23337     94.9973     
1 1 1 7  4  63 o 19 166.834 2.75655 520.097     24.9143  468.652     21.1751  159.491    117.628     122.302     117.628     
1 1 1 7  4  64 o 17 81.1157 2.85027 115.326     11.9637  118.937     11.104   24.0322    5.39675     16.4025     5.39675     
1 1 1 7  4  65 o 2  284.772 3.44782 1473.29     50.5898  1411.26     47.8221  195.195    40.7839     28.7604     40.7839     
1 1 1 7  4  66 o 12 130.72  2.787   311.986     18.3639  295.841     18.1054  82.0718    164.713     4.25627     164.713     
1 1 1 7  4  67 o 10 167.942 2.84086 518.98      24.0408  484.029     23.7651  112.15     244.428     15.7233     244.428     
1 1 1 7  4  68 o 5  84.3116 2.75638 135.896     11.693   117.743     11.5032  35.9869    133.976     27.5933     313.976     
1 1 1 7  4  69 o 14 196.381 2.86328 712.482     28.2665  660.587     28.0681  160.87     269.86      79.0194     269.86      
1 1 1 7  4  70 o 10 70.5634 2.83515 91.794      10.05    86.1099     9.91483  39.6843    244.073     3.41805     244.073     
1 1 1 7  4  71 o 2  70.6114 2.80671 90.0863     10.0959  88.0725     9.6873   20.8012    200.46      40.6486     20.4604     
1 1 1 7  4  72 o 12 30.1303 4.43386 20.6623     6.62342  13.4146     6.35955  0.701537   113.906     24.8657     113.906     
1 1 1 7  4  73 o 11 57.7712 3.00878 67.6999     8.83886  52.5571     8.39975  33.3596    67.6317     1.06345     67.6317     
1 1 1 7  4  74 o 3  50.4141 3.3031  43.9152     8.50297  47.8635     7.94422  13.1425    329.694     32.0041     149.694     
1 1 1 7  4  75 o 4  43.1334 3.75296 42.7078     7.92061  26.1644     7.60053  24.5776    99.4671     9.37366     99.4671     
1 1 1 7  4  76 o 12 21.4269 5.01123 4.83883     7.31754  10.1526     5.74824  5.30454    72.4817     28.0415     72.4817     
1 1 1 7  4  77 o 7  94.143  2.75609 156.323     13.7307  161.34      12.1379  62.9081    16.0901     13.7259     16.0901     
1 1 1 7  4  78 o 14 19.9453 4.61505 11.6721     6.04905  0.620887    5.76874  2.82469    224.156     19.4117     224.156     
1 1 1 7  4  79 o 8  65.8751 3.28108 82.7592     12.3926  74.2579     9.00436  23.9387    192.213     29.4763     12.2131     
1 1 1 7  4  80 o 2  22.2053 5.45096 5.79719     8.54204  10.1049     6.69477  2.06316    338.093     9.86299     158.093     
1 1 1 7  4  81 o 19 34.3119 5.56465 14.3125     10.7928  30.938      8.53733  17.7726    212.986     4.48716     212.986     
1 1 1 7  4  82 o 15 26.0645 5.6974  16.3417     9.08088  9.61223     7.44524  8.68264    105.172     0.166673    285.172     
1 1 1 7  4  83 o 3  86.9987 3.33922 148.967     16.1806  126.884     12.8252  55.8403    246.497     9.97861     246.497     
1 1 1 7  4  84 o 4  75.1859 3.81598 95.0424     14.2965  113.564     14.1541  49.8128    146.358     12.7962     146.358     
1 1 1 7  4  85 o 16 66.9265 4.09246 88.6833     13.6609  78.2012     13.4842  36.3178    191.873     4.15835     11.8727     
1 1 1 7  4  86 o 10 24.2138 6.55776 1.93206     14.3572  12.721      9.53635  1.28162    15.3439     0.0409281   15.3439     
1 1 1 7  4  87 o 13 54.7849 5.45534 54.7869     14.5471  62.4535     14.5101  27.943     32.5828     4.99314     212.583     
1 1 1 7  4  88 o 14 40.7001 7.2548  25.4278     17.3939  44.2226     13.5142  16.9024    201.061     8.79984     21.0614     
1 1 1 7  4  89 o 14 32.9509 8.25852 29.5725     18.2514  15.7184     16.3659  14.9166    155.306     0.29729     335.306     
1 1 1 7  4  90 o 14 46.278  8.5271  80.0526     20.9684  -2.42853    34.8887  21.4179    295.156     7.05549     115.156     
1 1 1 7  4  91 o 3  32.2871 14.2423 0           0        14.0115     31.8286  11.1787    304.619     1.65596     124.619     
1 1 1 7  4  92 x 5  ?       ?       ?           ?        ?           ?        33.1081    80.0449     0           0           
1 1 1 7  4  93 x 4  ?       ?       ?           ?        ?           ?        9.61049    331.997     0           0           
1 1 1 7  4  94 x 14 ?       ?       ?           ?        ?           ?        10.3861    29.9619     0           0           
1 1 1 7  4  95 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  5  0  o 3  179.361 2.47448 570.703     22.2229  570.703     22.2229  13.0876    360         9.70305     180         
1 1 1 7  5  1  o 9  530.508 4.96018 4953.69     128.988  5027.15     134.729  367.694    147.497     0.303247    327.493     
1 1 1 7  5  2  o 13 818.539 7.2838  11980.9     305.255  11801.2     292.258  608.118    293.947     55.274      293.947     
1 1 1 7  5  3  o 5  275.163 3.07734 1340.3      43.3466  1343.53     41.5013  149.455    241.254     34.4814     61.254      
1 1 1 7  5  4  o 5  574.927 5.39566 5863.48     155.461  5860.38     155.458  339.01     292.536     128.07      112.536     
1 1 1 7  5  5  f 0  473.023 4.63031 4017.81     104.591  3916.79     114.565  236.14     68.5697     0           0           
1 1 1 7  5  6  o 8  330.244 3.51238 1970.8      58.1241  1895.81     58.1189  230.208    33.127      43.6149     33.127      
1 1 1 7  5  7  o 6  418.196 4.1537  3090.68     87.0506  3110.16     87.0513  122.594    211.249     334.625     31.2493     
1 1 1 7  5  8  o 16 581.775 5.45656 6024.23     159.086  5981.08     159.087  477.262    313.159     147.711     313.159     
1 1 1 7  5  9  o 15 484.693 4.48962 4152.44     109.051  4177.82     109.054  401.614    194.863     144.896     194.863     
1 1 1 7  5  10 o 15 193.702 2.76204 645.827     26.8007  684.345     26.8061  45.0905    345.204     120.424     165.204     
1 1 1 7  5  11 o 17 138.113 2.56635 328.728     18.1916  347.745     17.266   18.9801    324.42      152.184     324.42      
1 1 1 7  5  12 o 4  325.722 3.65484 1879.49     59.6584  1881.56     59.6593  262.06     292.47      158.507     292.47      
1 1 1 7  5  13 o 13 93.7432 2.33118 157.699     10.9348  154.148     10.9332  50.8479    198.629     148.389     198.629     
1 1 1 7  5  14 f 0  989.907 9.48986 17352.1     482.962  17455       458.185  637.567    28.851      0           0           
1 1 1 7  5  15 o 18 578.305 5.83158 5821.15     173.282  6040.81     164.407  401.278    87.4896     5.33263     267.49      
1 1 1 7  5  16 o 15 436.576 4.40382 3339.02     98.5795  3418.2      94.0016  308.154    97.4082     19.9648     97.4082     
1 1 1 7  5  17 o 11 104.982 2.23424 206.817     11.7276  184.445     11.7255  93.2313    6.99195     288.064     6.99195     
1 1 1 7  5  18 o 8  455.208 4.46462 3648.64     97.1345  3697.06     106.409  225.242    353.994     181.319     173.994     
1 1 1 7  5  19 o 15 733.518 6.72064 9533.58     235.554  9547.79     258.046  621.666    339.57      213.973     339.57      
1 1 1 7  5  20 o 18 841.719 7.46789 12580.1     308.072  12548.8     321.782  588.43     177.735     11.97       357.735     
1 1 1 7  5  21 o 4  354.971 3.60947 2232.86     62.7967  2233.15     65.5913  298.063    238.196     132.695     238.196     
1 1 1 7  5  22 o 17 673.164 6.08317 8015.37     200.708  8051.29     209.646  520.16     182.513     98.0333     182.513     
1 1 1 7  5  23 o 17 456.776 4.34861 3674.86     97.3633  3720.79     101.701  463.006    355.868     324.092     355.868     
1 1 1 7  5  24 o 9  933.824 8.17171 15301.4     356.804  15630.8     406.887  754.388    338.399     194.482     338.399     
1 1 1 7  5  25 o 1  750.719 6.86947 9953.84     246.439  10031.3     269.993  600.798    246.602     150.868     246.602     
1 1 1 7  5  26 o 17 195.857 2.67198 687.225     24.9957  672.293     27.3739  109.931    275.747     10.4377     275.747     
1 1 1 7  5  27 o 12 77.1056 2.25348 105.079     8.07144  105.975     9.26898  19.7352    100.409     61.5271     100.409     
1 1 1 7  5  28 o 11 90.0283 2.50468 137.293     10.9792  150.547     11.579   16.7688    74.3907     72.7661     74.3907     
1 1 1 7  5  29 o 10 1310.45 12.0069 30512.2     729.928  30488.6     842.973  958.093    104.914     76.5117     104.914     
1 1 1 7  5  30 o 13 584.096 5.36066 5906.45     160.162  6190.92     153.368  352.304    30.5384     103.836     210.538     
1 1 1 7  5  31 o 3  357.254 3.66248 2269.69     64.1241  2254.16     66.9765  151.617    40.8038     179.454     220.804     
1 1 1 7  5  32 o 2  292.137 3.16214 1520.65     45.2682  1504.21     47.2865  213.132    335.52      61.8648     335.52      
1 1 1 7  5  33 o 11 477.21  4.52081 3988.18     105.752  4085.41     110.472  283.285    321.876     82.8145     141.876     
1 1 1 7  5  34 o 6  186.493 2.6047  625.142     23.7644  607.563     24.8896  73.6256    115.553     58.1769     295.553     
1 1 1 7  5  35 o 18 692.395 6.06935 8677.82     201.411  8327.8      218.989  544.919    239.587     138.79      239.587     
1 1 1 7  5  36 o 5  606.129 5.45731 6488.54     154.585  6541        176.323  346.675    300.829     139.352     120.829     
1 1 1 7  5  37 o 17 1238.23 11.0631 27306.1     654.44   27227.3     717.009  895.661    239.957     77.7049     239.957     
1 1 1 7  5  38 o 4  449.034 4.37885 3673.09     93.8312  3477.93     102.742  290.682    267.163     28.4225     87.1629     
1 1 1 7  5  39 o 4  318.71  3.61369 1806.62     57.7189  1794.62     57.7156  271.499    154.835     128.098     154.835     
1 1 1 7  5  40 o 7  442.471 4.2616  3480.5      92.3395  3462.51     96.595   270.36     241.343     59.6606     61.3432     
1 1 1 7  5  41 o 9  398.161 4.11421 2832.3      80.0983  2789.97     84.008   342.74     91.2114     153.484     91.2114     
1 1 1 7  5  42 o 17 64.4706 2.54801 75.1876     7.99409  72.6216     8.39085  12.2494    141.731     51.8245     141.731     
1 1 1 7  5  43 o 3  212.547 2.94363 809.88      32.8483  791.847     29.8185  174.205    115.856     89.314      115.856     
1 1 1 7  5  44 o 5  250.612 3.0922  1121.28     41.5143  1105.72     35.9975  143.509    177.447     41.7047     357.447     
1 1 1 7  5  45 o 8  424.487 4.44597 3225.42     99.2032  3168.72     89.7963  377.675    67.1583     189.859     67.1583     
1 1 1 7  5  46 o 3  269.831 3.38515 1298.55     49.2844  1283.76     42.0167  234.258    347.542     124.281     347.542     
1 1 1 7  5  47 o 7  136.675 2.66755 334.302     19.6579  328.534     16.7565  53.4289    90.3483     57.2379     270.348     
1 1 1 7  5  48 o 15 248.786 3.25915 1094.5      41.6794  1100.76     39.5546  154.995    101.107     15.2576     281.107     
1 1 1 7  5  49 o 14 346.375 3.95167 2096.9      70.3317  2160.74     66.7441  247.522    186.348     35.2656     186.348     
1 1 1 7  5  50 o 7  201.909 2.86836 720.064     30.4337  725.719     27.5287  147.505    274.176     35.4462     274.176     
1 1 1 7  5  51 o 9  139.925 2.63019 360.229     18.9351  334.792     17.924   70.4971    248.896     33.4394     68.8961     
1 1 1 7  5  52 o 4  112.597 2.44038 225.562     14.0637  224.411     13.4389  64.1081    7.81059     1.08171     7.81058     
1 1 1 7  5  53 o 11 224.419 2.86485 888.942     32.237   897.454     32.2018  126.593    27.1035     37.9774     207.104     
1 1 1 7  5  54 o 10 385.987 4.01927 2610.02     79.5071  2679.99     75.885   235.143    187.303     38.317      7.30308     
1 1 1 7  5  55 o 4  299.55  3.65312 1599.12     56.2453  1585.95     53.4081  184.276    194.152     22.3766     14.1515     
1 1 1 7  5  56 o 11 181.366 2.71852 595.678     25.3448  571.22      24.0747  97.5839    240.505     34.7544     60.5054     
1 1 1 7  5  57 o 19 262.746 3.41479 1232.16     48.3749  1218.15     41.3121  200.212    155.688     63.2104     155.688     
1 1 1 7  5  58 f 0  83.5003 2.48926 130.94      10.3948  116.991     10.3674  77.907     286.285     0           0           
1 1 1 7  5  59 o 6  279.789 3.22223 1407.07     45.208   1371.59     45.1475  237.832    302.778     118.532     302.778     
1 1 1 7  5  60 o 17 45.66   3.31457 38.7944     7.71161  36.0268     7.24446  7.65332    290.723     43.9091     290.723     
1 1 1 7  5  61 o 7  246.442 2.88634 1105.22     36.3558  1050.87     34.9428  172.822    227.344     31.0213     227.344     
1 1 1 7  5  62 o 7  340.197 3.39605 2119.99     60.6092  1992.69     55.186   265.521    255.928     94.0694     255.928     
1 1 1 7  5  63 o 5  108.533 2.51379 212.579     14.2503  205.98      13.0477  53.4609    137.218     24.8213     317.218     
1 1 1 7  5  64 o 1  170.92  2.70148 534.799     23.7988  502.874     22.4856  149.12     216.835     88.37       216.835     
1 1 1 7  5  65 o 11 167.916 2.77118 515.862     23.916   486.038     22.7277  106.264    238.055     2.61585     238.055     
1 1 1 7  5  66 o 17 216.521 3.05234 852.823     34.0776  814.51      32.166   177.615    311.372     84.0535     311.372     
1 1 1 7  5  67 o 17 96.5387 2.72583 164.415     13.574   167.429     12.7249  65.328     55.1353     18.2928     55.1352     
1 1 1 7  5  68 o 17 93.4243 2.76403 154.534     13.3021  156.469     12.504   45.665     310.877     20.2693     130.877     
1 1 1 7  5  69 o 4  242.512 3.17762 1060.79     39.7088  1035.33     37.5194  192.418    105.892     82.2012     105.892     
1 1 1 7  5  70 o 11 61.6921 3.03318 67.3701     9.59018  68.9265     9.03082  32.07      358.893     3.5381      358.893     
1 1 1 7  5  71 o 1  108.638 2.63861 207.974     15.011   212.781     13.6248  77.3848    204.141     24.8925     204.141     
1 1 1 7  5  72 o 3  148.689 2.87404 396.438     22.6474  392.614     20.0759  102.834    141.17      22.84       141.17      
1 1 1 7  5  73 o 17 112.679 2.628   231.09      15.6074  222.076     14.0152  62.1302    33.7793     13.4956     213.779     
1 1 1 7  5  74 o 10 82.5759 2.83495 126.488     11.9887  117.706     11.4069  26.398     116.672     47.1352     296.672     
1 1 1 7  5  75 o 1  32.1601 4.27302 21.4835     6.88677  17.1721     6.38382  1.67806    297.591     37.9986     297.591     
1 1 1 7  5  76 o 6  72.4674 2.95895 101.451     10.6154  87.5078     10.7282  46.3522    265.746     7.76215     265.746     
1 1 1 7  5  77 o 19 18.777  5.07995 2.4785      7.17933  6.14869     6.38609  2.62217    72.8767     14.9182     72.8767     
1 1 1 7  5  78 o 18 38.5924 4.55882 33.31       8.86875  22.8112     8.078    16.046     220.904     8.69647     40.904      
1 1 1 7  5  79 o 19 97.3517 3.00021 171.046     15.1682  169.911     14.0151  53.9159    353.147     8.19877     173.147     
1 1 1 7  5  80 o 19 33.7321 5.0517  22.5237     8.65511  20.8992     7.89414  16.2847    93.2707     1.67464     93.2707     
1 1 1 7  5  81 o 11 21.0308 5.39263 7.92421     7.73108  6.26262     6.9214   2.75961    90.6556     5.21744     270.656     
1 1 1 7  5  82 o 14 27.6329 5.53943 16.3972     8.49306  13.22       7.5695   6.34014    166.993     15.4197     346.993     
1 1 1 7  5  83 o 5  39.9138 5.09435 28.7191     10.748   32.5157     8.68746  16.9804    105.318     10.0908     285.318     
1 1 1 7  5  84 o 1  78.1367 3.61235 107.418     14.156   116.867     13.9463  40.8447    329.602     9.30188     149.602     
1 1 1 7  5  85 o 15 43.4306 5.7017  31.0185     10.6245  44.0226     13.3489  14.5627    23.6366     19.3025     203.637     
1 1 1 7  5  86 o 18 42.0191 6.57623 45.1946     13.7255  27.7672     13.4626  24.8145    313.755     6.10389     313.755     
1 1 1 7  5  87 o 17 59.5769 5.42406 63.4185     15.8646  75.0845     15.6126  25.3778    267.415     16.39       87.4154     
1 1 1 7  5  88 o 19 41.8848 7.21114 55.5827     15.7075  19.4265     16.6788  22.2173    28.7292     1.29023     28.7291     
1 1 1 7  5  89 o 4  36.8048 8.10535 48.0282     19.2564  8.7981      17.959   7.81221    134.736     23.7213     314.736     
1 1 1 7  5  90 o 4  28.5851 9.00768 13.182      25.7696  -8.70804    27.6884  3.08123    163.958     1.33535     163.958     
1 1 1 7  5  91 o 11 36.1784 10.4636 13.9398     31.9193  42.5519     30.5058  18.1935    83.8314     2.74889     83.8314     
1 1 1 7  5  92 x 16 ?       ?       ?           ?        ?           ?        27.4695    270.595     0           0           
1 1 1 7  5  93 x 18 ?       ?       ?           ?        ?           ?        6.67611    132.167     0           0           
1 1 1 7  5  94 x 5  ?       ?       ?           ?        ?           ?        16.748     209.431     0           0           
1 1 1 7  5  95 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  6  0  o 1  300.627 3.18853 1602.64     48.013   1602.64     48.013   256.223    360         139.43      360         
1 1 1 7  6  1  o 5  813.395 7.07249 11734.7     288.293  11747.9     288.294  588.883    55.9146     21.5968     55.9147     
1 1 1 7  6  2  o 18 543.532 5.11407 5224.8      139.299  5252.76     139.3    395.346    126.441     34.0634     126.441     
1 1 1 7  6  3  o 5  250.472 2.9954  1084.6      37.5867  1139.5      37.5941  97.7792    71.2148     116.203     251.215     
1 1 1 7  6  4  o 15 158.139 2.59523 448.825     20.5657  437.582     20.5662  64.3814    12.5324     312.387     12.5324     
1 1 1 7  6  5  o 8  798.674 8.26635 11358.3     340.484  11294.4     320.999  622.813    276.268     112.985     276.268     
1 1 1 7  6  6  o 14 907.521 9.30582 14605       410.606  14659       435.52   778.14     153.602     266.819     153.602     
1 1 1 7  6  7  o 2  676.9   6.88377 8176.98     233.515  8083.54     233.506  492.518    41.971      30.0749     41.971      
1 1 1 7  6  8  o 7  914.703 9.03493 14824.1     414.158  14897       414.155  727.65     145.011     153.98      145.011     
1 1 1 7  6  9  o 5  652.131 7.05349 7493.35     230.505  7598.55     230.516  545.691    19.3815     177.394     19.3815     
1 1 1 7  6  10 f 0  801.213 7.99816 11400.5     321.145  11387.9     321.142  456.141    141.548     0           0           
1 1 1 7  6  11 o 8  235.313 3.20047 961.478     37.7318  1001.43     37.7396  52.8802    318.401     195.473     138.401     
1 1 1 7  6  12 f 0  1042.49 9.75595 19208.3     509.673  19395.6     509.693  624.473    70.2333     0           0           
1 1 1 7  6  13 o 8  399.12  4.11789 2821.82     80.3793  2825.28     84.3046  314.081    289.019     93.6112     289.019     
1 1 1 7  6  14 o 1  303.636 3.33537 1631.14     50.7517  1636.67     50.7532  173.726    86.5367     51.0518     266.537     
1 1 1 7  6  15 o 17 776.438 7.05083 10720.4     274.35   10664       274.352  602.23     151.589     106.85      151.589     
1 1 1 7  6  16 o 12 177.09  2.55922 577.811     22.7022  534.056     22.6962  4.69041    118.585     204.832     298.585     
1 1 1 7  6  17 o 13 200.462 2.64301 718.837     26.5496  705.362     26.5517  40.4911    263.495     168.603     83.4949     
1 1 1 7  6  18 o 15 194.617 2.58406 659.69      24.6523  682.72      25.7538  26.9125    84.7932     190.073     264.793     
1 1 1 7  6  19 o 13 239.558 2.84212 1012.37     33.3729  1021.5      34.8579  142.814    318.014     7.92021     138.014     
1 1 1 7  6  20 o 6  1104.13 9.81792 21514.9     543.232  21748.5     543.261  710.237    21.686      147.454     201.686     
1 1 1 7  6  21 o 12 572.162 5.26851 5780.56     147.756  5824.86     154.328  283.558    104.545     236.101     284.545     
1 1 1 7  6  22 o 9  1191.46 10.352  25280.7     604.463  25102.5     631.354  919.674    203.462     151.192     203.462     
1 1 1 7  6  23 o 4  622.371 5.81776 6929.24     177.039  6803.89     185.674  548.567    287.508     231.323     287.508     
1 1 1 7  6  24 o 10 161.565 2.60583 474.138     21.0971  451.101     21.0905  59.3623    13.5522     9.08444     193.552     
1 1 1 7  6  25 o 19 540.428 5.36196 5195.58     145.219  5158.66     145.217  370.813    41.054      9.82839     221.054     
1 1 1 7  6  26 o 2  465.518 4.64695 3860.16     110.972  3821.83     105.808  443.375    94.1124     257.502     94.1124     
1 1 1 7  6  27 o 15 667.719 6.16749 7900.45     206.377  7908.64     206.378  349.43     49.3758     235.803     229.376     
1 1 1 7  6  28 o 13 50.7781 2.45684 42.5247     6.21369  49.4121     6.18392  96.5345    56.6587     218.499     56.6587     
1 1 1 7  6  29 o 11 613.072 5.68044 6675.34     174.525  6651.18     174.521  431.455    291.794     13.0846     291.794     
1 1 1 7  6  30 o 12 994.336 8.72476 17654.3     444.175  17431.8     425.241  795.47     57.0154     202.024     57.0154     
1 1 1 7  6  31 o 5  945.275 8.1849  15920.2     371.153  15785.8     403.49   731.903    133.364     146.705     133.364     
1 1 1 7  6  32 o 18 656.904 5.60231 7615.37     177.221  7686.37     191.426  401.962    176.497     104.216     356.497     
1 1 1 7  6  33 o 15 169.057 2.37258 493.719     19.3231  519.348     20.8782  24.9525    109.216     4.34393     109.216     
1 1 1 7  6  34 o 8  352.299 3.43684 2201.5      59.447   2197.91     61.8825  202.61     223.219     65.5385     43.2192     
1 1 1 7  6  35 o 18 470.625 4.31378 3911.99     99.6857  3940.71     103.768  312.092    87.4958     16.5998     267.496     
1 1 1 7  6  36 o 2  298.001 3.13515 1536.28     45.8792  1612.02     47.7681  148.407    146.401     99.4201     326.401     
1 1 1 7  6  37 o 3  1042.34 9.1334  19220.7     466.605  19389.5     487.435  745.392    322.41      48.3542     322.41      
1 1 1 7  6  38 o 5  503.814 4.84887 4532.46     122.412  4470.35     122.434  321.214    159.759     46.2049     339.759     
1 1 1 7  6  39 o 1  383.307 3.75453 2537.52     75.0184  2672.85     68.8981  229.708    37.2499     59.2941     217.25      
1 1 1 7  6  40 f 0  525.219 5.03366 4996.02     135.669  4791.77     129.325  360.879    58.1927     0           0           
1 1 1 7  6  41 o 8  334.04  3.79615 1990.33     66.2729  1966.68     60.7335  224.424    162.287     1.19437     162.288     
1 1 1 7  6  42 o 10 675.304 7.14223 8112.76     248.732  8094.54     234.491  539.336    226.318     157.433     226.318     
1 1 1 7  6  43 o 15 392.589 4.23397 2749.57     87.395   2718.26     79.0408  312.772    282.972     99.2383     282.972     
1 1 1 7  6  44 f 0  164.832 2.62026 466.638     22.1294  496.833     21.0987  134.693    223.79      0           0           
1 1 1 7  6  45 o 2  195.197 2.96539 692.784     30.6544  658.497     27.3364  135.745    31.995      29.1602     31.995      
1 1 1 7  6  46 o 14 751.526 7.2657  10035.6     273.631  10062       273.651  537.601    28.7264     57.2098     28.7264     
1 1 1 7  6  47 o 15 342.203 3.84679 2111.55     69.2444  2043.54     62.6231  228.036    28.8258     0.306572    28.8255     
1 1 1 7  6  48 o 19 272.192 3.39705 1314.42     47.4641  1313.67     45.1845  161.006    168.821     37.9712     348.821     
1 1 1 7  6  49 o 6  145.557 2.47054 370.613     18.7418  380.872     17.2291  74.666     116.115     34.0565     296.115     
1 1 1 7  6  50 o 1  164.649 2.60608 481.795     21.9955  479.509     21.0019  76.0064    164.489     59.6359     344.489     
1 1 1 7  6  51 o 5  54.9425 2.78248 51.8459     7.81385  55.7974     7.37451  5.34634    90.665      48.0167     90.665      
1 1 1 7  6  52 o 15 287.553 3.6166  1464.15     54.931   1470.31     49.1276  159.84     214.897     59.1618     34.8969     
1 1 1 7  6  53 o 4  225.395 2.98618 884.927     33.723   917.387     33.7295  182.377    64.2161     76.7477     64.2161     
1 1 1 7  6  54 f 0  577.869 5.50081 5983.02     163.11   5895.25     155.447  362.571    91.8796     0           0           
1 1 1 7  6  55 f 0  173.213 2.77535 545.403     23.4355  519.014     24.6883  44.0125    140.261     0           0           
1 1 1 7  6  56 o 19 101.047 2.46523 175.639     12.9955  186.998     11.8625  15.1003    28.3588     91.0099     208.359     
1 1 1 7  6  57 o 12 77.4106 2.6373  116.724     10.49    96.7942     9.89099  17.9488    225.224     43.8329     45.2237     
1 1 1 7  6  58 o 18 379.285 4.14042 2565.27     78.7042  2545.94     78.6934  289.807    133.839     86.5081     133.839     
1 1 1 7  6  59 o 19 191.585 2.61602 653.878     25.6961  648.3       24.5283  118.471    205.847     5.63333     25.8467     
1 1 1 7  6  60 o 11 119.096 2.44571 253.765     14.9387  249.858     14.2204  90.5982    190.511     60.5532     190.511     
1 1 1 7  6  61 f 0  98.6754 2.4468  178.939     12.3855  167.063     11.7785  52.04      126.411     0           0           
1 1 1 7  6  62 o 8  103.98  2.43115 193.488     12.9567  190.609     12.3419  63.7604    95.6279     4.2649      95.6279     
1 1 1 7  6  63 o 10 126.491 2.43661 290.819     15.7991  277.592     15.0656  62.779     52.3879     31.237      232.388     
1 1 1 7  6  64 f 0  218.363 2.82737 870.412     32.436   823.827     29.4362  122.984    54.9028     0           0           
1 1 1 7  6  65 o 11 118.13  2.4534  242.494     14.8521  253.549     14.1337  75.3711    304.605     7.23948     304.604     
1 1 1 7  6  66 o 14 77.8308 2.69753 113.997     11.4035  101.979     9.57231  45.6614    211.098     5.03198     211.098     
1 1 1 7  6  67 o 1  41.3714 3.50522 33.0103     7.64071  28.9145     6.61259  3.15131    326.483     2.98443     146.483     
1 1 1 7  6  68 o 2  42.5646 3.62814 33.1877     7.46895  32.385      7.69085  8.047      210.996     14.847      30.9962     
1 1 1 7  6  69 o 1  110.326 2.40979 220.741     14.108   212.546     12.4837  65.767     1.65918     1.57786     181.659     
1 1 1 7  6  70 f 0  165.453 2.87112 496.741     25.2373  479.024     22.308   98.3687    23.6452     0           0           
1 1 1 7  6  71 o 3  60.5177 3.24143 73.4901     10.558   58.4621     8.97779  34.4226    95.371      2.38547     95.371      
1 1 1 7  6  72 o 16 28.3802 4.29682 27.2586     7.11244  4.59615     5.77305  4.55452    207.531     12.4926     27.5315     
1 1 1 7  6  73 o 14 89.674  2.93516 148.936     14.001   139.011     12.299   51.6218    168.487     5.1912      348.487     
1 1 1 7  6  74 o 14 50.1197 3.42428 45.9137     9.27731  45.006      7.63161  10.3642    305.482     37.7352     125.482     
1 1 1 7  6  75 o 14 58.6105 3.58969 57.7622     10.7508  66.8524     9.99939  32.3478    351.824     2.91646     171.824     
1 1 1 7  6  76 o 6  35.9612 4.80493 26.8646     8.70536  21.8637     7.98654  15.7335    5.98207     5.18689     5.98207     
1 1 1 7  6  77 o 19 89.3527 3.38785 152.469     16.3362  135.945     13.8951  55.4189    267.297     4.22582     267.297     
1 1 1 7  6  78 o 9  55.3866 4.17043 51.6012     11.8087  61.1739     10.7608  27.4736    348.512     8.68703     168.512     
1 1 1 7  6  79 o 13 65.8578 3.83743 87.043      13.1356  71.5202     11.9641  27.2225    117.931     22.9539     297.931     
1 1 1 7  6  80 o 2  14.8095 4.70163 -3.22829    7.62293  -2.63344    6.88697  4.69001    188.063     17.3549     188.063     
1 1 1 7  6  81 o 4  46.8885 4.61386 42.4063     10.4175  39.9817     10.6587  20.993     345.996     11.3354     165.996     
1 1 1 7  6  82 o 8  16.7316 5.05556 2.35037     7.75729  -1.75131    7.37701  2.50212    255.777     17.3204     255.777     
1 1 1 7  6  83 o 11 105.604 3.30387 199.734     17.1282  206.44      17.756   62.7344    237.312     0.879738    237.312     
1 1 1 7  6  84 o 3  22.4776 5.5643  12.5751     7.86837  4.18022     8.30446  5.39757    136.622     3.08942     316.622     
1 1 1 7  6  85 o 17 19.0937 5.68322 -3.32014    9.58175  5.97566     9.50273  0.381636   288.754     15.8969     288.754     
1 1 1 7  6  86 f 0  83.3578 3.85436 126.645     16.0347  131.142     15.9857  38.9982    179.5       0           0           
1 1 1 7  6  87 o 8  20.0207 6.02677 6.8764      11.804   -3.03279    9.63487  1.05344    36.7306     8.6316      216.731     
1 1 1 7  6  88 o 4  32.7224 7.83317 29.3373     17.8422  16.6653     12.7777  14.944     177.003     0.210911    177.003     
1 1 1 7  6  89 o 3  29.1966 7.75063 22.3778     17.6086  10.5589     13.1694  10.9921    229.74      5.58166     49.7401     
1 1 1 7  6  90 o 4  31.1668 8.78589 13.0333     26.5452  20.6422     16.5948  9.80675    113.326     11.3873     293.326     
1 1 1 7  6  91 o 6  47.3179 13.1907 76.557      35.5448  79.1891     75.4891  27.2202    156.515     6.97235     156.515     
1 1 1 7  6  92 x 12 ?       ?       ?           ?        ?           ?        15.8186    171.303     0           0           
1 1 1 7  6  93 x 4  ?       ?       ?           ?        ?           ?        27.8028    336.726     0           0           
1 1 1 7  6  94 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 7  7  0  o 10 189.648 5.06431 640.097     47.9755  640.097     47.9755  0.853495   180         21.4362     360         
1 1 1 7  7  1  o 2  334.299 4.31424 1982.61     72.2228  1982.61     72.2228  260.452    210         40.9021     210         
1 1 1 7  7  2  o 6  118.782 2.94121 250.937     17.4593  250.937     17.4593  32.1677    240         154.681     240         
1 1 1 7  7  3  o 4  73.0556 3.04962 95.5607     11.0751  95.5607     11.0751  19.1248    90.0001     46.8818     90.0001     
1 1 1 7  7  4  o 2  168.38  2.97825 503.341     25.0955  503.341     25.0955  44.4841    120         75.5572     300         
1 1 1 7  7  5  o 7  238.161 3.43505 1006.39     40.9596  1006.39     40.9596  163.953    330         38.7506     330         
1 1 1 7  7  6  o 17 697.995 8.04021 8646.58     281.074  8646.58     281.074  584.816    1.22019e-07 162.826     1.22019e-07 
1 1 1 7  7  7  o 15 690.568 7.01013 8460.14     242.488  8460.14     242.488  518.295    210         40.8561     210         
1 1 1 7  7  8  o 19 54.6638 2.36581 53.5402     6.42476  53.5402     6.42476  61.3889    60          136.484     60          
1 1 1 7  7  9  o 13 106.666 2.38612 202.208     12.726   202.208     12.726   27.1321    90          111.805     90          
1 1 1 7  7  10 o 18 811.103 7.33644 11669.4     298.1    11669.4     298.1    594.492    300         21.0965     300         
1 1 1 7  7  11 o 1  401.096 3.99576 2852.64     80.2813  2852.64     80.2813  16.4341    150         544.326     330         
1 1 1 7  7  12 o 9  196.952 2.95322 688.271     29.1189  688.271     29.1189  101.065    180         13.3695     180         
1 1 1 7  7  13 o 6  233.822 2.87543 969.648     33.6707  969.648     33.6707  171.993    210         69.0925     210         
1 1 1 7  7  14 o 7  749.541 6.84438 9963.38     256.996  9963.38     256.996  681.106    240         285.826     240         
1 1 1 7  7  15 o 11 196.573 2.79082 685.517     27.4676  685.517     27.4676  111.167    270         23.3038     270         
1 1 1 7  7  16 f 0  249.612 3.13373 1105.08     39.1723  1105.08     39.1723  36.0167    120         0           0           
1 1 1 7  7  17 o 16 619.277 5.99253 6800.65     185.897  6800.65     185.897  318.627    330         249.782     150         
1 1 1 7  7  18 o 11 404.058 4.42737 2895.21     89.6015  2895.21     89.6015  272.426    360         33.3505     180         
1 1 1 7  7  19 o 14 392.556 4.40249 2732.81     86.5596  2732.81     86.5596  152.955    210         255.26      30          
1 1 1 7  7  20 o 6  1869.11 18.0289 62081.9     1688.04  62081.9     1688.04  1368.21    240         67.3439     240         
1 1 1 7  7  21 o 3  48.2583 2.67235 42.0192     6.36915  42.0192     6.36915  6.02652    90.0008     13.5283     90.0008     
1 1 1 7  7  22 o 14 497.466 5.00913 4388.23     124.821  4388.23     124.821  342.27     300         24.1887     120         
1 1 1 7  7  23 o 3  731.318 6.95967 9484.77     254.964  9484.77     254.964  714.899    150         389.203     150         
1 1 1 7  7  24 o 17 770.126 7.34983 10518.8     283.545  10518.8     283.545  610.461    360         126.53      360         
1 1 1 7  7  25 o 7  952.388 8.95859 16090.2     427.406  16090.2     427.406  785.147    210         218.728     210         
1 1 1 7  7  26 o 5  454.045 4.35349 3655.29     99.0185  3655.29     99.0185  171.851    60          299.74      240         
1 1 1 7  7  27 o 18 1408.53 12.4315 35215.1     877.197  35215.1     877.197  1189.93    270         386.701     270         
1 1 1 7  7  28 o 11 19.5272 4.74442 8.78167     4.17504  8.78167     4.17504  142.744    120         290.068     120         
1 1 1 7  7  29 o 15 1123.57 9.8739  22398.9     555.776  22398.9     555.776  904.563    150         224.115     150         
1 1 1 7  7  30 o 12 250.552 2.96473 1113.3      37.2021  1113.3      37.2021  174.13     180         1.82233     180         
1 1 1 7  7  31 o 17 799.161 7.28219 11327.9     291.538  11327.9     291.538  495.822    30          131.99      210         
1 1 1 7  7  32 o 17 112.527 2.3159  224.935     13.0348  224.935     13.0348  0.337469   240         14.7682     60.0001     
1 1 1 7  7  33 o 7  228.564 2.85587 926.579     32.6889  926.579     32.6889  182.282    90          102.958     90          
1 1 1 7  7  34 o 15 622.435 5.85336 6871.34     182.51   6871.34     182.51   384.503    300         101.445     120         
1 1 1 7  7  35 o 8  19.5608 4.83843 8.87649     4.29256  8.87649     4.29256  97.3218    150         198.885     150         
1 1 1 7  7  36 o 12 148.353 2.26885 390.528     16.8501  390.528     16.8501  59.0481    1.58882e-08 78.4152     180         
1 1 1 7  7  37 o 9  167.258 2.44316 496.355     20.4587  496.355     20.4587  120.56     210         39.5915     210         
1 1 1 7  7  38 o 11 197.744 2.45529 693.554     24.3145  693.554     24.3145  172.29     240         113.021     240         
1 1 1 7  7  39 o 5  299.034 3.0554  1585.71     45.7663  1585.71     45.7663  218.606    270         23.2225     270         
1 1 1 7  7  40 f 0  500.887 4.35661 4449.45     109.32   4449.45     109.32   269.965    300         0           0           
1 1 1 7  7  41 o 15 460.715 4.25566 3764.69     98.2185  3764.69     98.2185  270.516    330         93.9784     150         
1 1 1 7  7  42 o 11 11.2939 4.74669 2.42892     4.68982  2.42892     4.68982  38.7146    360         78.3783     360         
1 1 1 7  7  43 o 10 462.409 4.76058 3793.87     110.265  3793.87     110.265  404.943    30          175.494     30          
1 1 1 7  7  44 o 5  112.809 2.67492 226.295     15.0836  226.295     15.0836  45.9017    60          7.16002     60          
1 1 1 7  7  45 o 7  55.0499 2.96333 54.6403     8.06349  54.6403     8.06349  8.17179    270         29.106      270         
1 1 1 7  7  46 o 8  314.593 3.79502 1756.12     59.7914  1756.12     59.7914  146.333    120         135.76      300         
1 1 1 7  7  47 o 12 373.331 4.22943 2473.32     79.0833  2473.32     79.0833  297.451    330         87.7895     330         
1 1 1 7  7  48 o 16 210.279 2.87079 784.626     30.2269  784.626     30.2269  167.631    1.87e-06    50.3831     1.87e-06    
1 1 1 7  7  49 o 4  220.999 2.97527 866.685     32.9247  866.685     32.9247  120.02     210         58.5649     30          
1 1 1 7  7  50 o 1  239.873 3.12125 1021.04     37.492   1021.04     37.492   164.652    60          6.08342     60.0001     
1 1 1 7  7  51 o 15 280.441 3.53078 1395.78     49.5863  1395.78     49.5863  189.948    90          3.06424     90          
1 1 1 7  7  52 o 8  104.532 2.63691 194.422     13.7736  194.422     13.7736  39.6645    300         59.1649     120         
1 1 1 7  7  53 o 4  215.235 2.76527 822.014     29.8049  822.014     29.8049  217.662    330         148.051     330         
1 1 1 7  7  54 f 0  67.1865 2.80143 80.8512     9.35665  80.8512     9.35665  59.941     360         0           0           
1 1 1 7  7  55 o 9  180.912 2.90987 581.133     26.3509  581.133     26.3509  108.717    30          22.827      210         
1 1 1 7  7  56 o 19 176.051 2.92725 550.395     25.7938  550.395     25.7938  164.668    60          96.912      60          
1 1 1 7  7  57 o 17 19.5058 6.25358 9.8039      6.59529  9.8039      6.59529  2.04825    270         4.44271     270         
1 1 1 7  7  58 o 13 788.714 8.01116 11086.9     316.5    11086.9     316.5    599.033    300         160.376     300         
1 1 1 7  7  59 o 5  284.992 3.21992 1441.53     45.9609  1441.53     45.9609  208.804    150         43.8635     150         
1 1 1 7  7  60 o 8  66.0253 2.84763 78.1617     9.34111  78.1617     9.34111  1.63928    1.68772e-06 80.9837     180         
1 1 1 7  7  61 o 11 149.474 2.55943 396.86      19.1467  396.86      19.1467  159.141    210         127.465     210         
1 1 1 7  7  62 o 17 166.181 2.54796 490.417     21.197   490.417     21.197   100.467    240         14.8247     60          
1 1 1 7  7  63 o 12 200.784 2.63469 715.776     26.49    715.776     26.49    152.226    270         44.6657     270         
1 1 1 7  7  64 o 4  51.3718 3.18161 47.9039     8.04007  47.9039     8.04007  13.9778    120         3.13275     300         
1 1 1 7  7  65 o 7  109.122 2.58428 211.961     14.0963  211.961     14.0963  73.3907    150         6.61816     150         
1 1 1 7  7  66 o 18 99.3648 2.5637  175.889     12.7275  175.889     12.7275  65.2979    1.73055e-06 3.45457     1.73055e-06 
1 1 1 7  7  67 o 11 10.1252 4.55384 0.51481     5.06126  0.51481     5.06126  4.95983    30.0001     10.4339     30.0001     
1 1 1 7  7  68 o 13 40.8543 3.56272 30.9967     6.99672  30.9967     6.99672  1.72697    60          41.2922     240         
1 1 1 7  7  69 o 3  111.376 2.41561 220.817     13.4541  220.817     13.4541  88.8136    90          36.6785     90          
1 1 1 7  7  70 o 2  9.98623 4.47269 0.654083    4.82385  0.654083    4.82385  16.0042    300         34.2378     300         
1 1 1 7  7  71 o 6  30.5584 6.27135 20.4111     8.33377  20.4111     8.33377  5.86153    330         15.1621     150         
1 1 1 7  7  72 o 11 28.4199 6.92548 18.8696     8.8788   18.8696     8.8788   3.24364    360         1.99269     180         
1 1 1 7  7  73 o 12 18.3945 6.76602 8.95191     8.10811  8.95191     8.10811  0.726139   29.9998     3.35813     29.9998     
1 1 1 7  7  74 o 3  58.5491 4.03599 62.9825     11.5661  62.9825     11.5661  50.0206    240         28.7072     240         
1 1 1 7  7  75 o 19 13.9012 5.96223 3.38056     7.70266  3.38056     7.70266  0.177686   90.0004     0.509243    90.0004     
1 1 1 7  7  76 o 1  160.536 3.25623 460.982     26.148   460.982     26.148   105.781    120         13.9696     120         
1 1 1 7  7  77 o 16 28.2734 7.092   19.067      9.14381  19.067      9.14381  9.76797    150         7.00755     330         
1 1 1 7  7  78 o 8  22.4047 6.89323 13.07       8.01834  13.07       8.01834  2.20948    180         14.0421     8.63232e-06 
1 1 1 7  7  79 o 19 18.5902 6.70494 9.32089     7.86138  9.32089     7.86138  1.37065    30          16.279      30          
1 1 1 7  7  80 o 19 22.5917 6.80654 13.229      7.83739  13.229      7.83739  3.10561    60          32.2975     60          
1 1 1 7  7  81 o 19 25.8712 6.75604 16.342      8.11334  16.342      8.11334  10.1579    270         1.65235     270         
1 1 1 7  7  82 o 5  7.89925 3.95141 -7.79224    6.40973  -7.79224    6.40973  4.57016    120         10.7446     120         
1 1 1 7  7  83 o 18 27.4226 6.81475 18.1077     8.49086  18.1077     8.49086  10.4936    150         10.3712     330         
1 1 1 7  7  84 o 1  28.3012 8.03327 20.8507     11.0735  20.8507     11.0735  13.2969    180         4.49168     180         
1 1 1 7  7  85 f 0  62.252  4.68013 72.9843     14.1857  72.9843     14.1857  34.8079    30          0           0           
1 1 1 7  7  86 o 6  43.3467 6.66399 39.3329     12.6867  39.3329     12.6867  27.5321    60          4.34172     60          
1 1 1 7  7  87 o 2  72.2859 4.93677 98.4415     17.4754  98.4415     17.4754  51.7602    270         18.8504     270         
1 1 1 7  7  88 o 15 10.2422 5.15493 -14.9614    11.5135  -14.9614    11.5135  18.543     120         46.0833     120         
1 1 1 7  7  89 f 0  18.3027 8.00083 6.53195     14.4806  6.53195     14.4806  9.30428    150         0           0           
1 1 1 7  7  90 o 16 41.0887 11.9663 49.2551     24.3904  49.2551     24.3904  27.1282    2.35935e-06 7.50704     2.35935e-06 
1 1 1 7  7  91 o 7  30.6549 14.9799 20.9225     77.8993  20.9225     77.8993  8.38291    30          17.1284     210         
1 1 1 7  7  92 x 7  ?       ?       ?           ?        ?           ?        11.0383    60          0           0           
1 1 1 7  7  93 x 6  ?       ?       ?           ?        ?           ?        3.0185     270         0           0           
1 1 1 7  7  94 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  0  0  o 10 270.817 3.65161 1300.97     49.5181  1300.97     49.5181  45.7043    180         69.4374     360         
1 1 1 8  0  1  o 3  944.36  7.34998 15815       347.749  15815       347.749  920.37     240         481.144     240         
1 1 1 8  0  2  o 19 183.188 2.22038 595.132     20.3703  595.132     20.3703  16.385     120         153.32      300         
1 1 1 8  0  3  o 19 249.802 2.46986 1106.33     30.9055  1106.33     30.9055  10.5912    180         3.75675     180         
1 1 1 8  0  4  o 14 1048.49 8.12206 19497.6     426.651  19497.6     426.651  1120.46    240         732.028     240         
1 1 1 8  0  5  o 18 1114.4  9.2702  22032       517.554  22032       517.554  1133.22    120         663.099     120         
1 1 1 8  0  6  o 19 203.16  2.57269 732.046     26.1741  732.046     26.1741  59.4047    360         71.8071     180         
1 1 1 8  0  7  o 14 368.543 3.17547 2407.86     58.6289  2407.86     58.6289  310.749    240         220.056     240         
1 1 1 8  0  8  o 1  555.442 4.5239  5469.73     125.888  5469.73     125.888  487.211    120         176.191     120         
1 1 1 8  0  9  o 5  259.027 2.61047 1189.61     33.8708  1189.61     33.8708  145.682    180         45.783      180         
1 1 1 8  0  10 o 8  429.592 3.68364 3271.85     79.2774  3271.85     79.2774  435.941    60          268.858     60          
1 1 1 8  0  11 o 12 533.236 4.39022 5041.3      117.282  5041.3      117.282  413.671    120         62.1931     120         
1 1 1 8  0  12 o 6  1022.22 7.94598 18537.9     406.943  18537.9     406.943  992.627    180         519.367     180         
1 1 1 8  0  13 o 2  507.858 4.27609 4573.04     108.796  4573.04     108.796  378.403    240         29.0377     240         
1 1 1 8  0  14 o 5  302.274 2.86501 1619.96     43.3821  1619.96     43.3821  243.051    300         83.4234     300         
1 1 1 8  0  15 o 8  297.005 2.84128 1564        42.2726  1564        42.2726  195.251    360         26.5497     180         
1 1 1 8  0  16 o 9  270.079 2.76756 1293.37     37.4406  1293.37     37.4406  15.2466    60          355.094     240         
1 1 1 8  0  17 o 9  430.651 3.81035 3288.27     82.2048  3288.27     82.2048  468.684    120         341.713     120         
1 1 1 8  0  18 o 16 197.033 2.33335 688.482     23.0253  688.482     23.0253  2.62003    0           267.308     180         
1 1 1 8  0  19 o 10 710.524 5.82734 8952.56     207.433  8952.56     207.433  542.204    240         71.5914     240         
1 1 1 8  0  20 o 9  692.447 5.69127 8502.3      197.435  8502.3      197.435  636.819    300         287.655     300         
1 1 1 8  0  21 o 15 354.836 3.28973 2232.27     58.4765  2232.27     58.4765  313.016    180         252.304     180         
1 1 1 8  0  22 o 6  132.633 2.06365 312.153     13.7017  312.153     13.7017  6.28996    240         62.9915     60          
1 1 1 8  0  23 o 15 148.961 2.22368 393.695     16.5832  393.695     16.5832  30.8795    120         67.5208     300         
1 1 1 8  0  24 o 15 87.2529 2.17581 135.396     9.48707  135.396     9.48707  48.7081    180         149.593     180         
1 1 1 8  0  25 o 8  516.122 4.75719 4722.97     122.998  4722.97     122.998  432.062    240         133.767     240         
1 1 1 8  0  26 o 18 979.015 8.65315 16999.4     424.396  16999.4     424.396  990.357    120         597.274     120         
1 1 1 8  0  27 o 6  331.913 3.56793 1953.47     59.3166  1953.47     59.3166  256.376    180         44.7363     180         
1 1 1 8  0  28 o 13 1640.13 14.5417 47757.4     1194.81  47757.4     1194.81  1152.34    60          6.06526     240         
1 1 1 8  0  29 o 9  398.6   3.90552 2817.02     77.9811  2817.02     77.9811  394.561    300         228.783     300         
1 1 1 8  0  30 o 8  911.686 7.56204 14739.4     345.39   14739.4     345.39   729.526    180         178.705     180         
1 1 1 8  0  31 o 11 83.845  2.13729 125.047     8.954    125.047     8.954    14.8487    60          54.3377     60          
1 1 1 8  0  32 o 9  571.892 5.60038 5799.71     160.437  5799.71     160.437  351.403    300         97.5956     120         
1 1 1 8  0  33 o 2  98.4238 2.4177  172.268     11.8924  172.268     11.8924  4.02922    180         23.3456     180         
1 1 1 8  0  34 o 17 1551.65 13.7649 42752.8     1069.97  42752.8     1069.97  1012.35    240         139.039     60          
1 1 1 8  0  35 o 12 149.944 2.39053 398.989     17.9426  398.989     17.9426  7.69498    120         171.565     300         
1 1 1 8  0  36 o 8  394.532 4.00897 2760.08     79.227   2760.08     79.227   250.954    5.78836e-07 46.1245     180         
1 1 1 8  0  37 o 6  495.252 4.72663 4349.27     117.263  4349.27     117.263  443.955    240         201.352     240         
1 1 1 8  0  38 o 6  1062.37 9.51466 20029.7     506.374  20029.7     506.374  801.156    300         132.617     300         
1 1 1 8  0  39 o 9  155.068 2.59087 426.801     20.1085  426.801     20.1085  71.213     360         0.629623    360         
1 1 1 8  0  40 o 11 356.319 3.87228 2251.68     69.1091  2251.68     69.1091  276.472    240         62.1311     240         
1 1 1 8  0  41 f 0  104.221 2.43707 193.105     12.6971  193.105     12.6971  52.6174    300         0           0           
1 1 1 8  0  42 o 8  544.664 5.77541 5263.31     157.562  5263.31     157.562  493.237    180         239.611     180         
1 1 1 8  0  43 f 0  173.615 2.59841 534.857     22.5847  534.857     22.5847  68.8327    60          0           0           
1 1 1 8  0  44 o 5  332.624 3.75509 1962.5      62.5583  1962.5      62.5583  188.782    300         76.379      120         
1 1 1 8  0  45 o 9  352.55  3.70465 2204.52     65.4202  2204.52     65.4202  222.569    3.58996e-06 34.8167     180         
1 1 1 8  0  46 o 11 19.8098 4.78247 9.01764     4.26028  9.01764     4.26028  6.826      59.9999     14.1825     59.9999     
1 1 1 8  0  47 o 15 159.527 2.83174 451.878     22.6062  451.878     22.6062  109.57     120         7.98887     120         
1 1 1 8  0  48 o 5  145.112 2.31297 373.739     16.801   373.739     16.801   48.8997    180         31.6032     180         
1 1 1 8  0  49 o 1  22.5115 4.63392 10.9879     4.53767  10.9879     4.53767  15.1902    59.9999     32.1811     59.9999     
1 1 1 8  0  50 o 1  764.152 7.32362 10375       280.341  10375       280.341  492.017    300         42.6983     120         
1 1 1 8  0  51 o 11 30.2071 3.39242 17.3493     4.74803  17.3493     4.74803  8.10485    360         19.1309     360         
1 1 1 8  0  52 o 17 288.539 3.34903 1477.1      48.3971  1477.1      48.3971  151.462    240         82.5843     60          
1 1 1 8  0  53 f 0  101.002 2.18892 181.302     11.056   181.302     11.056   92.9511    120         0           0           
1 1 1 8  0  54 o 8  131.537 2.57001 307.366     16.9119  307.366     16.9119  108.045    180         48.2558     180         
1 1 1 8  0  55 o 11 612.444 6.05549 6663.71     185.774  6663.71     185.774  441.319    60          71.5962     60          
1 1 1 8  0  56 o 10 66.0836 2.60895 78.1281     8.57808  78.1281     8.57808  5.7966     120         7.95806     300         
1 1 1 8  0  57 f 0  451.498 4.38393 3618.28     99.1505  3618.28     99.1505  255.461    1.76144e-06 0           0           
1 1 1 8  0  58 o 1  164.29  2.9214  479.41      24.0183  479.41      24.0183  138.051    240         61.1971     240         
1 1 1 8  0  59 o 12 460.412 5.30227 3766.18     122.267  3766.18     122.267  354.656    120         107.238     120         
1 1 1 8  0  60 o 9  258.087 3.3994  1182.42     43.9327  1182.42     43.9327  183.772    1.40147e-08 31.157      1.40147e-08 
1 1 1 8  0  61 o 18 297.118 3.94876 1567.79     58.7495  1567.79     58.7495  267.87     240         149.771     240         
1 1 1 8  0  62 o 4  39.4239 4.2279  29.4118     7.78474  29.4118     7.78474  4.1323     120         18.148      120         
1 1 1 8  0  63 o 8  184.867 3.1205  607.177     28.8725  607.177     28.8725  179.545    180         120.631     180         
1 1 1 8  0  64 o 16 196.829 3.19657 688.337     31.4932  688.337     31.4932  133.941    60          14.8283     60          
1 1 1 8  0  65 o 4  144.591 3.1816  372.01      23.0035  372.01      23.0035  68.9859    120         47.2597     300         
1 1 1 8  0  66 o 19 239.715 3.76316 1021.86     45.157   1021.86     45.157   169.104    360         32.2268     360         
1 1 1 8  0  67 o 14 444.453 5.03494 3518.35     112.08   3518.35     112.08   323.313    240         81.3903     240         
1 1 1 8  0  68 o 7  105.652 3.00564 199.094     15.8552  199.094     15.8552  71.5609    120         9.31223     120         
1 1 1 8  0  69 o 12 23.8271 6.80746 14.0873     7.93571  14.0873     7.93571  11.6532    8.76624e-06 33.8984     8.76624e-06 
1 1 1 8  0  70 o 8  53.115  3.89722 51.7751     10.095   51.7751     10.095   14.7967    60          34.1397     240         
1 1 1 8  0  71 o 11 82.8941 3.22942 123.233     13.3218  123.233     13.3218  36.2991    120         31.1763     300         
1 1 1 8  0  72 o 10 194.761 3.24266 675.543     31.6096  675.543     31.6096  146.251    180         49.5256     180         
1 1 1 8  0  73 o 16 15.1414 6.11859 5.31717     7.31002  5.31717     7.31002  11.4422    240         28.4409     240         
1 1 1 8  0  74 o 4  78.6497 3.19948 111.147     12.5143  111.147     12.5143  53.7355    300         10.1417     300         
1 1 1 8  0  75 o 5  65.8647 3.40398 78.5027     11.0948  78.5027     11.0948  42.1144    3.89475e-06 3.07491     3.89476e-06 
1 1 1 8  0  76 o 12 14.0362 5.92314 3.84971     7.35813  3.84971     7.35813  12.8384    240         34.1076     240         
1 1 1 8  0  77 o 1  53.7314 3.89314 53.1848     10.2096  53.1848     10.2096  35.8807    120         6.36941     120         
1 1 1 8  0  78 o 12 18.5413 6.64636 9.20395     7.69734  9.20395     7.69734  7.46122    180         30.5991     180         
1 1 1 8  0  79 o 4  160.83  2.96632 462.008     23.8713  462.008     23.8713  119.754    240         44.639      240         
1 1 1 8  0  80 o 4  77.3725 3.26573 108.007     12.5584  108.007     12.5584  48.3419    120         3.34706     120         
1 1 1 8  0  81 o 6  126.288 2.92368 285.368     18.4585  285.368     18.4585  63.2201    1.16519e-06 25.2283     180         
1 1 1 8  0  82 o 10 18.7503 6.78436 9.51124     8.06427  9.51124     8.06427  0.844327   60          8.25951     240         
1 1 1 8  0  83 o 18 101.359 3.07617 184.701     15.5598  184.701     15.5598  67.0488    300         13.4664     300         
1 1 1 8  0  84 o 13 17.6711 6.67995 8.41023     8.07632  8.41023     8.07632  0.330777   360         1.27641     180         
1 1 1 8  0  85 o 11 14.8332 6.26709 4.62033     8.25673  4.62033     8.25673  0.994398   60          7.44977     60          
1 1 1 8  0  86 o 7  8.4672  4.32032 -16.5452    9.33053  -16.5452    9.33053  0.8091     300.001     1.94488     300.001     
1 1 1 8  0  87 o 3  22.4915 8.28673 14.4815     12.1768  14.4815     12.1768  1.38095    360         20.9851     180         
1 1 1 8  0  88 o 2  53.4976 6.70668 57.9758     16.2953  57.9758     16.2953  25.1241    240         11.933      60          
1 1 1 8  0  89 o 8  57.7842 6.23402 66.1196     16.8073  66.1196     16.8073  37.1863    120         7.54117     120         
1 1 1 8  0  90 o 5  36.7861 12.4949 42.6097     26.593   42.6097     26.593   21.8725    180         12.7604     180         
1 1 1 8  0  91 x 10 ?       ?       ?           ?        ?           ?        8.11944    240         0           0           
1 1 1 8  0  92 x 15 ?       ?       ?           ?        ?           ?        10.9899    120         0           0           
1 1 1 8  0  93 x 5  ?       ?       ?           ?        ?           ?        22.7849    360         0           0           
1 1 1 8  0  94 x 12 ?       ?       ?           ?        ?           ?        0.697398   240         0           0           
1 1 1 8  0  95 x 5  ?       ?       ?           ?        ?           ?        2.924      120         0           0           
1 1 1 8  0  96 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  1  0  o 7  912.969 7.38682 14782.4     337.867  14782.4     337.867  847.329    4.52417e-06 379.813     4.52417e-06 
1 1 1 8  1  1  o 4  689.154 5.73362 8491.56     211.805  8350.06     183.441  564.984    83.9252     169.061     83.9252     
1 1 1 8  1  2  o 11 676.061 5.59244 8145.08     196.155  8062.05     182.615  400.051    246.603     150.935     66.6033     
1 1 1 8  1  3  o 15 514.83  4.24697 4702.55     113.169  4693.41     105.863  319.247    304.202     70.8181     124.202     
1 1 1 8  1  4  o 16 801.569 6.69082 11309.4     283.171  11481.3     253.297  533.191    303.313     67.1706     123.313     
1 1 1 8  1  5  o 1  1256.59 10.6309 28032.6     655.918  28062.9     682.74   1042.75    346.024     293.148     346.024     
1 1 1 8  1  6  o 1  601.503 5.61331 6285.65     179.633  6545.97     157.557  568.439    92.8781     320.791     92.8781     
1 1 1 8  1  7  o 7  1015.44 8.32095 18253.1     431.172  18346.4     415.51   880.059    86.3018     320.753     86.3018     
1 1 1 8  1  8  o 8  605.916 4.90828 6503.17     153.921  6514.53     143.984  562.97     229.629     299.75      229.629     
1 1 1 8  1  9  o 6  550.617 4.48528 5356.56     127.808  5392.69     119.557  201.369    160.944     368.401     340.944     
1 1 1 8  1  10 o 5  443.216 3.86202 3439.33     90.0418  3524.95     81.1708  306.777    239.514     16.4359     239.514     
1 1 1 8  1  11 o 6  864.67  6.91473 13187.5     314.637  13344.5     283.624  613.766    326.937     4.33252     326.936     
1 1 1 8  1  12 o 7  1006.8  7.82901 17996.9     407.958  17990.5     381.632  939.584    69.2399     457.082     69.2399     
1 1 1 8  1  13 o 14 563.124 4.60101 5536.91     134.013  5708.35     125.374  416.813    171.319     55.4795     171.319     
1 1 1 8  1  14 o 16 640.791 5.13843 7118.5      167.718  7446.22     162.061  582.861    244.284     281.825     244.284     
1 1 1 8  1  15 o 15 134.863 2.01372 341.864     13.8385  303.303     13.3685  35.4012    278.394     185.264     278.394     
1 1 1 8  1  16 o 9  267.027 2.70262 1250.08     36.7725  1277.28     35.5325  122.643    229.62      88.1875     49.6197     
1 1 1 8  1  17 o 14 255.354 2.72935 1142.12     34.2747  1169.09     35.5789  149.68     50.7759     9.12303     50.776      
1 1 1 8  1  18 o 11 427.086 3.91495 3225.28     83.7839  3241.05     83.7999  336.129    99.0198     101.365     99.0198     
1 1 1 8  1  19 o 13 270.457 2.81093 1322.6      37.3625  1270.2      38.7809  151.014    236.019     34.2382     56.0194     
1 1 1 8  1  20 o 2  295.406 3.08988 1568.04     44.7988  1525.08     46.6357  193.473    25.3158     135.579     25.3158     
1 1 1 8  1  21 o 5  538.049 5.01763 5180.68     132.278  5083.35     138.181  453.612    8.18877     169.516     8.18877     
1 1 1 8  1  22 o 2  586.386 5.55085 6143.72     155.45   6047.93     170.323  559.117    291.59      315.947     291.59      
1 1 1 8  1  23 o 14 593.803 5.62078 6391.5      159.273  6111.44     174.5    451.051    15.0714     78.4051     15.0714     
1 1 1 8  1  24 o 12 242.41  3.10494 1075.73     36.6621  1007.46     38.6547  128.34     144.417     45.3085     324.417     
1 1 1 8  1  25 o 14 468.042 4.95412 3951.5      106.465  3814.65     124.856  278.496    325.25      87.519      145.25      
1 1 1 8  1  26 o 7  508.372 5.01523 4584.21     124.676  4577.26     130.788  442.079    0.622213    191.092     0.622213    
1 1 1 8  1  27 o 10 452.99  4.41345 3695.54     93.315   3578.45     106.408  219.71     225.145     184.756     45.1451     
1 1 1 8  1  28 o 5  885.962 7.6667  13928.4     325.881  13910.5     354.297  549.655    264.594     140.75      84.5944     
1 1 1 8  1  29 o 13 330.045 3.33588 1979.13     54.0154  1882.19     56.2313  141.813    68.0739     161.815     248.074     
1 1 1 8  1  30 o 16 391.873 3.68913 2716.09     70.9769  2726.82     73.8964  96.8479    203.43      344.389     23.4299     
1 1 1 8  1  31 f 0  324.563 3.14021 1899.67     49.2813  1834.11     52.7402  167.945    310.713     0           0           
1 1 1 8  1  32 o 14 379.049 3.72924 2565.11     67.7954  2527.55     73.7137  230.378    353.87      48.5016     173.87      
1 1 1 8  1  33 o 18 292.112 3.18021 1511.33     45.5279  1512.95     47.5608  132.352    228.274     118.414     48.2744     
1 1 1 8  1  34 o 4  930.644 7.93356 15008.6     369.89   15723.6     369.979  663.554    132.137     39.1735     132.137     
1 1 1 8  1  35 o 9  336.298 3.68503 1977.11     63.5544  2031.89     60.57    242.595    305.914     53.3043     305.914     
1 1 1 8  1  36 o 10 538.836 5.20983 5172.62     137.271  5122.28     143.979  368.033    217.428     4.972       217.428     
1 1 1 8  1  37 o 4  1069.59 9.62078 19744.4     537.722  20894.4     490.945  740.971    28.4528     6.55063     28.4524     
1 1 1 8  1  38 o 9  127.562 2.54119 271.459     17.2684  306.065     14.9259  21.4685    301.355     37.6804     121.355     
1 1 1 8  1  39 o 10 107.778 2.67767 214.957     14.9988  197.458     13.8879  4.13212    65.8826     101.502     65.8826     
1 1 1 8  1  40 o 4  364.418 4.24884 2345.3      81.7726  2363.56     73.1412  235.044    214.894     16.5789     34.894      
1 1 1 8  1  41 o 14 439.552 4.94351 3422.57     120.371  3430.28     96.0194  323.859    266.395     56.7817     266.395     
1 1 1 8  1  42 o 8  186.878 2.73566 619.18      26.2195  618.761     25.0066  67.0041    59.6486     102.502     239.649     
1 1 1 8  1  43 o 9  374.397 3.96062 2491.59     76.0644  2479.3      72.5245  202.047    54.7856     98.4461     234.786     
1 1 1 8  1  44 o 7  551.636 5.32384 5432.46     150.654  5367.16     143.654  377.406    98.3951     8.87648     98.3951     
1 1 1 8  1  45 o 12 399.972 3.97106 2838.33     77.8357  2835.93     81.3186  240.13     151.25      55.7745     331.25      
1 1 1 8  1  46 o 17 270.536 3.38706 1275.19     48.1286  1320.51     43.5048  210.065    336.728     71.0387     336.728     
1 1 1 8  1  47 o 14 734.1   7.17663 9594.94     250.419  9571.9      276.913  585.539    292.672     182.581     292.672     
1 1 1 8  1  48 o 16 473.496 4.96777 3996.02     129.193  3963.75     105.454  267.678    87.0398     97.9929     267.04      
1 1 1 8  1  49 o 12 246.282 3.12588 1067.38     35.7352  1083.72     41.2668  190.535    350.352     66.101      350.352     
1 1 1 8  1  50 o 18 227.997 2.81551 951.248     32.349   892.538     31.9768  143.191    54.5592     8.3182      234.559     
1 1 1 8  1  51 o 8  238.305 3.15496 1021.02     38.7175  993.304     36.6329  158.719    347.856     7.68722     347.856     
1 1 1 8  1  52 o 12 265.976 3.13348 1233.36     40.8086  1276.12     42.7261  226.004    102.488     108.02      102.488     
1 1 1 8  1  53 o 4  52.3539 2.87265 43.9338     7.79404  54.1344     6.97598  24.9447    148.434     97.2144     148.434     
1 1 1 8  1  54 o 17 299.95  4.17686 1578.33     62.7654  1616.18     62.7992  222.396    109.368     54.3393     109.368     
1 1 1 8  1  55 o 12 465.756 5.3335  3871.54     132.052  3841.26     116.493  334.005    231.114     55.8782     231.114     
1 1 1 8  1  56 o 14 215.843 3.52244 803.848     38.0474  849.895     38.1356  107.466    66.3558     62.2709     246.356     
1 1 1 8  1  57 o 15 503.346 5.31561 4513.18     134.053  4497.69     134.117  318.815    246.878     21.2046     66.8783     
1 1 1 8  1  58 o 1  187.195 3.00618 663.317     28.0989  581.294     28.2043  118.182    341.775     1.68952     341.775     
1 1 1 8  1  59 o 10 222.833 3.30723 875.844     36.9488  886.471     36.9141  169.153    294.815     57.6206     294.815     
1 1 1 8  1  60 o 1  183.14  3.17047 604.463     27.1347  586.375     30.8499  95.4158    279.18      39.5568     99.1803     
1 1 1 8  1  61 o 6  166.08  3.19228 503.252     23.8708  476.482     28.8415  111.532    154.361     18.4355     154.361     
1 1 1 8  1  62 o 6  183.604 3.12979 592.967     28.5849  603.876     29.011   121.681    253.74      13.8073     253.74      
1 1 1 8  1  63 o 3  28.1835 4.63109 21.3452     6.97116  8.61083     6.27065  42.9525    35.9707     108.699     35.9707     
1 1 1 8  1  64 o 5  193.205 3.16544 661.332     29.7656  664.688     31.5112  128.933    213.55      15.1873     213.55      
1 1 1 8  1  65 o 18 179.487 2.91186 571.665     26.4047  572.679     25.9765  113.036    61.3185     1.61507     61.3184     
1 1 1 8  1  66 o 15 36.4357 4.74333 26.5295     7.86702  22.3727     8.7401   12.874     85.6655     55.9756     85.6655     
1 1 1 8  1  67 o 3  52.8032 3.75321 54.3015     9.18587  46.1664     10.2168  13.017     348.786     24.5263     168.786     
1 1 1 8  1  68 o 16 33.7616 4.95857 19.7284     7.62727  22.6162     8.61138  0.289241   29.8388     5.01116     29.8389     
1 1 1 8  1  69 o 8  61.5565 3.57716 76.1682     10.58    60.3007     11.0935  11.856     54.0195     45.7371     234.02      
1 1 1 8  1  70 o 7  101.058 3.07203 191.455     14.6295  173.235     16.2548  73.9649    57.4071     31.5075     57.4071     
1 1 1 8  1  71 o 19 123.4   3.06126 277.488     18.7928  265.981     18.999   73.9184    316.149     1.06945     136.149     
1 1 1 8  1  72 o 5  72.2296 3.32951 95.8537     11.8758  91.2288     12.084   39.089     13.2594     3.83769     193.259     
1 1 1 8  1  73 o 4  68.7506 3.4433  88.5276     11.9487  81.3908     11.62    43.0295    344.251     7.59042     344.251     
1 1 1 8  1  74 o 10 176.163 2.97843 531.2       26.7236  577.784     25.7552  120.81     120.233     25.5054     120.233     
1 1 1 8  1  75 o 4  52.2833 3.8978  47.3406     10.0484  52.0626     10.0482  26.615     173.351     5.35456     353.351     
1 1 1 8  1  76 o 16 28.8197 5.58165 18.904      8.50953  12.5116     8.26674  6.32968    213.642     5.27479     33.642      
1 1 1 8  1  77 o 11 30.1491 5.34842 10.7714     8.23002  23.9745     8.48196  2.28412    268.562     25.7363     88.5621     
1 1 1 8  1  78 o 18 36.8803 5.01596 23.4055     8.79605  27.9996     9.06827  13.1623    210.254     11.9387     30.2541     
1 1 1 8  1  79 o 7  22.5475 5.71461 10.7407     7.76038  4.55296     9.16478  1.27006    226.265     11.2604     46.2655     
1 1 1 8  1  80 o 7  51.9558 4.09793 57.9569     10.267   41.8247     10.4051  33.5381    157.709     10.4141     157.709     
1 1 1 8  1  81 o 3  87.139  3.29141 136.128     14.4923  138.342     14.1436  39.5657    151.244     23.7163     331.244     
1 1 1 8  1  82 o 7  21.3594 5.71764 5.73136     8.34483  7.40771     8.47086  5.19093    161.511     31.2874     161.511     
1 1 1 8  1  83 o 2  29.4356 5.8323  13.9789     8.8373   19.8421     9.19568  6.31166    172.522     18.0334     352.522     
1 1 1 8  1  84 o 8  51.3635 4.2952  48.276      10.8008  50.2753     10.8812  13.1339    209.106     32.6404     29.1057     
1 1 1 8  1  85 o 14 35.4532 5.35298 12.4328     9.37468  38.5306     9.77008  18.7346    300.907     1.37419     300.907     
1 1 1 8  1  86 o 1  79.5087 3.90701 114.359     14.73    119.878     16.201   48.0759    80.946      4.87999     80.946      
1 1 1 8  1  87 o 14 26.0681 6.71952 13.9127     12.104   10.7329     10.687   7.94946    183.091     4.03974     3.09144     
1 1 1 8  1  88 o 9  49.8651 6.75297 53.9561     16.279   48.2023     16.2316  27.4027    29.3107     1.25608     29.3107     
1 1 1 8  1  89 o 8  21.9576 6.59636 3.63704     12.5662  3.03414     12.7522  3.22549    273.604     6.01601     93.6042     
1 1 1 8  1  90 o 18 36.0637 8.65765 53.4679     22.9231  -16.4504    25.3813  18.077     33.8744     1.16345     33.8745     
1 1 1 8  1  91 x 3  ?       ?       ?           ?        ?           ?        27.0002    91.8506     0           0           
1 1 1 8  1  92 x 0  ?       ?       ?           ?        ?           ?        4.35302    172.04      0           0           
1 1 1 8  1  93 x 5  ?       ?       ?           ?        ?           ?        12.2794    305.606     0           0           
1 1 1 8  1  94 x 4  ?       ?       ?           ?        ?           ?        7.86255    304.451     0           0           
1 1 1 8  1  95 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  2  0  o 15 186.445 2.38995 616.556     22.314   616.556     22.314   32.4887    360         38.179      180         
1 1 1 8  2  1  o 2  104.069 2.02807 198.704     10.9786  185.525     10.1582  133.48     158.923     352.579     158.923     
1 1 1 8  2  2  f 0  481.383 4.31098 4140.2      103.994  4075.18     103.998  435.564    162.514     0           0           
1 1 1 8  2  3  o 9  449.74  4.01668 3614.19     88.822   3556.26     92.1741  331.313    72.4797     59.1804     72.4797     
1 1 1 8  2  4  o 4  1000.28 8.51693 17773.1     435.395  17747.3     418.325  707.814    166.374     8.64355     346.374     
1 1 1 8  2  5  o 14 368.825 3.58969 2388.78     62.2702  2433.35     70.2575  297.936    223.925     192.285     223.925     
1 1 1 8  2  6  o 12 432.25  4.21844 3296.49     93.3316  3327.58     89.3638  350.639    291.672     134.002     291.672     
1 1 1 8  2  7  o 19 132.929 2.2661  312.505     14.4501  313.94      15.7051  47.3489    45.6358     198.229     45.6358     
1 1 1 8  2  8  o 8  76.4279 1.97043 104.996     7.38891  102.302     7.67237  32.1674    279.83      76.4604     279.83      
1 1 1 8  2  9  o 14 340.8   3.26369 2074.78     54.688   2042.32     56.7545  166.817    303.171     116.419     123.171     
1 1 1 8  2  10 o 9  841.655 6.94023 12583.3     287.24   12556.2     298.108  637.601    71.0208     85.2769     71.0209     
1 1 1 8  2  11 o 10 764.633 6.3564  10398.7     238.995  10345.9     248.037  547.622    213.477     16.9908     213.477     
1 1 1 8  2  12 o 9  464.184 4.11935 3852.34     94.0134  3787.3      97.5682  353.652    164.278     79.1623     164.278     
1 1 1 8  2  13 o 5  1002.22 8.15675 17846.2     401.989  17822.8     417.211  865.913    62.5511     312.58      62.5511     
1 1 1 8  2  14 o 4  350.125 3.3271  2218.55     57.2555  2127.46     59.4161  284.409    125.611     196.297     125.611     
1 1 1 8  2  15 o 15 386.77  3.50342 2639.66     67.8991  2663.26     67.9112  348.881    109.647     239.317     109.647     
1 1 1 8  2  16 o 10 414.939 3.69721 3025.82     76.8715  3077.85     76.8864  200.333    66.5986     167.963     246.599     
1 1 1 8  2  17 o 4  371.407 3.64511 2412.63     67.8335  2477.49     67.849   114.936    248.782     278.374     68.7816     
1 1 1 8  2  18 o 11 204.458 2.65766 747.266     26.6252  734.354     27.812   76.7985    236.273     73.3321     56.2733     
1 1 1 8  2  19 o 18 348.119 3.60738 2177.22     61.5256  2118.61     64.2649  249.446    152.947     43.2104     152.947     
1 1 1 8  2  20 o 7  575.071 5.44004 5875.2      156.765  5850.68     156.79   522.858    257.495     255.759     257.495     
1 1 1 8  2  21 o 10 806.177 7.49064 11581       295.271  11473.2     309.74   539.71     87.1343     55.5085     267.134     
1 1 1 8  2  22 o 17 581.063 5.74481 6028.29     167.266  5942.86     167.299  417.043    212.609     26.2529     212.609     
1 1 1 8  2  23 o 8  431.693 4.27003 3268.31     88.0968  3337.55     96.5458  352.37     36.6537     121.703     36.6537     
1 1 1 8  2  24 o 1  745.13  6.56422 9969.22     234.521  9718.91     254.997  485.845    9.94275     73.1422     189.943     
1 1 1 8  2  25 o 17 507.057 4.59485 4613.29     114.352  4500.68     119.046  331.929    208.976     36.8255     28.9761     
1 1 1 8  2  26 o 9  1266.81 10.5944 28736.5     658.818  28225.2     685.801  772.79     59.726      239.688     239.726     
1 1 1 8  2  27 o 16 340.677 3.3567  2077.97     56.1227  2035.57     58.4417  195.559    58.0377     66.8708     238.038     
1 1 1 8  2  28 o 8  644.091 5.73621 7432.44     185.135  7276.14     185.157  468.586    123.388     42.5664     123.388     
1 1 1 8  2  29 o 13 109.144 2.15995 211.622     11.3056  210.872     12.2776  0.692143   44.693      51.3003     224.693     
1 1 1 8  2  30 o 1  266.305 2.84167 1231.14     36.4357  1282.52     39.4027  187.423    228.679     40.9099     228.679     
1 1 1 8  2  31 o 10 524.698 4.82213 4868.82     115.751  4890.8      136.997  340.91     101.777     38.9367     281.777     
1 1 1 8  2  32 o 10 822.066 7.21752 11989.6     271.389  11979.8     321.177  653.254    353.261     167.667     353.261     
1 1 1 8  2  33 o 2  514.427 4.79225 4686.37     120.814  4695.31     126.221  417.129    308.089     137.859     308.089     
1 1 1 8  2  34 o 7  980.016 8.92634 16939.1     448.567  17149.6     427.839  702.296    354.313     47.043      354.313     
1 1 1 8  2  35 o 3  1174.15 10.6552 24256.3     641.441  24717.7     611.822  781.561    162.686     64.3928     342.686     
1 1 1 8  2  36 o 19 547.494 5.25694 5275.73     147.581  5353.24     140.754  424.764    79.9115     107.467     79.9115     
1 1 1 8  2  37 o 3  706.158 6.49382 8818.46     239.97   8871.4      219.103  476.264    248.16      16.1756     68.1601     
1 1 1 8  2  38 o 3  957.043 8.86122 16269.6     454.308  16261.4     393.503  773.411    343.143     230.692     343.143     
1 1 1 8  2  39 o 18 905.813 8.57222 14455.9     407.913  14689.5     369.03   627.668    15.4495     10.7267     15.4497     
1 1 1 8  2  40 o 11 747.203 7.04769 9886.84     270.087  9933.38     257.54   555.095    229.581     88.1405     229.581     
1 1 1 8  2  41 o 3  117.082 2.3389  240.235     13.7223  246.039     13.6951  5.58355    42.3967     119.174     222.397     
1 1 1 8  2  42 o 16 133.377 2.52196 308.928     16.6187  322.16      17.0659  50.9875    140.426     44.0501     320.426     
1 1 1 8  2  43 o 8  551.464 5.44419 5358.87     150.418  5433.93     150.49   407.198    210.739     67.6549     210.739     
1 1 1 8  2  44 o 18 332.846 3.83775 1985.96     60.3104  1943.25     67.4369  173.238    25.1343     98.5605     205.134     
1 1 1 8  2  45 o 4  235.39  3.31149 974.655     37.8858  990.174     40.2229  159.76     45.5845     16.9985     45.5845     
1 1 1 8  2  46 f 0  400.294 4.07477 2791.95     81.5681  2893.07     81.901   202.196    166.373     0           0           
1 1 1 8  2  47 o 13 380.69  4.63327 2561.83     82.6668  2581.94     93.8088  337.589    285.449     174.281     285.449     
1 1 1 8  2  48 o 15 334.967 4.32344 1930.61     70.1241  2052.21     75.0436  170.895    261.647     102.84      81.6467     
1 1 1 8  2  49 o 17 341.25  4.04337 2052.09     69.1298  2080.17     69.1629  261.613    102.372     73.4418     102.372     
1 1 1 8  2  50 o 11 135.879 2.56476 324.769     16.4499  330.355     18.4086  95.0195    310.679     41.3204     310.679     
1 1 1 8  2  51 o 2  324.349 3.84878 1832.5      62.5336  1901.06     62.5712  189.888    197.077     49.5112     17.0774     
1 1 1 8  2  52 o 2  107.587 2.58931 199.221     13.1163  211.8       14.7561  58.8638    260.899     1.07708     80.8987     
1 1 1 8  2  53 o 7  326.732 3.9826  1880.68     61.4914  1908.76     68.7765  200.094    184.517     29.502      4.5166      
1 1 1 8  2  54 o 16 49.7654 2.99461 45.3601     7.09783  43.1394     7.66506  11.32      173.345     52.5178     173.345     
1 1 1 8  2  55 o 5  287.068 3.2726  1484.95     45.9497  1439.21     48.1421  242.452    52.5226     115.04      52.5226     
1 1 1 8  2  56 o 14 96.1309 2.80639 170.03      15.356   158.424     11.4635  7.61823    217.738     98.7628     37.7378     
1 1 1 8  2  57 o 18 381.288 4.38461 2614.13     83.7791  2550.88     83.7734  278.462    48.987      60.6964     48.987      
1 1 1 8  2  58 o 14 177.45  2.78832 562.186     25.9847  554.855     23.5628  105.228    134.515     11.7963     314.515     
1 1 1 8  2  59 o 17 337.167 3.77312 1994.08     66.7896  2042.92     60.4767  217.531    32.9914     0.820583    212.992     
1 1 1 8  2  60 f 0  129.71  2.58648 288.352     17.4922  309.134     15.9981  155.378    87.9551     0           0           
1 1 1 8  2  61 o 19 226.403 3.1286  891.94      36.3924  927.777     34.5299  143.826    326.582     0.110064    326.588     
1 1 1 8  2  62 o 3  109.35  2.60353 217.063     14.6547  207.775     13.8403  64.3144    108.637     0.540929    108.636     
1 1 1 8  2  63 o 5  58.6108 3.02507 63.0152     9.02566  59.6351     8.62408  7.37488    15.8131     46.5952     195.813     
1 1 1 8  2  64 o 5  50.683  3.11849 51.4641     8.10029  40.7909     7.55278  1.60829    230.54      54.4264     230.54      
1 1 1 8  2  65 o 15 91.2083 2.65058 156.907     12.336   139.259     11.8351  62.1038    33.0338     25.152      33.0338     
1 1 1 8  2  66 o 6  300.981 3.74318 1621.31     56.435   1604.01     56.4833  182.693    82.1782     16.247      262.178     
1 1 1 8  2  67 o 2  27.9495 4.43772 21.5117     6.62931  8.20699     5.8743   25.7793    155.627     74.1974     155.627     
1 1 1 8  2  68 o 14 79.3458 2.79512 124.7       10.9079  100.38      11.1232  50.0405    264.166     13.2057     264.166     
1 1 1 8  2  69 o 11 29.154  4.50044 14.2359     6.72932  17.3457     6.0585   10.5498    279.513     40.3163     279.513     
1 1 1 8  2  70 f 0  176.091 2.86411 571.606     25.5073  532.788     25.0331  92.2985    318.596     0           0           
1 1 1 8  2  71 o 2  89.5439 2.71768 150.303     12.8188  135.876     11.5227  63.8961    230.799     26.8871     230.799     
1 1 1 8  2  72 o 6  113.794 2.77514 244.609     16.0308  217.702     15.5566  71.0631    225.517     4.666       225.517     
1 1 1 8  2  73 f 0  117.899 2.894   254.395     16.7028  242.117     17.4094  75.4401    193.494     0           0           
1 1 1 8  2  74 o 3  67.2356 3.19334 80.1711     10.5789  82.2139     10.8163  25.6264    291.437     28.5513     111.437     
1 1 1 8  2  75 o 14 14.4038 4.45024 1.00316     5.99346  -4.63245    6.4938   3.62135    17.2326     10.0928     17.2326     
1 1 1 8  2  76 o 6  18.1535 5.03489 3.56648     6.43548  3.83304     6.9197   1.47245    148.967     6.83519     148.967     
1 1 1 8  2  77 o 5  71.2389 3.17412 88.473      11.2628  94.3812     11.2765  38.007     20.1402     7.69843     200.14      
1 1 1 8  2  78 o 9  95.2145 2.87733 166.466     13.8018  158.985     13.5922  54.4211    347.534     4.66802     167.534     
1 1 1 8  2  79 o 19 31.8331 4.98341 14.0658     7.62562  24.8906     8.00825  11.2278    252.923     2.19535     252.923     
1 1 1 8  2  80 o 5  32.6636 5.00715 21.0381     7.73574  19.5934     8.18335  14.0933    126.163     0.242296    126.163     
1 1 1 8  2  81 o 10 46.3234 4.03803 44.1692     8.96642  35.2183     9.22516  21.0993    111.824     9.66688     291.824     
1 1 1 8  2  82 f 0  18.3116 5.13835 3.83622     6.75293  3.5642      7.30968  12.7515    119.552     0           0           
1 1 1 8  2  83 o 4  39.3158 4.79487 27.8731     8.54084  30.947      9.67547  13.0044    1.6439      17.6487     181.644     
1 1 1 8  2  84 o 14 62.5766 3.51525 64.8619     10.8537  79.0424     10.926   28.8502    243.025     14.501      63.0248     
1 1 1 8  2  85 o 17 54.7274 4.3792  50.003      11.6753  62.8547     11.7783  33.4627    65.7281     5.60198     65.7281     
1 1 1 8  2  86 o 14 33.9542 5.83773 19.2883     9.95067  27.0466     9.86548  14.586     156.767     5.57771     336.767     
1 1 1 8  2  87 o 3  39.5181 6.83208 30.744      14.5826  33.9683     12.3454  7.86639    69.1011     27.329      249.101     
1 1 1 8  2  88 o 13 24.1291 6.72236 8.32274     12.9117  8.96657     11.0377  4.26274    230.238     2.9212      50.2384     
1 1 1 8  2  89 o 9  41.9989 7.9092  26.1197     19.8091  49.8753     16.1715  18.5377    189.595     7.17081     9.59502     
1 1 1 8  2  90 o 17 67.5709 7.00469 108.512     23.4939  80.1105     22.2281  44.3045    205.555     13.6901     205.555     
1 1 1 8  2  91 o 2  51.6639 21.3667 0           0        105.891     63.7187  17.9185    269.086     16.499      89.0855     
1 1 1 8  2  92 x 4  ?       ?       ?           ?        ?           ?        22.5006    131.806     0           0           
1 1 1 8  2  93 x 14 ?       ?       ?           ?        ?           ?        11.0127    179.177     0           0           
1 1 1 8  2  94 x 2  ?       ?       ?           ?        ?           ?        6.80204    300.655     0           0           
1 1 1 8  2  95 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  3  0  o 18 1407.72 13.8864 35227.9     979.212  35227.9     979.212  1051.15    4.88979e-06 73.2366     4.88979e-06 
1 1 1 8  3  1  f 0  197.54  2.61525 673.803     26.4231  709.485     25.3026  288.382    87.6544     0           0           
1 1 1 8  3  2  o 18 504.936 4.66017 4507.49     117.921  4532.97     117.924  436.711    96.5773     192.654     96.5773     
1 1 1 8  3  3  o 1  304.465 3.45635 1676.94     56.4556  1609.45     48.885   183.266    223.649     110.612     223.649     
1 1 1 8  3  4  o 17 466.592 4.5804  3905.36     102.066  3814.47     111.792  203.454    242.178     240.221     62.1777     
1 1 1 8  3  5  o 7  592.219 5.23738 6168.05     152.315  6270.69     158.542  335.133    213.584     160.623     33.5837     
1 1 1 8  3  6  o 9  441.466 4.38338 3485.69     92.4248  3424.7      101.244  330.847    350.671     68.2789     350.671     
1 1 1 8  3  7  o 12 279.985 3.18369 1389.2      46.6555  1389.57     42.5936  54.6355    267.712     258.271     87.7117     
1 1 1 8  3  8  o 9  382.859 3.70033 2611.45     66.5813  2585.09     75.1112  331.501    338.734     200.397     338.734     
1 1 1 8  3  9  o 11 461.593 4.17694 3777.83     92.8304  3776.72     100.27   304.079    266.251     23.7115     86.2507     
1 1 1 8  3  10 o 7  214.235 2.59106 825.957     27.2472  800.892     28.3561  27.5952    18.5196     205.042     198.52      
1 1 1 8  3  11 o 13 463.645 4.17344 3767.21     93.1982  3854.85     100.675  250.978    97.7342     138.411     277.734     
1 1 1 8  3  12 o 15 148.801 2.21654 384.571     15.8895  400.239     17.1641  9.60781    275.757     150.109     275.757     
1 1 1 8  3  13 o 6  729.366 6.29887 9421.67     225.583  9452.43     234.806  662.597    202.321     305.279     202.321     
1 1 1 8  3  14 o 18 442.627 4.27382 3469.26     92.7146  3477.01     96.8475  405.015    310.111     229.86      310.111     
1 1 1 8  3  15 o 8  367.671 3.72563 2386.08     67.1396  2406.08     70.1331  283.922    276.575     88.6098     276.575     
1 1 1 8  3  16 o 5  610.315 5.594   6569.07     167.34   6640.98     174.805  425.804    162.616     1.71755     342.616     
1 1 1 8  3  17 o 9  566.466 5.36135 5696.45     152.189  5682.01     152.207  419.228    66.8371     51.1323     66.8371     
1 1 1 8  3  18 o 14 1096.28 10.0974 21425.4     541.293  21255.4     567.761  759.914    78.6075     36.2106     258.608     
1 1 1 8  3  19 o 13 712.476 6.72815 8968        234.44   9035.99     245.923  540.408    51.4795     80.7726     51.4795     
1 1 1 8  3  20 o 16 372.733 3.7555  2446.78     68.6089  2477.62     71.674   268.049    7.6551      37.3796     7.65511     
1 1 1 8  3  21 o 8  357.503 3.52997 2299.44     60.5045  2230.77     65.7802  309.41     218.484     158.413     218.484     
1 1 1 8  3  22 o 9  963.923 8.35569 16496.2     386.409  16464.5     420.114  665.916    256.442     29.3987     76.4419     
1 1 1 8  3  23 o 1  334.734 3.4322  1995.81     55.1077  1975.4      59.9155  266.029    225.161     96.8494     225.161     
1 1 1 8  3  24 o 14 177.151 2.43865 575.807     20.6883  536.7       22.4903  61.2334    23.5513     75.5616     203.551     
1 1 1 8  3  25 o 19 745.734 6.46258 9958.79     226.393  9760.34     255.456  533.682    18.9696     22.925      18.9696     
1 1 1 8  3  26 o 9  419.792 3.94385 3119.03     77.8186  3127.13     87.8295  256.813    136.842     61.407      316.842     
1 1 1 8  3  27 o 9  753.656 6.5206  10169.3     230.851  9971.92     260.496  626.212    177.341     201.309     177.341     
1 1 1 8  3  28 o 3  172.474 2.40301 537.357     19.4414  516.964     21.9673  78.7726    42.9728     6.19323     42.9729     
1 1 1 8  3  29 o 10 93.8234 2.23757 158.166     9.76068  154.165     11.182   14.1114    260.648     70.5875     260.648     
1 1 1 8  3  30 o 16 530.734 5.02575 4995.92     127.427  4989.86     139.629  356.265    321.752     18.1493     141.752     
1 1 1 8  3  31 o 12 664.636 6.37224 7917.4      196.314  7747.77     226.732  382.219    63.5696     157.281     243.57      
1 1 1 8  3  32 o 17 366.153 3.92379 2403.38     66.5855  2348.98     76.9165  294.573    290.337     111.286     290.337     
1 1 1 8  3  33 o 9  258.354 3.22423 1228.92     40.0031  1137.69     43.2514  143.419    107.018     36.3306     287.018     
1 1 1 8  3  34 o 5  896.242 8.00801 14273.7     359.657  14229.2     359.692  591.046    225.955     58.751      45.9548     
1 1 1 8  3  35 o 6  557.017 5.24645 5488.48     146.427  5513.17     146.476  333.205    127.81      95.3629     307.81      
1 1 1 8  3  36 o 16 251.504 3.09745 1128.68     39.9449  1113.36     38.1248  88.2487    115.433     149.223     295.433     
1 1 1 8  3  37 o 12 853.27  7.83066 12752.5     326.77   13093.1     342.896  670.488    162.939     166.557     162.939     
1 1 1 8  3  38 o 15 142.879 2.5832  367.838     18.4602  356.242     18.4981  11.7909    193.476     196.283     193.476     
1 1 1 8  3  39 o 11 440.897 4.78337 3540.85     105.646  3354.42     105.675  305.423    69.7409     14.5896     69.7409     
1 1 1 8  3  40 o 16 342.948 3.88413 2113.75     64.9327  2056.67     68.4718  247.607    17.5191     39.2258     17.5191     
1 1 1 8  3  41 o 8  260.872 3.42163 1198.54     44.732   1214.29     44.7311  125.469    181.582     93.1972     1.58207     
1 1 1 8  3  42 o 11 485.543 5.1927  4201.63     126.348  4163.48     126.353  328.678    201.682     0.38497     21.6842     
1 1 1 8  3  43 o 12 277.8   3.47966 1415.74     48.5851  1321.56     48.2677  189.834    24.039      14.1811     24.039      
1 1 1 8  3  44 o 2  421.573 4.53594 3151.95     98.3095  3153.66     93.2822  299.154    258.249     31.8926     258.249     
1 1 1 8  3  45 o 4  325.114 3.86104 1876.37     62.9139  1872.89     62.9006  275.229    231.316     124.16      231.316     
1 1 1 8  3  46 f 0  281.578 3.3738  1409.37     47.6089  1402.53     47.6065  188.498    34.1293     0           0           
1 1 1 8  3  47 o 4  123.642 2.7682  277.836     18.6317  264.831     15.5568  60.4872    71.6133     0.130735    251.614     
1 1 1 8  3  48 o 18 190.768 2.73943 649.515     25.8744  640.891     26.4956  111.612    348.027     18.4537     168.027     
1 1 1 8  3  49 o 16 171.467 2.59928 528.962     22.0609  513.558     22.5952  107.019    172.73      0.263086    352.729     
1 1 1 8  3  50 o 12 50.786  2.90158 44.3286     7.37188  47.7683     7.2582   31.3133    35.0987     108.01      35.0987     
1 1 1 8  3  51 o 17 245.246 2.93149 1100.6      36.8198  1033.08     35.2437  103.544    9.44173     115.755     189.442     
1 1 1 8  3  52 o 18 92.2496 2.28883 150.02      10.7526  152.08      10.3706  42.2358    33.376      5.42783     213.376     
1 1 1 8  3  53 o 3  342.468 3.80302 2057.79     68.3657  2105.16     61.9336  210.944    2.17534     29.2408     182.175     
1 1 1 8  3  54 o 11 174.258 2.75563 524.084     22.8775  553.115     25.2435  78.7473    57.7485     64.7123     237.749     
1 1 1 8  3  55 o 14 250.733 2.94435 1123.88     37.0214  1106.3      36.9704  147.928    205.939     29.0483     25.9394     
1 1 1 8  3  56 o 19 131.681 2.82664 313         20.6839  302.703     16.3966  87.0444    234.264     21.181      234.264     
1 1 1 8  3  57 o 16 427.861 4.65604 3280.5      97.1639  3225.73     102.386  297.581    216.763     36.2815     216.763     
1 1 1 8  3  58 o 6  387.383 4.13957 2634.74     84.2067  2696.04     76.2184  263.168    242.892     22.5377     242.892     
1 1 1 8  3  59 o 10 447.549 4.67755 3568.82     110.021  3552.71     99.5592  310.32     162.979     38.8974     162.979     
1 1 1 8  3  60 o 5  156.821 2.65142 459.051     21.8396  414.026     19.8486  86.6021    338.059     21.5699     158.059     
1 1 1 8  3  61 o 4  363.414 4.1386  2357.36     81.0863  2337.8      69.2358  251.899    164.824     35.3645     164.824     
1 1 1 8  3  62 o 9  164.356 2.76947 504.77      24.532   454.678     21.0929  63.8916    278         79.8878     98          
1 1 1 8  3  63 o 3  150.951 2.71495 436.223     21.1576  374.117     19.8866  65.3407    233.659     58.9102     53.6587     
1 1 1 8  3  64 o 11 187.877 2.88642 664.834     28.0922  589.992     26.2667  145.224    224.684     55.6626     224.684     
1 1 1 8  3  65 o 11 174.445 2.83018 578.021     25.6017  504.302     23.8833  111.753    178.276     5.30575     178.276     
1 1 1 8  3  66 o 4  219.731 3.11208 911.473     34.512   806.936     33.9616  166.597    169.015     57.3726     169.015     
1 1 1 8  3  67 o 11 106.806 2.70714 220.15      15.0397  186.516     13.8909  51.192     140.098     27.1749     320.098     
1 1 1 8  3  68 o 14 61.6085 3.05288 77.6711     9.76413  58.7366     8.92402  27.4279    351.173     9.62305     171.173     
1 1 1 8  3  69 o 12 93.9599 2.74277 171.624     13.42    143.649     12.3503  47.1794    3.12885     17.4111     183.129     
1 1 1 8  3  70 o 7  211.663 2.95657 826.853     32.3621  769.701     30.3701  165.79     82.3273     69.5684     82.3273     
1 1 1 8  3  71 o 1  74.3823 2.88684 108.876     11.183   89.3396     10.2488  40.409     21.527      3.86571     201.527     
1 1 1 8  3  72 o 12 138.979 2.68364 362.402     19.3498  326.698     18.0053  67.4456    215.008     36.1037     35.0078     
1 1 1 8  3  73 o 16 65.0249 3.21304 75.9304     9.99594  75.9076     10.7955  35.1791    283.126     5.73658     103.126     
1 1 1 8  3  74 o 14 99.9683 2.74972 184.371     13.8328  172.931     13.66    69.0811    161.342     17.8485     161.342     
1 1 1 8  3  75 o 10 34.1419 4.68264 22.7376     8.44413  20.8977     6.9938   5.99369    63.3414     23.625      243.341     
1 1 1 8  3  76 o 1  13.7202 4.21876 -1.86782    6.23131  0.143736    4.63619  4.01236    210.559     11.058      210.559     
1 1 1 8  3  77 o 15 95.4328 2.83753 176.216     14.3835  150.92      12.7141  58.5226    156.131     2.98727     156.131     
1 1 1 8  3  78 o 19 25.6406 5.18575 5.34585     7.24456  18.8867     7.80925  4.62547    169.185     8.86299     349.185     
1 1 1 8  3  79 o 6  50.5636 3.80561 43.1504     9.53511  50.4591     9.38281  17.7518    309.595     22.385      129.595     
1 1 1 8  3  80 o 1  46.2185 4.08154 40.0053     9.30545  38.7601     9.19038  26.878     232.682     3.57394     232.682     
1 1 1 8  3  81 o 4  31.7838 5.15406 15.5017     7.98782  23.49       8.19081  5.87263    199.833     22.2352     19.8335     
1 1 1 8  3  82 o 7  32.5068 5.34928 21.4657     8.3471   19.4752     8.76473  8.35502    50.0157     18.2475     230.016     
1 1 1 8  3  83 o 18 62.3545 3.78312 78.0358     12.5067  65.2561     10.9261  30.1207    132.401     11.9072     312.401     
1 1 1 8  3  84 o 19 12.6512 4.33369 -13.0416    9.91282  -9.3336     6.34712  12.0519    214.26      34.4045     214.26      
1 1 1 8  3  85 o 18 97.035  3.78139 172.704     19.0706  174.464     17.5144  54.0478    277.465     4.96595     97.4649     
1 1 1 8  3  86 o 19 58.5933 4.88886 74.148      15.161   57.5425     13.0144  35.3685    43.3149     5.04461     43.3149     
1 1 1 8  3  87 o 2  20.3733 6.10616 9.21463     12.0463  -7.95686    10.7018  1.09853    319.977     2.2585      139.977     
1 1 1 8  3  88 f 0  30.0681 7.24469 18.5671     13.8349  18.0602     12.3358  21.673     336.162     0           0           
1 1 1 8  3  89 o 15 25.6221 7.29288 -9.86495    17.871   18.0193     14.5446  5.76141    52.6877     11.3787     232.688     
1 1 1 8  3  90 o 10 31.1124 8.37417 15.949      19.1007  21.3256     17.3349  14.2507    325.397     0.681606    325.397     
1 1 1 8  3  91 o 8  27.0096 12.5407 0           0        -5.99664    28.805   4.02367    66.1456     0.514937    246.146     
1 1 1 8  3  92 x 7  ?       ?       ?           ?        ?           ?        31.1398    349.284     0           0           
1 1 1 8  3  93 x 15 ?       ?       ?           ?        ?           ?        21.2561    88.3864     0           0           
1 1 1 8  3  94 x 12 ?       ?       ?           ?        ?           ?        8.9636     187.073     0           0           
1 1 1 8  3  95 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  4  0  o 6  142.335 2.41351 359.606     17.1932  359.606     17.1932  168.428    1.69517e-06 530.865     1.69517e-06 
1 1 1 8  4  1  o 18 607.74  5.70148 6566.92     173.645  6534.79     173.648  460.597    17.5746     72.0609     17.5746     
1 1 1 8  4  2  o 11 248.626 2.84306 1098.86     35.4243  1092.18     35.4225  119.559    107.861     48.6113     287.861     
1 1 1 8  4  3  o 10 319.8   3.34021 1829.03     54.6939  1796.45     52.3623  197.119    20.7868     14.5151     200.787     
1 1 1 8  4  4  o 2  451.351 4.43965 3632.08     100.422  3591.51     100.417  396.118    165.784     195.116     165.784     
1 1 1 8  4  5  o 2  337.105 3.47251 2010.19     57.3765  2018.33     59.9279  167.626    198.284     112.67      18.2838     
1 1 1 8  4  6  o 6  493.066 4.76206 4309.86     117.669  4311.54     117.668  443.451    252.029     224.113     252.029     
1 1 1 8  4  7  o 19 730.631 7.02144 9462.46     257.084  9484.18     257.095  341.6      77.2448     354.666     257.245     
1 1 1 8  4  8  o 10 497.463 4.74401 4355.51     118.262  4420.25     118.269  388.256    88.6789     94.4861     88.6789     
1 1 1 8  4  9  f 0  986.807 9.06998 17340.3     459.111  17256.4     437.758  638.764    45.5159     0           0           
1 1 1 8  4  10 o 5  216.88  2.91637 854.845     31.6945  812.674     31.6852  41.7433    96.7324     182.088     276.732     
1 1 1 8  4  11 o 5  733.055 7.04281 9578.86     258.732  9491.88     258.72   485.309    19.1735     66.1476     199.173     
1 1 1 8  4  12 o 4  364.012 3.95225 2362.1      72.0978  2335.5      72.0957  261.671    106.911     43.6818     106.911     
1 1 1 8  4  13 o 1  553.771 5.47866 5510.6      152.034  5365.65     152.03   235.163    236.145     308.265     56.145      
1 1 1 8  4  14 o 12 228.441 2.97399 943.163     34.0412  906.67      34.0419  124.363    337.149     26.0663     337.149     
1 1 1 8  4  15 o 15 304.416 3.42388 1609.49     50.9873  1675.59     53.4837  68.2935    17.1218     274.92      197.122     
1 1 1 8  4  16 o 18 545.686 5.17552 5332.35     141.526  5225.99     141.528  487.895    20.0283     225.456     20.0283     
1 1 1 8  4  17 o 18 220.136 2.77361 865.929     28.5201  851.593     32.5111  53.9766    191.109     170.083     11.1093     
1 1 1 8  4  18 o 7  399.965 3.88233 2829.6      74.5083  2840.76     81.0028  267.58     263.096     9.03383     83.0959     
1 1 1 8  4  19 o 11 956.008 8.47104 16028.3     378.685  16399.4     431.822  654.426    233.547     45.9205     53.5468     
1 1 1 8  4  20 o 1  199.778 2.55583 721.554     24.4742  693.034     26.6069  19.5296    191.219     298.351     191.219     
1 1 1 8  4  21 o 11 252.619 2.87159 1126.84     33.9088  1134.86     38.6598  171.305    255.973     106.211     255.973     
1 1 1 8  4  22 o 16 797.931 6.85348 11248       257.121  11329.5     290.108  729.394    79.9096     340.036     79.9096     
1 1 1 8  4  23 o 1  419.916 4.06773 3139.35     78.1086  3110.6      92.4241  285.541    277.835     3.69095     97.8353     
1 1 1 8  4  24 o 8  365.459 3.66203 2352.09     62.5601  2381.74     71.3429  164.876    94.9848     170.579     274.985     
1 1 1 8  4  25 o 15 551.199 5.15268 5397.94     132.695  5372.55     151.313  363.767    145.188     39.0428     325.188     
1 1 1 8  4  26 o 14 569.742 5.54666 5754.94     146.61   5753.28     169.309  446.157    289.537     102.574     289.537     
1 1 1 8  4  27 o 6  152.46  2.51437 427.991     17.7254  396.344     20.4531  47.3735    257.321     58.8124     77.3209     
1 1 1 8  4  28 o 3  579.569 5.73792 5820.24     158.239  6090.77     174.967  442.899    281.49      83.4569     281.49      
1 1 1 8  4  29 o 3  293.746 3.47626 1526.26     45.7762  1532.03     56.0707  205.817    258.637     32.5476     258.637     
1 1 1 8  4  30 o 16 401.043 4.16322 2832.29     77.4872  2868.88     89.4994  305.817    297.782     73.8988     297.782     
1 1 1 8  4  31 o 7  359.571 3.8537  2306.33     64.2491  2276.56     74.2103  295.106    167.738     122.746     167.738     
1 1 1 8  4  32 o 19 402.721 4.16367 2925.06     81.9504  2824.53     85.9744  364.356    100.682     206.675     100.682     
1 1 1 8  4  33 f 0  155.542 2.52152 433.018     18.6975  424.437     20.5487  70.6928    49.1538     0           0           
1 1 1 8  4  34 o 11 388.141 3.84825 2787.92     73.0655  2555        76.3554  278.435    279.555     41.4388     279.555     
1 1 1 8  4  35 o 18 105.354 2.27599 184.957     11.6618  209.151     12.3412  36.1785    99.7144     167.49      99.7144     
1 1 1 8  4  36 o 4  438.693 4.08718 3313.63     87.8583  3510.68     91.8676  269.817    87.7947     55.1696     267.795     
1 1 1 8  4  37 o 5  964.515 9.0061  16633.6     435.196  16415.6     435.423  724.577    5.32991     117.177     5.32992     
1 1 1 8  4  38 o 10 355.549 3.82139 2292.64     69.6855  2189.87     66.5027  293.857    346.653     117.18      346.653     
1 1 1 8  4  39 o 11 569.982 5.46725 5807.53     159.835  5718.34     152.463  392.181    325.502     5.42351     325.501     
1 1 1 8  4  40 o 4  445.828 4.18853 3491.13     97.3283  3557.69     89.5947  276.794    48.518      51.5755     228.518     
1 1 1 8  4  41 o 10 256.854 2.90425 1192.75     38.9281  1146.27     35.825   115.687    328.66      108.823     148.66      
1 1 1 8  4  42 o 11 221.075 2.86679 899.695     32.7097  833.595     30.8218  122.768    256.515     41.4414     76.5152     
1 1 1 8  4  43 o 15 223.378 2.8479  874.368     31.9018  894.711     31.8556  169.373    174.854     56.1047     174.854     
1 1 1 8  4  44 o 17 467.636 4.80789 3885.13     112.668  3875.72     112.679  368.431    159.042     107.283     159.042     
1 1 1 8  4  45 o 19 303.059 3.57091 1662.66     55.684   1595.24     52.7866  179.149    352.242     43.78       172.242     
1 1 1 8  4  46 o 17 160.869 2.7076  452.099     22.8785  465.8       20.6643  78.2819    315.284     55.1709     315.284     
1 1 1 8  4  47 f 0  362.035 4.32587 2318.25     80.729   2333.32     76.1574  163.199    330.078     0           0           
1 1 1 8  4  48 o 7  137.504 2.49537 344.238     17.5692  326.678     16.7959  89.1485    76.8054     24.874      76.8054     
1 1 1 8  4  49 o 16 228.211 3.03139 920.686     34.6567  926.376     34.6807  108.273    93.3557     83.1522     273.356     
1 1 1 8  4  50 o 19 270.075 3.31718 1298.98     47.0996  1288.53     42.598   148.356    121.646     60.3321     301.646     
1 1 1 8  4  51 o 19 536.605 5.71216 5179.81     162.033  5058.53     144.888  352.446    175.105     11.5781     355.105     
1 1 1 8  4  52 o 9  82.6896 2.42263 120.51      10.0098  122.361     10.0247  15.8201    215.67      58.6401     35.6701     
1 1 1 8  4  53 o 10 384.171 4.00758 2609.68     78.9528  2629.95     75.2998  261.428    202.154     15.7255     202.154     
1 1 1 8  4  54 o 2  263.273 3.40334 1235.2      42.4626  1224.45     47.1959  184.562    95.3297     27.3861     95.3297     
1 1 1 8  4  55 o 1  106.96  2.433   218.423     13.0731  188.267     12.9312  60.1438    63.342      28.5998     63.342      
1 1 1 8  4  56 o 9  330.865 3.6329  2018.42     63.3036  1869.1      57.1836  244.998    171.124     59.4199     171.124     
1 1 1 8  4  57 o 4  535.816 5.72864 5122.58     165.463  5097.44     141.278  412.802    0.285659    123.535     0.285659    
1 1 1 8  4  58 o 5  90.2882 2.65137 143.625     12.0898  146.051     11.8474  35.4198    267.572     14.1644     267.572     
1 1 1 8  4  59 o 16 296.512 3.43574 1564.03     52.2231  1557.37     49.8608  240.784    58.5055     101.066     58.5055     
1 1 1 8  4  60 o 17 247.808 3.14426 1105.47     39.9325  1074.55     38.1617  181.921    10.2112     47.6262     10.2112     
1 1 1 8  4  61 o 10 363.562 3.78443 2385        69.0162  2312.68     68.8752  253.123    16.2279     37.0551     16.2279     
1 1 1 8  4  62 o 3  136.583 2.46006 348.233     16.9282  314.385     16.7101  70.8098    42.2399     28.3869     222.24      
1 1 1 8  4  63 o 8  276.513 3.17623 1396.38     44.0969  1320.61     43.9095  202.951    350.237     52.8657     350.237     
1 1 1 8  4  64 o 14 156.235 2.65366 444.696     21.341   422.221     20.2165  98.5008    45.7077     2.15347     45.7079     
1 1 1 8  4  65 o 5  54.8885 3.12378 57.8346     8.65346  50.0988     8.36929  5.10688    304.452     48.4587     124.452     
1 1 1 8  4  66 o 12 78.0081 2.78457 120.778     11.0641  96.7123     10.5819  33.235     4.87355     23.6693     184.874     
1 1 1 8  4  67 o 16 66.7931 2.88138 82.3923     9.73759  76.9051     9.45909  28.4276    63.7181     16.9325     243.718     
1 1 1 8  4  68 o 8  81.129  2.70315 121.548     11.106   113.136     10.8106  46.473     230.228     0.104438    230.227     
1 1 1 8  4  69 o 9  34.9306 4.27481 16.9231     7.20584  28.6401     6.94882  0.289619   316.264     2.11049     136.264     
1 1 1 8  4  70 o 15 152.736 2.73181 417.233     21.6064  413.639     20.1748  114.609    306.764     42.692      306.764     
1 1 1 8  4  71 o 18 51.0606 3.31796 46.3743     8.69976  47.497      8.06692  19.6633    348.174     14.0678     168.174     
1 1 1 8  4  72 o 6  157.082 2.6906  444.65      21.3094  434.734     21.0516  92.0247    16.9339     10.0123     196.934     
1 1 1 8  4  73 o 10 95.5723 2.67012 169.796     12.8814  156.559     12.6381  45.9495    201.956     24.3992     21.956      
1 1 1 8  4  74 o 9  35.8326 4.04155 20.8977     7.10823  26.5889     6.8088   2.04133    248.988     35.2049     68.9884     
1 1 1 8  4  75 o 19 18.2715 4.77106 5.21408     5.94069  4.49171     5.60728  1.07766    307.657     5.2203      307.657     
1 1 1 8  4  76 o 5  63.5403 2.97688 73.1438     9.67491  72.1124     9.17264  33.8887    97.3334     6.38205     277.333     
1 1 1 8  4  77 o 19 39.3469 3.97006 32.6889     7.43769  24.6442     7.60854  19.6249    221.969     0.851399    41.9689     
1 1 1 8  4  78 o 2  47.2987 3.63693 41.9045     8.36035  39.7601     8.58845  19.1524    353.86      15.139      173.86      
1 1 1 8  4  79 o 19 22.3346 4.98963 11.3963     6.26492  6.4668      6.50713  0.60258    266.581     19.7743     266.581     
1 1 1 8  4  80 o 3  35.3596 4.51383 23.7838     7.84742  23.2434     7.56114  10.8191    324.353     16.4184     144.353     
1 1 1 8  4  81 o 10 33.99   5.28929 16.4523     9.88189  27.9931     7.78741  10.5399    28.8346     15.4727     208.835     
1 1 1 8  4  82 o 15 19.6432 5.38576 2.83608     8.49611  6.53758     6.91729  0.657864   108.086     18.1549     108.086     
1 1 1 8  4  83 o 7  59.1117 4.84029 53.4777     14.1073  79.4306     13.2166  34.139     349.485     0.555192    349.484     
1 1 1 8  4  84 o 16 17.1536 5.27659 -4.74728    8.39061  2.79571     8.86769  0.705618   12.8189     12.7687     12.8188     
1 1 1 8  4  85 o 19 27.6674 6.26103 17.0227     9.63791  12.9138     10.1497  10.6643    32.302      2.8358      212.302     
1 1 1 8  4  86 o 1  38.9139 6.81185 31.0472     13.683   31.7269     12.7543  16.9639    218.556     7.28993     38.5563     
1 1 1 8  4  87 o 16 58.9289 6.19211 71.5313     17.541   67.4237     17.8883  33.0137    120.916     0.493505    120.916     
1 1 1 8  4  88 f 0  15.3533 5.2426  -19.1423    11.2646  -12.8182    12.8194  11.4314    121.376     0           0           
1 1 1 8  4  89 o 17 50.0538 9.08936 41.0778     21.5987  75.3686     25.179   12.2328    321.581     31.068      141.581     
1 1 1 8  4  90 o 14 56.679  9.63904 97.5963     24.0461  54.6965     33.5895  26.6567    138.743     9.13982     318.743     
1 1 1 8  4  91 o 19 40.8759 10.7376 15.7427     34.4928  64.5707     30.7818  22.5211    271.086     4.92791     271.086     
1 1 1 8  4  92 x 3  ?       ?       ?           ?        ?           ?        30.1938    190.027     0           0           
1 1 1 8  4  93 x 4  ?       ?       ?           ?        ?           ?        6.31779    242.831     0           0           
1 1 1 8  4  94 x 14 ?       ?       ?           ?        ?           ?        8.56175    357.614     0           0           
1 1 1 8  4  95 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  5  0  o 1  195.915 2.55578 680.831     25.0737  680.831     25.0737  50.2427    5.46142e-07 155.116     180         
1 1 1 8  5  1  o 17 549.842 5.09693 5325.8      137.373  5396.45     143.486  349.253    245.153     71.4282     65.1533     
1 1 1 8  5  2  o 7  357.132 3.64426 2290.34     66.641   2231.39     63.802   129.293    154.903     228.87      334.903     
1 1 1 8  5  3  o 14 277.57  3.2489  1353.01     44.1125  1378.15     46.2645  81.4317    263.346     201.777     83.3455     
1 1 1 8  5  4  o 3  406.47  4.63129 2948.14     97.0919  2910.56     91.5366  249.56     82.6433     54.774      262.643     
1 1 1 8  5  5  o 15 203.511 3.00348 751.451     30.6279  716.809     30.6231  59.6637    263.639     5.03919     263.639     
1 1 1 8  5  6  o 10 383.153 4.43921 2542.8      82.7285  2663.33     87.7576  195.66     308.179     131.555     128.179     
1 1 1 8  5  7  o 19 723.184 7.55329 9324.65     281.724  9240.48     265.595  583.62     235.733     146.526     235.733     
1 1 1 8  5  8  o 10 226.995 3.23466 930.457     37.8734  896.164     35.7184  100.049    109.036     63.1202     289.036     
1 1 1 8  5  9  o 5  510.585 5.5595  4616.12     138.012  4630.07     146.385  377.586    227.686     47.705      227.686     
1 1 1 8  5  10 o 9  466.723 4.94773 3817.46     115.715  3907.03     115.722  261.808    278.931     124.928     98.9306     
1 1 1 8  5  11 o 1  326.445 3.65619 1887.02     59.8122  1890.6      59.8149  109.859    194.911     223.254     14.9107     
1 1 1 8  5  12 o 2  316.578 3.50893 1779.34     54.3244  1773.19     56.9778  189.716    219.456     36.845      39.4557     
1 1 1 8  5  13 o 19 375.762 3.92739 2507.68     72.1706  2497.57     75.6936  261.41     144.584     17.7179     144.584     
1 1 1 8  5  14 o 6  1446.01 12.784  36816.3     926.331  37540.3     926.401  1077.22    210.991     87.2347     210.991     
1 1 1 8  5  15 o 5  385.801 3.76659 2622.31     69.7372  2653.63     75.8172  296.727    248.382     76.1842     248.382     
1 1 1 8  5  16 f 0  296.821 3.24994 1558.04     45.0859  1564.58     51.4055  317.405    321.305     0           0           
1 1 1 8  5  17 o 1  256.269 2.89693 1163.68     35.6217  1163.87     38.7226  168.626    91.0411     25.2695     91.0411     
1 1 1 8  5  18 o 10 605.396 5.42038 6460.58     157.474  6533.22     171.209  413.573    97.3513     22.7689     277.351     
1 1 1 8  5  19 o 15 1115.31 9.93116 21863.5     529.415  22284.5     580.036  989.228    90.386      396.41      90.386      
1 1 1 8  5  20 o 11 198.603 2.61492 674.108     24.842   724.197     27.2156  99.4973    254.931     32.2918     254.931     
1 1 1 8  5  21 o 19 423.983 4.22171 3190.44     85.52    3181.26     93.684   207.341    301.211     172.825     121.211     
1 1 1 8  5  22 o 12 1019.96 9.33376 18326.6     465.632  18585.4     488.413  767.808    9.63042     92.5966     9.63043     
1 1 1 8  5  23 o 15 410.152 4.30967 3005.37     88.5849  2957.59     88.5764  274.755    141.942     12.5582     321.942     
1 1 1 8  5  24 o 13 190.104 2.7793  640.995     25.1331  639.799     27.7557  52.9211    95.1082     129.874     275.108     
1 1 1 8  5  25 o 16 984.786 9.04965 17194.4     457.115  17215.9     435.848  737.158    35.0094     86.3196     35.0093     
1 1 1 8  5  26 o 13 1004.72 9.00142 17956.7     453.225  17862.3     453.232  825.236    143.471     236.803     143.471     
1 1 1 8  5  27 o 10 320.127 3.45266 1779.7      55.3818  1852.93     55.3826  117.672    246.844     199.406     66.844      
1 1 1 8  5  28 o 13 233.78  2.93775 963.854     35.2171  973.129     33.5908  163.281    297.005     85.6715     297.005     
1 1 1 8  5  29 o 6  350.878 3.60514 2192.42     61.9933  2171.36     64.7478  208.4      20.6693     54.4299     200.669     
1 1 1 8  5  30 o 4  1278.73 11.1376 29276.8     697.878  28803.6     728.945  925.673    200.791     58.7665     200.791     
1 1 1 8  5  31 o 10 338.557 3.52675 2061.33     58.4979  2001.63     61.0992  253.917    290.324     68.3778     290.324     
1 1 1 8  5  32 o 16 149.034 2.33173 405.393     16.6559  381.951     18.0903  16.2054    122.767     10.6456     302.767     
1 1 1 8  5  33 o 4  171.352 2.41732 492.373     20.3366  548.988     21.1702  7.47746    333.832     224.101     333.832     
1 1 1 8  5  34 o 18 736.556 6.46136 9626.54     228.32   9618.23     248.255  524.437    2.92138     30.8776     2.92137     
1 1 1 8  5  35 o 2  487.35  4.49781 4240.19     105.131  4181.06     114.31   249.547    22.0377     168.612     202.038     
1 1 1 8  5  36 o 3  434.853 4.12424 3374.18     86.0124  3330.29     93.5312  280.365    30.8798     30.1877     210.88      
1 1 1 8  5  37 o 6  1059.67 9.2569  19757.2     501.967  20153.2     480.721  710.124    119.604     46.8986     299.604     
1 1 1 8  5  38 o 12 263.262 2.94468 1254.15     39.7186  1202.89     37.9846  155.533    29.0006     34.6882     209.001     
1 1 1 8  5  39 o 16 291.433 3.22515 1530.53     48.1248  1480.7      46.0834  254.374    121.042     133.811     121.042     
1 1 1 8  5  40 o 12 495.372 4.74605 4378.38     123.269  4326.64     112.175  382.436    179.841     91.3762     179.841     
1 1 1 8  5  41 o 12 298.453 3.42963 1567.25     54.7848  1591.17     47.4894  193.48     276.728     10.6471     96.7281     
1 1 1 8  5  42 o 19 297.236 3.3465  1591.88     54.2551  1541.1      45.1631  234.018    72.8443     76.06       72.8443     
1 1 1 8  5  43 o 2  265.418 3.26606 1250.77     45.5626  1247.26     41.2193  178.229    308.393     7.58684     308.393     
1 1 1 8  5  44 o 8  493.782 5.03765 4335.15     130.724  4320.17     118.303  330.428    338.388     7.16378     158.388     
1 1 1 8  5  45 o 7  405.668 4.16983 2919.79     90.6011  2919.42     78.5086  322.34     192.536     102.318     192.536     
1 1 1 8  5  46 o 4  823.721 7.89106 11936.4     325.698  12227.7     325.754  625.242    179.459     134.015     179.459     
1 1 1 8  5  47 o 17 501.726 5.21726 4494.6      134.582  4446.2      127.723  302.064    182.554     71.7248     2.55432     
1 1 1 8  5  48 o 16 364.287 3.78542 2373.19     69.1012  2335.42     69.1081  286.449    283.381     88.0762     283.381     
1 1 1 8  5  49 o 5  198.6   2.91242 705.365     29.7588  693.466     28.2048  79.742     282.36      101.091     102.36      
1 1 1 8  5  50 o 12 148.449 2.47868 383.176     18.4178  398.298     18.4576  70.738     6.16629     46.7275     186.166     
1 1 1 8  5  51 o 16 447.819 4.53487 3549.89     99.3191  3572.22     104.181  311.514    28.2174     26.3876     28.2175     
1 1 1 8  5  52 o 18 114.144 2.52073 233.831     14.4085  228.657     14.3932  40.085     60.553      58.2827     240.553     
1 1 1 8  5  53 o 6  266.559 3.19708 1271.43     43.719   1249.56     41.6876  212.35     212.188     78.9305     212.188     
1 1 1 8  5  54 o 15 593.161 5.99017 6245.53     173.29   6278.54     182.732  393.882    303.946     1.5004      303.945     
1 1 1 8  5  55 o 2  391.548 4.01734 2743.12     75.1364  2701.22     82.2979  317.533    321.167     122.036     321.167     
1 1 1 8  5  56 o 12 145.283 2.45367 379.008     18.6884  369.595     17.0205  80.9372    76.8954     17.1219     256.895     
1 1 1 8  5  57 o 17 188.955 2.81733 640.879     27.9173  625.827     25.4069  152.545    234.883     70.8094     234.883     
1 1 1 8  5  58 o 10 219.528 2.91606 871.567     31.3055  838.591     32.8009  155.566    358.132     31.6458     358.132     
1 1 1 8  5  59 o 3  73.3347 2.49742 96.2426     9.26836  94.9775     9.03402  1.4254     345.941     85.623      345.941     
1 1 1 8  5  60 o 3  163.052 2.44509 480.419     20.1028  462.849     19.8546  148.513    85.088      106.709     85.088      
1 1 1 8  5  61 o 2  30.5835 4.32006 12.9961     6.47776  21.8134     6.2674   28.2415    7.06025     78.2691     7.06025     
1 1 1 8  5  62 o 7  175.6   2.73849 543.95      25.4547  550.721     22.6418  142.953    124.48      66.8892     124.48      
1 1 1 8  5  63 o 6  191.18  2.71682 674.952     27.2465  623.423     24.821   93.0404    236.587     56.9601     56.5875     
1 1 1 8  5  64 o 18 92.6445 2.61549 145.765     12.1716  159.681     12.0399  52.1327    188.156     4.25556     8.15638     
1 1 1 8  5  65 o 4  220.766 2.96476 869.531     33.6329  863.013     31.9527  161.638    84.4268     44.4579     84.4268     
1 1 1 8  5  66 o 14 71.2454 2.84544 91.4057     10.1766  89.6381     10.0597  41.4041    101.869     9.00617     101.869     
1 1 1 8  5  67 o 4  19.2102 5.0046  4.80787     6.6631   5.6102      6.05257  26.0398    60.583      62.9146     60.583      
1 1 1 8  5  68 o 4  80.1982 2.76065 117.785     11.2619  111.65      10.863   43.8635    131.876     4.60405     311.876     
1 1 1 8  5  69 o 5  74.7901 2.85767 95.4853     10.719   104.387     10.6     36.4007    322.354     12.6719     142.354     
1 1 1 8  5  70 o 11 225.564 2.97862 905.284     33.7622  908.372     33.5773  145.491    167.829     9.44548     167.829     
1 1 1 8  5  71 o 4  21.4452 4.68386 2.21022     6.13337  12.8946     6.04299  12.2448    239.342     38.9459     239.342     
1 1 1 8  5  72 o 15 113.109 2.67458 232.602     15.2067  223.987     15.0697  77.3624    230.947     16.4517     230.947     
1 1 1 8  5  73 o 19 113.263 2.79428 230.344     16.0176  228.152     15.6543  78.3684    251.572     18.7378     251.572     
1 1 1 8  5  74 o 18 44.5996 3.59306 34.1794     7.85636  38.2095     7.8976   23.891     248.988     0.599185    248.988     
1 1 1 8  5  75 o 15 106.772 2.65212 203.081     14.3135  204.762     14.0213  59.2515    266.01      11.0921     86.0097     
1 1 1 8  5  76 o 2  43.5672 3.87878 30.2379     8.78     39.6328     7.29598  24.6824    65.1965     3.90205     65.1964     
1 1 1 8  5  77 o 14 105.21  2.89944 203.357     15.3522  194.08      15.1616  51.6605    63.9267     23.6596     243.927     
1 1 1 8  5  78 o 13 45.0401 4.3685  32.9173     10.1727  42.4624     8.53284  19.9808    127.071     10.1849     307.071     
1 1 1 8  5  79 o 3  74.7795 3.43632 100.026     13.2927  102.57      12.2846  47.0675    232.293     6.45905     232.293     
1 1 1 8  5  80 o 7  55.2798 3.54277 57.3167     10.6701  54.1264     8.68075  27.0675    143.045     9.64711     323.045     
1 1 1 8  5  81 o 11 61.2318 3.90472 61.6755     11.8691  76.4057     11.6879  27.2402    196.033     17.0378     16.0333     
1 1 1 8  5  82 o 5  24.6652 5.74827 10.9419     8.82917  11.5347     7.68971  7.58636    290.567     1.10879     110.567     
1 1 1 8  5  83 o 7  50.6571 4.5564  57.5764     10.2893  39.8037     11.5704  29.0895    77.1837     0.947898    77.1837     
1 1 1 8  5  84 o 7  39.4202 6.37003 30.9528     11.7259  31.9163     12.8924  15.4818    125.668     12.2224     305.668     
1 1 1 8  5  85 o 5  21.8571 6.35197 9.59575     11.7923  -1.17282    11.1213  1.53629    235.927     16.2327     55.9272     
1 1 1 8  5  86 o 16 77.707  4.45793 108.096     18.6051  119.463     15.3638  54.0996    22.3813     19.6726     22.3813     
1 1 1 8  5  87 o 19 21.0689 6.35954 1.10263     12.5314  3.72944     11.274   1.30325    111.087     2.61626     291.087     
1 1 1 8  5  88 o 15 43.0578 7.10103 38.6929     16.2877  39.3213     13.8205  16.6452    299.233     13.3172     119.233     
1 1 1 8  5  89 o 1  21.9769 6.9065  0.539183    18.0786  -0.719573   12.072   3.16919    102.557     12.5964     282.557     
1 1 1 8  5  90 o 13 54.0206 8.39008 88.154      23.6311  45.2406     21.2995  31.7645    308.199     4.80045     308.199     
1 1 1 8  5  91 o 19 36.0163 9.95491 42.4172     33.7404  23.3105     18.4966  16.0771    338.242     3.32343     158.242     
1 1 1 8  5  92 x 14 ?       ?       ?           ?        ?           ?        23.4038    49.341      0           0           
1 1 1 8  5  93 x 8  ?       ?       ?           ?        ?           ?        10.8587    145.6       0           0           
1 1 1 8  5  94 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  6  0  o 12 489.187 6.44027 4246.93     157.761  4246.93     157.761  273.279    180         159.783     7.04643e-06 
1 1 1 8  6  1  o 13 68.5436 2.79152 87.1899     9.53611  79.9648     9.5459   58.7723    207.9       138.935     207.9       
1 1 1 8  6  2  o 6  96.9296 2.85346 162.534     13.8254  171.11      13.8285  38.7488    81.8826     119.86      81.8826     
1 1 1 8  6  3  o 11 249.752 3.7903  1111.14     50.7319  1100.13     43.9367  149.662    126.797     15.6949     126.797     
1 1 1 8  6  4  o 13 296.09  4.13534 1545        61.3559  1563.18     61.3656  47.1336    273.856     307.35      93.8557     
1 1 1 8  6  5  o 8  961.959 10.995  16411.8     566.508  16488.3     490.651  823.847    89.6579     275.814     89.6579     
1 1 1 8  6  6  o 19 524.376 5.91996 4858.24     145.553  4894.85     165.043  412.587    24.138      96.6899     24.138      
1 1 1 8  6  7  o 14 483.003 4.89568 4125.07     118.496  4147.03     118.506  241.173    280.975     194.251     100.975     
1 1 1 8  6  8  o 12 318.282 3.60966 1802.5      57.5764  1788.48     57.5742  158.859    29.3084     108.401     209.308     
1 1 1 8  6  9  o 3  278.532 3.32779 1383.26     46.4498  1366.63     46.4504  196.81     220.689     59.4945     220.689     
1 1 1 8  6  10 o 7  173.275 2.53081 523.058     21.9713  541.117     21.9768  49.2479    67.3727     65.3626     247.373     
1 1 1 8  6  11 o 9  302.621 3.32226 1584.82     50.3688  1661.63     50.3785  236.716    299.262     103.035     299.262     
1 1 1 8  6  12 o 5  819.679 7.41402 11905.8     304.544  11929.3     304.555  701.981    313.623     242.011     313.623     
1 1 1 8  6  13 o 4  743.663 6.76781 9777.37     252.216  9837.15     252.229  515.547    90.069      23.685      270.069     
1 1 1 8  6  14 o 18 771.684 6.98863 10453.8     270.246  10667.3     270.267  399.056    345.324     299.644     165.324     
1 1 1 8  6  15 o 3  709.335 6.7933  8981.71     241.482  8862.37     241.483  684.6      294.129     374.294     294.129     
1 1 1 8  6  16 o 3  306.337 3.43901 1681.24     54.0525  1644.9      51.5304  174.37     336.238     60.4894     156.238     
1 1 1 8  6  17 o 10 581.131 5.6725  5970.65     165.195  6002.56     165.204  255.765    123.434     309.045     303.434     
1 1 1 8  6  18 o 19 555.364 5.63022 5503.02     160.796  5431.83     152.54   434.741    230.327     94.0428     230.327     
1 1 1 8  6  19 o 18 175.88  2.74996 558.963     24.8825  537.437     23.5955  54.6129    182.448     93.2021     2.44832     
1 1 1 8  6  20 o 5  502.201 5.14297 4508.86     132.828  4431.96     126.003  348.735    170.575     1.82827     350.575     
1 1 1 8  6  21 o 18 526.744 5.26424 4935.17     145.769  4900.98     131.853  363.127    312.342     8.73513     132.342     
1 1 1 8  6  22 o 18 339.247 3.85845 2053.23     63.8399  2026.03     67.2856  201.276    66.8055     57.623      246.805     
1 1 1 8  6  23 o 16 957.698 8.95112 16284.7     429.597  16257.3     429.607  618.552    38.2549     117.888     218.255     
1 1 1 8  6  24 o 11 701.818 6.42628 8872.98     226.002  8593.76     225.993  433.106    188.325     121.157     8.3252      
1 1 1 8  6  25 o 13 545.128 5.15127 5295.07     140.723  5240.01     140.725  365.638    232.451     28.3226     52.4513     
1 1 1 8  6  26 o 6  846.092 7.48998 12859.7     310.499  12533.1     324.302  647.926    293.566     107.364     293.566     
1 1 1 8  6  27 o 8  1174.52 10.3794 24602.1     610.917  24373.5     610.935  845.652    168.915     36.5699     168.914     
1 1 1 8  6  28 o 4  410.783 4.11844 3062.74     84.774   2919.55     84.755   213.396    113.014     135.935     293.014     
1 1 1 8  6  29 o 18 352.847 3.59458 2232.1      62.152   2180.97     64.9032  270.727    227.051     77.4783     227.051     
1 1 1 8  6  30 o 11 507.598 4.62284 4584.67     117.592  4549.67     117.597  358.59     293.723     21.8631     293.723     
1 1 1 8  6  31 o 2  429.969 4.0832  3275.02     87.9846  3278.54     87.9809  260.929    252.618     61.9136     72.6181     
1 1 1 8  6  32 o 12 489.038 4.44483 4225.88     111.08   4252.9      106.727  274.779    330         121.405     150         
1 1 1 8  6  33 o 16 196.597 2.52416 681.928     25.3581  687.926     24.3648  84.0796    87.4163     43.3883     87.4163     
1 1 1 8  6  34 o 10 714.75  6.31694 9134.69     235.581  8989.16     216.699  469.917    122.998     50.1565     302.998     
1 1 1 8  6  35 o 7  475.051 4.34916 3947.48     105.547  4054.63     101.422  290.387    274.133     70.0053     94.1328     
1 1 1 8  6  36 f 0  85.1179 2.17075 131.238     9.40861  125.902     9.0811   116.359    110.313     0           0           
1 1 1 8  6  37 o 12 95.1843 2.33623 154.766     11.1204  166.855     11.1219  5.55173    163.177     24.0304     343.177     
1 1 1 8  6  38 o 2  277.646 2.97256 1378.32     40.4981  1354.44     42.188   206.803    31.199      49.9448     31.1991     
1 1 1 8  6  39 o 3  439.533 4.0284  3414.74     86.9329  3436.36     90.5071  298.517    247.995     1.37995     67.9946     
1 1 1 8  6  40 o 17 251.17  2.75489 1104.68     33.9606  1131.81     35.3908  160.893    347.092     8.7348      167.092     
1 1 1 8  6  41 o 7  302.57  3.21853 1649.49     46.6967  1596.8      50.7489  199.329    57.1037     5.7261      237.104     
1 1 1 8  6  42 o 1  567.357 5.38158 5712.58     149.306  5715.01     156.632  421.686    33.1184     70.3565     33.1184     
1 1 1 8  6  43 o 4  224.521 2.85141 888.577     30.7674  898.773     33.3606  163.941    138.95      40.6465     138.95      
1 1 1 8  6  44 o 17 205.26  2.81898 751.928     28.2483  741.956     29.7168  73.2358    114.176     121.703     294.176     
1 1 1 8  6  45 o 8  34.6924 3.57932 23.7427     6.04481  19.9331     5.99922  75.9163    103.006     173.098     103.006     
1 1 1 8  6  46 o 15 92.4331 2.3912  147.061     10.9395  156.321     11.1744  4.85778    307.678     93.0706     127.678     
1 1 1 8  6  47 o 13 177.605 2.67137 539.608     24.2297  579.223     23.2566  108.997    240.135     8.20665     60.1351     
1 1 1 8  6  48 o 3  232.222 2.92491 952.191     33.1458  960.328     34.916   214.803    79.5368     132.778     79.5368     
1 1 1 8  6  49 o 18 394.599 4.03351 2773.49     79.7128  2753.32     79.8113  289.027    350.697     50.4967     350.697     
1 1 1 8  6  50 o 8  84.3484 2.52745 124.354     10.3817  128.401     10.9367  29.9235    283.145     24.9115     103.145     
1 1 1 8  6  51 o 6  394.364 4.09492 2760.4      78.9526  2761.19     82.8581  302.968    239.122     82.1272     239.122     
1 1 1 8  6  52 o 11 134.786 2.55543 326.466     17.1986  318.297     17.2891  72.6822    39.8632     20.1359     219.863     
1 1 1 8  6  53 o 3  260.275 3.27872 1190.77     41.5983  1213.06     43.9205  209.504    221.852     81.7341     221.852     
1 1 1 8  6  54 o 18 220.68  2.98994 856.997     31.354   870.774     34.718   162.924    176.207     42.8716     176.207     
1 1 1 8  6  55 f 0  165.074 2.88263 484.963     22.3199  482.082     25.2498  102.375    195.475     0           0           
1 1 1 8  6  56 o 5  419.193 4.53079 3104.81     97.6269  3140.35     92.6372  322.321    249.085     94.9642     249.085     
1 1 1 8  6  57 o 8  311.176 3.69418 1723.33     55.9773  1715.11     59.1863  221.658    38.5838     38.8841     38.5838     
1 1 1 8  6  58 o 11 204.459 2.96854 744.655     30.289   738.86      30.5421  145.145    227.769     30.8387     227.769     
1 1 1 8  6  59 o 11 277.147 3.05288 1379.05     41.5214  1347.57     43.2397  161.219    24.7427     36.2435     204.743     
1 1 1 8  6  60 o 9  287.713 3.14256 1466.5      44.3327  1472.91     46.2727  225.549    267.006     80.594      267.006     
1 1 1 8  6  61 o 19 128.316 2.54137 293.681     15.5723  291.105     17.0394  76.3224    86.3208     6.15762     266.321     
1 1 1 8  6  62 o 3  91.6737 2.61799 148.637     11.3921  150.201     12.5887  56.0801    344.85      7.01641     344.85      
1 1 1 8  6  63 o 2  114.681 2.49566 222.962     13.6087  244.663     15.0505  76.6732    53.434      14.9807     53.434      
1 1 1 8  6  64 o 2  137.531 2.62088 343.287     18.1252  329.115     17.9663  76.2557    262.513     18.8715     82.5127     
1 1 1 8  6  65 o 14 71.486  2.53539 90.9018     9.09072  91.0937     9.01691  42.4676    167.828     14.7726     167.828     
1 1 1 8  6  66 o 7  67.9162 2.26347 83.5284     7.70222  80.6735     7.66099  32.6461    2.16602     9.60648     182.166     
1 1 1 8  6  67 o 14 74.0257 3.16295 90.9651     11.9959  105.173     11.241   34.9435    102.764     15.1505     282.764     
1 1 1 8  6  68 o 16 109.591 2.58363 209.925     14.2079  217.836     14.126   80.3806    166.453     30.3901     166.453     
1 1 1 8  6  69 o 12 120.732 2.5598  262.758     15.3026  256.433     15.6303  74.0114    217.064     0.891631    217.063     
1 1 1 8  6  70 o 12 33.1084 4.33645 19.2958     6.9759   21.2986     6.8761   2.45349    269.754     18.318      89.7543     
1 1 1 8  6  71 o 9  20.6467 4.77086 12.0513     6.37664  1.19325     6.08739  3.09804    329.106     13.3966     329.106     
1 1 1 8  6  72 f 0  51.4557 3.69888 45.4095     9.0185   50.5755     9.79829  38.5049    348.754     0           0           
1 1 1 8  6  73 o 17 92.8178 2.96475 145.223     13.7625  163.658     13.7048  51.4272    21.9404     9.91877     201.94      
1 1 1 8  6  74 o 11 136.629 3.05121 345.722     20.1048  323.554     21.5333  96.6056    91.4858     25.9994     91.4858     
1 1 1 8  6  75 o 19 72.7542 3.35801 91.4346     13.0195  99.6301     11.1452  44.4554    165.963     2.82524     165.963     
1 1 1 8  6  76 o 17 99.481  2.82902 181.858     14.5705  173.209     13.5798  55.6485    288.937     8.88165     108.938     
1 1 1 8  6  77 o 10 51.2245 3.18082 45.215      7.7901   49.8581     8.37862  21.8486    134.277     15.241      314.277     
1 1 1 8  6  78 o 2  19.6154 5.23029 1.54092     7.18467  8.31771     7.2889   7.11926    328.714     31.4286     328.714     
1 1 1 8  6  79 o 9  67.0849 3.33828 88.9656     11.2604  74.4607     10.9924  35.9689    330.438     6.79351     150.438     
1 1 1 8  6  80 o 7  32.8708 5.1289  25.12       8.43044  16.6551     8.09446  14.9497    335.913     3.34178     155.913     
1 1 1 8  6  81 o 3  34.5551 5.2517  23.1085     8.80184  23.0554     8.84516  19.8989    127.591     6.62356     127.591     
1 1 1 8  6  82 o 3  40.5672 4.67336 34.2137     9.43789  28.4372     8.89715  25.727     353.536     8.41803     353.536     
1 1 1 8  6  83 f 0  73.2183 3.48424 102.991     13.4997  93.6475     11.9234  43.133     13.8179     0           0           
1 1 1 8  6  84 o 9  43.6149 5.27693 35.0114     10.5504  39.1174     11.6964  26.0006    313.81      4.76011     313.81      
1 1 1 8  6  85 o 15 42.3324 5.97121 29.843      12.467   42.2895     11.9169  19.6951    249.769     6.76383     69.7694     
1 1 1 8  6  86 o 5  24.6136 6.4611  14.9625     10.8119  4.69086     11.1931  4.9755     230.082     10.7509     50.0824     
1 1 1 8  6  87 o 2  55.1128 5.83845 60.0109     16.51    60.5357     14.6512  38.6624    112.09      18.1307     112.09      
1 1 1 8  6  88 o 10 34.1805 7.98314 30.9292     17.2712  19.5031     14.6904  8.33336    112.764     19.3301     292.764     
1 1 1 8  6  89 o 2  32.7615 8.72998 18.7303     24.9813  23.4637     15.6479  13.2677    349.62      6.01494     169.62      
1 1 1 8  6  90 o 10 33.5634 9.30068 22.7631     23.6787  25.6629     21.9896  15.5771    212.665     0.70057     32.6651     
1 1 1 8  6  91 o 15 53.7787 14.7618 256.404     86.9054  45.3329     25.8828  27.7259    228.614     0.847203    48.6138     
1 1 1 8  6  92 o 3  38.0434 18.4855 0           0        56.1778     78.7377  7.72476    249.724     1.39331     249.723     
1 1 1 8  6  93 x 2  ?       ?       ?           ?        ?           ?        14.3306    146.459     0           0           
1 1 1 8  6  94 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  7  0  o 1  151.9   2.58042 409.559     19.6174  409.559     19.6174  26.1141    180         44.787      360         
1 1 1 8  7  1  o 9  484.604 5.02198 4159.03     118.715  4167.76     125.13   353.469    257.318     32.7971     257.318     
1 1 1 8  7  2  o 9  223.057 3.06929 873.262     34.3031  890.267     34.3135  123.378    280.833     24.6148     280.833     
1 1 1 8  7  3  f 0  470.313 5.08095 3905.25     126.199  3937.72     112.882  270.353    268.51      0           0           
1 1 1 8  7  4  o 15 476.673 4.96495 4025.09     115.444  4031.1      121.684  166.294    51.7807     339.744     231.781     
1 1 1 8  7  5  o 18 620.918 6.02501 6840.74     187.479  6832.28     187.479  530.405    211.459     187.894     211.459     
1 1 1 8  7  6  o 9  547.793 5.43722 5311.09     149.262  5329.27     149.264  415.492    211.51      62.9726     211.51      
1 1 1 8  7  7  o 1  316.449 3.57208 1761.64     56.645   1787.92     56.6489  255.478    57.669      114.111     57.669      
1 1 1 8  7  8  o 10 310.185 3.37451 1721.33     52.4551  1689        52.4525  171.395    232.677     71.8633     52.6769     
1 1 1 8  7  9  o 14 232.501 3.09506 950.451     35.1029  965.49      37.0099  126.804    62.777      27.255      242.777     
1 1 1 8  7  10 o 14 349.598 3.94941 2153.92     67.3521  2178.32     71.0047  266.177    119.935     67.1649     119.935     
1 1 1 8  7  11 o 1  458     5.07931 3736.65     113.083  3700.01     119.944  284.132    35.9276     70.7311     215.928     
1 1 1 8  7  12 o 12 865.138 8.59274 13035.3     372.455  13522.9     372.54   618.749    235.981     3.85847     235.98      
1 1 1 8  7  13 o 4  671.681 7.2871  7908.88     259.946  8092.65     229.294  389.466    277.885     174.939     97.8848     
1 1 1 8  7  14 o 6  1039.13 10.1715 19083.9     529.669  19241.7     529.688  773.949    129.214     64.0052     129.214     
1 1 1 8  7  15 o 2  341.616 3.97907 2056.87     64.2386  2079.6      71.8313  282.839    194.85      116.395     194.85      
1 1 1 8  7  16 f 0  443.143 4.94657 3495.02     106.555  3466.32     113.025  183.814    203.977     0           0           
1 1 1 8  7  17 o 4  670.544 6.60737 7889.37     216.15   8054.43     227.864  399.841    225.581     149.993     45.5809     
1 1 1 8  7  18 o 14 445.965 4.68937 3451.38     102.036  3599.39     107.579  297.876    143.467     23.4792     323.467     
1 1 1 8  7  19 o 11 330.526 3.79392 1983.36     64.5075  1889.36     61.1867  201.016    33.7695     45.8442     213.769     
1 1 1 8  7  20 o 4  1335.73 12.0071 31342.8     784.5    32022.5     822.865  982.06     17.7014     61.6947     17.7014     
1 1 1 8  7  21 o 9  376.579 4.05565 2456.68     72.6642  2570.5      80.3628  284.339    301.214     56.7536     301.214     
1 1 1 8  7  22 o 13 593.621 5.68488 6214.47     165.055  6279.29     173.123  370.397    106.359     93.5548     286.359     
1 1 1 8  7  23 o 1  1416.15 12.498  35356.3     845.934  35896.2     926.737  1008.82    247.28      6.56773     247.28      
1 1 1 8  7  24 o 5  227.379 2.85962 915.14      31.0632  917.194     34.042   93.6847    109.766     106.427     289.766     
1 1 1 8  7  25 o 7  502.335 4.83324 4497.74     115.976  4447.9      127.052  345.039    36.8444     6.6291      216.844     
1 1 1 8  7  26 o 16 886.575 7.91813 13804.2     335.542  14081.2     367.62   696.582    299.518     146.812     299.518     
1 1 1 8  7  27 o 17 1201.27 10.4081 25642.2     612.774  25598.9     640.052  878.381    29.9691     63.2736     29.9691     
1 1 1 8  7  28 o 4  283.113 3.07294 1414.94     41.7457  1425.91     45.3892  198.138    198.586     38.691      198.586     
1 1 1 8  7  29 o 15 960.108 8.05583 16333.1     379.775  16377       395.302  717.28     20.9969     89.7124     20.9969     
1 1 1 8  7  30 o 15 553.966 4.91481 5426.77     133.689  5453.73     139.155  380.739    107.598     2.44722     287.598     
1 1 1 8  7  31 o 18 168.88  2.45172 503.241     20.7416  507.56      20.7572  17.8034    187.812     167.098     7.81207     
1 1 1 8  7  32 f 0  303.33  3.17146 1634.81     47.2295  1626.52     49.1655  151.52     62.1519     0           0           
1 1 1 8  7  33 o 16 125.209 2.25607 277.92      13.85    277.889     14.4434  25.5224    97.0489     194.305     97.0489     
1 1 1 8  7  34 o 5  150.195 2.30401 381.444     16.6593  418.506     18.0334  64.3718    167.42      22.5978     347.42      
1 1 1 8  7  35 o 17 480.176 4.37473 4026.37     103.154  4150.16     107.393  368.93     94.5763     80.3603     94.5763     
1 1 1 8  7  36 o 3  265.998 2.93687 1252.79     36.7251  1255.35     41.4363  162.414    278.168     26.9436     98.1675     
1 1 1 8  7  37 f 0  346.398 3.26142 2139.59     54.3754  2114.45     58.7458  242.306    146.047     0           0           
1 1 1 8  7  38 o 4  210.731 2.57126 776.317     26.084   797.879     28.2077  157.974    324.684     53.6914     324.684     
1 1 1 8  7  39 o 16 507.676 4.5261  4516.24     110.667  4627.1      119.56   360.333    48.1768     25.4272     48.1767     
1 1 1 8  7  40 o 17 465.729 4.1794  3869.65     97.5332  3824.45     97.5555  399.873    176.295     166.981     176.295     
1 1 1 8  7  41 f 0  515.026 4.99888 4729.79     122.975  4684.74     134.739  333.022    232.207     0           0           
1 1 1 8  7  42 o 19 312.277 3.1504  1711.69     48.3032  1746.42     50.2975  245.681    104.498     76.4846     104.498     
1 1 1 8  7  43 o 2  537.74  4.84936 5165.99     128.287  5099.06     133      525.756    132.519     325.482     132.519     
1 1 1 8  7  44 o 15 522.604 5.02103 4966.87     138.079  4732.15     124.849  362.865    156.896     16.6183     156.896     
1 1 1 8  7  45 o 7  389.364 4.08836 2709.41     77.8326  2670.47     81.6403  223.544    19.3994     78.171      199.399     
1 1 1 8  7  46 o 12 366.544 3.8215  2390.11     70.1931  2377.05     70.2011  238.615    249.927     15.4511     69.9275     
1 1 1 8  7  47 o 9  475.824 5.04444 4069.15     117.033  3973.44     123.369  339.115    149.688     36.2238     149.688     
1 1 1 8  7  48 o 18 415.57  4.24973 3095.59     90.6078  3035.5      86.3862  279.895    292.849     1.16688     292.849     
1 1 1 8  7  49 o 9  626.863 6.03809 6976        185.108  7002.91     194.169  411.96     130.129     20.5909     310.129     
1 1 1 8  7  50 o 12 117.787 2.38996 245.532     14.0878  246.819     14.0978  26.3476    175.827     94.6205     355.827     
1 1 1 8  7  51 o 1  216.656 2.78013 831.352     30.7557  833.541     29.6024  103.113    29.0896     77.5972     209.09      
1 1 1 8  7  52 o 13 139.054 2.53168 336.759     17.4929  349.494     17.7616  42.3976    179.589     91.5204     359.589     
1 1 1 8  7  53 f 0  43.4582 3.289   37.2146     7.09383  30.728      6.96311  45.1876    170.795     0           0           
1 1 1 8  7  54 f 0  98.9059 2.47861 175.245     12.2236  172.135     12.3067  82.6554    283.858     0           0           
1 1 1 8  7  55 o 5  455.559 4.68089 3596.93     106.759  3781.21     106.924  337.281    144.968     73.7687     144.968     
1 1 1 8  7  56 o 7  87.6566 2.69479 125.867     11.956   147.66      11.5698  38.8629    41.2091     11.5905     221.209     
1 1 1 8  7  57 o 7  100.373 2.52673 183.694     12.7078  174.203     12.6655  20.1142    195.305     81.0513     15.3049     
1 1 1 8  7  58 o 12 439.033 4.6915  3477.45     105.979  3380.24     100.451  308.79     93.1763     43.2283     93.1763     
1 1 1 8  7  59 o 10 245.445 3.17497 1066.71     39.0514  1072.45     39.0544  174.132    316.973     32.1274     316.973     
1 1 1 8  7  60 o 11 405.417 4.03511 2976.58     85.7405  2869.74     78.1646  318.395    111.168     109.878     111.168     
1 1 1 8  7  61 o 18 118.482 2.39455 245.511     14.2491  253.104     14.1534  34.3916    274.796     79.9306     94.7956     
1 1 1 8  7  62 o 15 55.2467 2.96422 58.108      8.14516  51.0641     8.11944  10.9872    96.438      34.0951     276.438     
1 1 1 8  7  63 o 2  98.3826 2.41615 172.327     11.9234  171.737     11.8654  48.5363    338.916     21.932      158.916     
1 1 1 8  7  64 o 9  91.1198 2.44419 143.545     11.1157  151.815     11.1606  21.5513    15.3296     68.4656     195.33      
1 1 1 8  7  65 o 2  87.2592 2.66107 134.992     11.3117  136.147     11.9016  47.699     309.706     7.6808      129.706     
1 1 1 8  7  66 o 5  82.4601 2.57983 123.636     10.9169  118.602     10.353   36.0359    217.975     26.0942     37.9745     
1 1 1 8  7  67 o 16 95.5677 2.70607 158.031     12.5861  167.533     13.2845  75.025     93.6226     42.3361     93.6226     
1 1 1 8  7  68 o 6  43.4197 3.8264  34.4567     8.53847  33.9757     7.73413  9.9729     60.8997     9.67984     240.9       
1 1 1 8  7  69 o 13 33.9954 4.5764  15.6566     6.5748   28.0606     8.52394  2.67834    302.642     12.1138     122.642     
1 1 1 8  7  70 o 2  25.1139 3.85198 -2.26381    4.98395  26.262      7.0238   11.8217    85.7806     46.0016     85.7806     
1 1 1 8  7  71 o 1  44.2652 3.91537 38.6722     8.13994  32.8356     8.72199  20.4032    60.8106     7.27199     240.811     
1 1 1 8  7  72 o 18 31.2548 4.82355 21.3695     7.01255  15.388      7.70476  1.48836    132.318     29.4286     312.318     
1 1 1 8  7  73 o 16 95.5713 2.73141 157.717     12.8013  169.192     13.3097  66.4338    286.844     17.1652     286.844     
1 1 1 8  7  74 o 1  74.6606 2.79529 96.8859     10.1674  103.1       10.6776  31.8265    328.389     26.2936     148.389     
1 1 1 8  7  75 o 4  23.1696 5.09356 5.93171     5.98598  13.8105     7.41268  2.26493    330.516     24.8501     330.516     
1 1 1 8  7  76 o 18 90.409  3.08498 143.394     13.3276  150.823     14.5413  46.724     258.184     15.625      78.1839     
1 1 1 8  7  77 o 12 54.5485 3.87973 63.4629     10.2535  45.9988     10.3871  31.6538    283.192     0.992968    283.192     
1 1 1 8  7  78 o 6  68.4067 3.62631 93.9161     12.563   76.6548     12.0615  34.2591    86.364      12.2958     266.364     
1 1 1 8  7  79 o 8  32.6577 5.31804 22.8117     8.6257   18.3231     8.45416  0.143405   290.387     36.7013     290.388     
1 1 1 8  7  80 o 5  32.9927 5.77053 24.0146     10.0144  18.668      9.00221  12.2452    12.3564     10.6609     192.356     
1 1 1 8  7  81 o 12 16.8493 4.99808 -5.45624    7.6383   5.12659     7.48174  0.17604    47.9818     1.74486     227.982     
1 1 1 8  7  82 o 19 134.862 3.50715 329.764     24.669   334.652     22.5862  81.4439    211.227     2.13453     211.227     
1 1 1 8  7  83 o 17 37.8643 5.81793 28.952      10.7478  28.118      10.6999  24.0228    126.827     14.442      126.827     
1 1 1 8  7  84 f 0  29.6966 6.90282 19.2832     11.7418  16.0176     12.1099  22.9324    96.5282     0           0           
1 1 1 8  7  85 o 15 28.4227 6.97314 16.053      12.1537  15.6098     12.1055  8.04785    175.942     11.212      355.942     
1 1 1 8  7  86 o 9  85.254  4.55893 137.934     18.8253  137.223     19.8204  61.8722    330.319     26.3115     330.319     
1 1 1 8  7  87 f 0  33.9514 6.6072  14.2702     12.5213  33.2737     12.0615  8.84521    97.04       0           0           
1 1 1 8  7  88 o 19 19.2783 6.02735 4.88791     12.0857  -11.0901    11.8083  1.56404    226.032     1.82205     46.0316     
1 1 1 8  7  89 o 2  24.0141 6.80785 -1.50806    13.1194  14.9144     13.158   6.17731    74.3209     8.70377     254.321     
1 1 1 8  7  90 o 5  26.03   7.38085 14.1678     13.5665  6.5264      16.4166  6.09065    81.498      12.4778     261.498     
1 1 1 8  7  91 o 16 25.5612 8.32976 7.59922     31.4412  -1.70834    16.1266  6.7228     324.817     3.81688     144.817     
1 1 1 8  7  92 o 8  33.9707 10.1023 -22.4272    34.0437  60.6031     33.4136  13.4704    290.815     2.7526      290.815     
1 1 1 8  7  93 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 8  8  0  o 8  323.708 4.72917 1859.19     76.6442  1859.19     76.6442  234.271    180         98.4918     180         
1 1 1 8  8  1  o 8  349.533 3.50359 2166.22     61.343   2166.22     61.343   356.383    210         282.627     210         
1 1 1 8  8  2  o 10 210.678 2.64511 787.211     27.9071  787.211     27.9071  130.816    60          13.7273     240         
1 1 1 8  8  3  o 12 315.77  3.59709 1768.26     56.8891  1768.26     56.8891  313.567    90          189.289     90          
1 1 1 8  8  4  o 16 948.736 9.35227 15970       444.46   15970       444.46   680.336    300         10.6859     120         
1 1 1 8  8  5  o 18 30.653  3.19495 17.6996     4.59556  17.6996     4.59556  147.524    150         305.61      150         
1 1 1 8  8  6  o 9  465.001 5.2783  3835        122.93   3835        122.93   394.707    360         117.648     360         
1 1 1 8  8  7  o 3  134.519 2.80859 321.475     18.8962  321.475     18.8962  16.9481    210         79.9443     30          
1 1 1 8  8  8  o 11 497.532 5.93779 4390.93     147.954  4390.93     147.954  403.809    60          89.4092     60          
1 1 1 8  8  9  o 1  522.081 5.79367 4834.26     151.499  4834.26     151.499  436.258    90          119.224     90          
1 1 1 8  8  10 f 0  353.35  4.94794 2215.24     87.5399  2215.24     87.5399  201.24     300         0           0           
1 1 1 8  8  11 o 15 170.35  2.96136 515.128     25.2464  515.128     25.2464  107.602    330         460.034     330         
1 1 1 8  8  12 o 2  958.109 9.46119 16285.3     454.078  16285.3     454.078  648.283    1.36629e-06 83.4509     180         
1 1 1 8  8  13 o 3  136.519 2.52749 330.913     17.2651  330.913     17.2651  9.91668    30.0002     9.92842     210         
1 1 1 8  8  14 o 4  699.097 6.7081  8667.14     234.918  8667.14     234.918  575.182    240         144.863     240         
1 1 1 8  8  15 o 7  902.247 8.48712 14438.8     383.595  14438.8     383.595  605.957    90          84.7354     270         
1 1 1 8  8  16 o 12 74.5192 2.40503 99.0079     8.93877  99.0079     8.93877  40.4688    120         115.098     120         
1 1 1 8  8  17 o 4  269.947 3.2599  1292.37     44.0714  1292.37     44.0714  34.5695    330         318.117     150         
1 1 1 8  8  18 o 14 773.74  7.01571 10616.6     271.936  10616.6     271.936  539.976    4.53286e-06 28.9766     180         
1 1 1 8  8  19 o 15 695.667 6.71674 8582.56     234.066  8582.56     234.066  408.36     210         179.296     30          
1 1 1 8  8  20 o 1  74.0264 2.32035 97.6686     8.56936  97.6686     8.56936  83.4515    240         232.038     240         
1 1 1 8  8  21 o 7  596.37  5.56775 6306.48     166.336  6306.48     166.336  470.68     90          89.3973     90          
1 1 1 8  8  22 o 14 454.535 4.25415 3663.07     96.8654  3663.07     96.8654  343.193    300         37.8186     300         
1 1 1 8  8  23 o 17 300.836 3.32931 1604.86     50.1656  1604.86     50.1656  288.344    330         153.793     330         
1 1 1 8  8  24 o 6  538.099 5.08058 5134.21     136.95   5134.21     136.95   419.215    180         72.5741     180         
1 1 1 8  8  25 o 13 663.034 5.8198  7795.17     193.31   7795.17     193.31   447.626    210         47.1411     30          
1 1 1 8  8  26 o 19 547.138 5.22037 5308.39     143.08   5308.39     143.08   434.804    240         93.0386     240         
1 1 1 8  8  27 o 11 747.593 6.22865 9910.66     233.283  9910.66     233.283  393.538    270         272.453     90          
1 1 1 8  8  28 o 8  224.191 2.6213  891.332     29.4325  891.332     29.4325  137.637    120         31.3679     300         
1 1 1 8  8  29 o 1  448.731 4.06654 3570.15     91.4137  3570.15     91.4137  337.373    150         40.7466     150         
1 1 1 8  8  30 f 0  542.041 4.71347 5209.55     127.993  5209.55     127.993  348.659    1.17254e-06 0           0           
1 1 1 8  8  31 o 8  31.6681 3.37585 18.9414     4.99805  18.9414     4.99805  63.2635    210         133.316     210         
1 1 1 8  8  32 o 15 804.916 6.98595 11493.1     281.701  11493.1     281.701  737.361    240         343.215     240         
1 1 1 8  8  33 o 12 191.846 2.45069 652.815     23.544   652.815     23.544   153.332    90          63.3948     90          
1 1 1 8  8  34 o 15 84.1789 2.1841  126.069     9.18558  126.069     9.18558  0.292798   300         5.43783     300         
1 1 1 8  8  35 o 11 445.74  4.06381 3523.23     90.7429  3523.23     90.7429  392.738    330         162.349     330         
1 1 1 8  8  36 o 13 178.878 2.39191 567.612     21.4246  567.612     21.4246  129.977    360         15.9071     360         
1 1 1 8  8  37 o 4  632.754 5.41127 7102.15     171.535  7102.15     171.535  599.151    30          317.25      30          
1 1 1 8  8  38 o 15 317.294 2.98983 1785.15     47.5219  1785.15     47.5219  238.173    240         35.4583     240         
1 1 1 8  8  39 o 1  266.387 2.77114 1258.41     36.976   1258.41     36.976   243.881    270         118.481     270         
1 1 1 8  8  40 o 9  319.65  3.15559 1812        50.5271  1812        50.5271  250.913    120         59.5768     120         
1 1 1 8  8  41 o 6  462.746 4.1628  3798.21     96.5008  3798.21     96.5008  396.966    150         155.134     150         
1 1 1 8  8  42 o 8  255.051 2.5526  1153.55     32.6118  1153.55     32.6118  159.216    1.68701e-11 32.8469     180         
1 1 1 8  8  43 o 11 123.403 2.01996 270.292     12.4768  270.292     12.4768  74.8563    30          0.728017    210         
1 1 1 8  8  44 o 10 238.674 2.81428 1010.49     33.6403  1010.49     33.6403  204.002    240         80.8687     240         
1 1 1 8  8  45 o 17 232.847 2.87781 961.867     33.5579  961.867     33.5579  199.832    90          81.2825     90          
1 1 1 8  8  46 o 12 11.8875 4.46298 3.60078     3.58392  3.60078     3.58392  10.3127    300         21.1157     300         
1 1 1 8  8  47 o 11 430.355 5.06964 3288.5      109.268  3288.5      109.268  353.956    330         122.434     330         
1 1 1 8  8  48 o 14 290.892 3.303   1501.3      48.1225  1501.3      48.1225  193.431    180         7.84497     8.66479e-06 
1 1 1 8  8  49 o 8  27.6784 4.71307 15.7269     5.66829  15.7269     5.66829  25.7377    210         60.3633     210         
1 1 1 8  8  50 o 17 18.5548 5.61993 8.69185     5.3389   8.69185     5.3389   17.3924    60          37.0693     60          
1 1 1 8  8  51 o 12 127.975 2.45765 290.928     15.7354  290.928     15.7354  34.3508    270         103.483     90          
1 1 1 8  8  52 o 17 161.769 2.71758 464.674     22.0031  464.674     22.0031  101.104    300         14.8547     120         
1 1 1 8  8  53 o 18 152.879 2.58565 415.003     19.7841  415.003     19.7841  93.8833    330         16.7393     150         
1 1 1 8  8  54 o 13 154.781 2.3817  425.247     18.4545  425.247     18.4545  106.463    360         6.52052     360         
1 1 1 8  8  55 o 6  78.1344 2.53793 108.903     9.88971  108.903     9.88971  18.7878    30          60.4978     210         
1 1 1 8  8  56 o 6  65.3196 3.10058 76.671      10.043   76.671      10.043   14.7837    240         37.342      60          
1 1 1 8  8  57 o 18 67.6637 2.7888  81.9988     9.38241  81.9988     9.38241  23.52      270         20.4707     90.0001     
1 1 1 8  8  58 o 19 201.524 2.889   721.052     29.1496  721.052     29.1496  150.31     300         35.0685     300         
1 1 1 8  8  59 o 5  38.316  4.49857 28.1172     7.92291  28.1172     7.92291  12.1897    150         56.5665     150         
1 1 1 8  8  60 o 8  560.315 5.6157  5587.84     157.616  5587.84     157.616  470.975    2.14998e-06 208.417     2.14998e-06 
1 1 1 8  8  61 o 2  355.739 3.97069 2248.98     70.7481  2248.98     70.7481  265.418    30          66.6768     30          
1 1 1 8  8  62 o 3  55.9127 3.12783 56.5086     8.63438  56.5086     8.63438  10.6715    60          93.2376     60          
1 1 1 8  8  63 o 13 78.6539 2.79746 110.597     10.9627  110.597     10.9627  48.1278    90          4.26978     270         
1 1 1 8  8  64 o 17 147.954 2.71922 389.237     20.1311  389.237     20.1311  141.761    120         92.4934     120         
1 1 1 8  8  65 o 9  37.1852 4.52796 26.6723     7.68791  26.6723     7.68791  3.15752    150         13.0163     330         
1 1 1 8  8  66 o 1  9.91088 4.53577 -0.194355   5.30477  -0.194355   5.30477  13.7357    8.55832e-06 28.8564     8.55832e-06 
1 1 1 8  8  67 o 9  133.804 2.36372 318.352     15.8275  318.352     15.8275  66.2964    210         38.3246     30          
1 1 1 8  8  68 o 10 50.2225 3.13952 45.8715     7.75324  45.8715     7.75324  16.2825    240         5.50843     240         
1 1 1 8  8  69 o 13 58.6305 3.0437  62.0903     8.82985  62.0903     8.82985  26.7432    90          20.4929     270         
1 1 1 8  8  70 o 16 33.9185 4.38583 22.4461     6.71838  22.4461     6.71838  7.76296    300         1.20505     300         
1 1 1 8  8  71 f 0  11.0493 4.82996 1.6203      5.27693  1.6203      5.27693  28.1884    330         0           0           
1 1 1 8  8  72 o 12 30.8081 4.82236 19.2443     6.51002  19.2443     6.51002  10.4835    1.38934e-05 11.2998     180         
1 1 1 8  8  73 o 3  79.9461 3.08396 114.873     12.2711  114.873     12.2711  23.1614    210         53.4545     30          
1 1 1 8  8  74 o 13 20.8509 6.67007 11.4246     7.50213  11.4246     7.50213  0.201652   240         7.2233      60          
1 1 1 8  8  75 o 14 17.7375 6.52861 8.38088     7.55259  8.38088     7.55259  13.2255    270         44.4147     270         
1 1 1 8  8  76 o 4  189.18  3.47016 640.935     32.8492  640.935     32.8492  136.119    120         39.0288     120         
1 1 1 8  8  77 o 8  126.642 3.28964 287.672     20.8138  287.672     20.8138  112.415    330         69.3724     330         
1 1 1 8  8  78 o 10 87.2818 3.57413 137.74      15.5124  137.74      15.5124  57.6334    360         8.58356     360         
1 1 1 8  8  79 o 19 53.3032 4.20125 52.9581     10.8658  52.9581     10.8658  33.8517    210         2.83865     210         
1 1 1 8  8  80 o 1  28.2066 6.95828 19.0084     8.89291  19.0084     8.89291  15.0395    60          2.53002     60          
1 1 1 8  8  81 o 9  45.6254 4.81912 40.1367     10.2952  40.1367     10.2952  29.1667    90          3.3256      90          
1 1 1 8  8  82 o 7  10.213  4.89311 -3.38781    7.4486   -3.38781    7.4486   5.19251    300         14.254      300         
1 1 1 8  8  83 o 17 21.8396 7.19568 13.0992     8.75852  13.0992     8.75852  6.04334    330         4.82784     150         
1 1 1 8  8  84 o 2  55.4633 5.0778  59.037      13.4627  59.037      13.4627  25.9866    360         14.0218     180         
1 1 1 8  8  85 o 10 17.9052 7.35199 8.10257     10.8105  8.10257     10.8105  6.71014    210         31.5441     210         
1 1 1 8  8  86 o 4  14.956  6.71354 2.47954     10.9383  2.47954     10.9383  3.08877    240         14.0154     240         
1 1 1 8  8  87 o 8  29.4869 9.03344 24.0749     13.7758  24.0749     13.7758  10.0336    270         13.7088     90          
1 1 1 8  8  88 o 17 23.5594 8.8498  16.3739     14.0985  16.3739     14.0985  7.47849    120         0.21161     120         
1 1 1 8  8  89 o 16 28.3978 9.29335 23.5151     14.5945  23.5151     14.5945  14.994     150         1.40751     150         
1 1 1 8  8  90 o 5  44.0393 8.52958 44.9336     16.2736  44.9336     16.2736  29.9285    180         9.20808     180         
1 1 1 8  8  91 o 12 14.7321 7.08694 -5.13464    15.9526  -5.13464    15.9526  0.375023   210         1.78577     210         
1 1 1 8  8  92 o 2  13.9345 6.78832 -7.65494    15.7009  -7.65494    15.7009  1.89673    60          6.34452     60          
1 1 1 8  8  93 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  0  0  o 1  166.719 2.83497 493.351     23.6551  493.351     23.6551  105.795    180         338.611     180         
1 1 1 9  0  1  o 16 682.429 5.64304 8257.87     192.929  8257.87     192.929  507.086    60          31.1015     60          
1 1 1 9  0  2  o 3  228.037 2.45742 922.059     28.0684  922.059     28.0684  96.4538    120         89.2545     300         
1 1 1 9  0  3  o 8  249.626 2.34575 1104.72     29.3332  1104.72     29.3332  143.79     360         3.79211     360         
1 1 1 9  0  4  o 7  1491.1  12.8234 39489.6     957.914  39489.6     957.914  1241.03    60          334.942     60          
1 1 1 9  0  5  o 12 363.534 3.35838 2343.08     61.16    2343.08     61.16    282.978    120         47.7014     120         
1 1 1 9  0  6  o 17 892.61  7.21325 14131.8     322.571  14131.8     322.571  604.945    180         74.7101     360         
1 1 1 9  0  7  o 4  671.548 5.47031 7996.79     184.043  7996.79     184.043  526.965    240         87.8181     240         
1 1 1 9  0  8  o 2  321.297 2.8849  1830.17     46.4345  1830.17     46.4345  274.505    120         138.772     120         
1 1 1 9  0  9  o 11 252.096 2.54072 1126.82     32.0837  1126.82     32.0837  28.5165    360         14.2195     360         
1 1 1 9  0  10 o 10 639.15  5.13054 7243.74     164.286  7243.74     164.286  429.804    60          58.6005     240         
1 1 1 9  0  11 o 15 452.278 3.83024 3626.7      86.7863  3626.7      86.7863  323.54     120         2.23637     299.999     
1 1 1 9  0  12 o 18 263.659 2.56724 1232.52     33.9066  1232.52     33.9066  184.178    180         35.381      180         
1 1 1 9  0  13 o 2  218.245 2.38917 844.609     26.1167  844.609     26.1167  110.587    60          27.7732     240         
1 1 1 9  0  14 o 10 210.362 2.32572 784.703     24.5044  784.703     24.5044  68.8843    120         11.4546     120         
1 1 1 9  0  15 o 15 380.577 3.35413 2567.89     63.9485  2567.89     63.9485  305.654    180         67.5537     180         
1 1 1 9  0  16 o 9  101.942 1.99158 184.562     10.1569  184.562     10.1569  49.4722    240         159.18      240         
1 1 1 9  0  17 o 16 320.087 3.08226 1816.56     49.4216  1816.56     49.4216  60.7179    120         48.3181     120         
1 1 1 9  0  18 o 17 196.958 2.56404 688.082     25.2887  688.082     25.2887  93.4663    180         20.5233     2.74344e-05 
1 1 1 9  0  19 f 0  1465.8  13.1206 38161       963.454  38161       963.454  1021.5     60          0           0           
1 1 1 9  0  20 o 2  243.758 3.11457 1053.9      38.0186  1053.9      38.0186  166.4      120         86.9747     120         
1 1 1 9  0  21 o 13 448.965 4.44187 3574.16     99.8957  3574.16     99.8957  423.145    1.1575e-05  207.481     1.1575e-05  
1 1 1 9  0  22 o 5  748.275 6.87366 9929.61     257.659  9929.61     257.659  741.224    60          418.819     60          
1 1 1 9  0  23 f 0  51.381  2.34272 47.3587     5.97402  47.3587     5.97402  17.236     120         0           0           
1 1 1 9  0  24 o 14 1422.27 11.516  35890.6     820.568  35890.6     820.568  1110.55    1.6301e-07  204.554     1.6301e-07  
1 1 1 9  0  25 o 6  111.092 2.2302  219.201     12.3935  219.201     12.3935  27.3623    60          162.041     60          
1 1 1 9  0  26 o 8  237.774 2.67314 1002.53     31.8346  1002.53     31.8346  99.4303    300         136.265     120         
1 1 1 9  0  27 o 14 273.458 2.80521 1325.85     38.4247  1325.85     38.4247  31.3954    360         323.283     180         
1 1 1 9  0  28 f 0  320.17  3.08758 1817.4      49.5196  1817.4      49.5196  219.66     60          0           0           
1 1 1 9  0  29 o 7  98.0807 2.14512 170.939     10.5209  170.939     10.5209  2.06315    299.999     17.0227     299.999     
1 1 1 9  0  30 o 13 1702.2  13.3026 51430.7     1134.46  51430.7     1134.46  1206.02    1.64379e-07 20.1182     1.64378e-07 
1 1 1 9  0  31 o 7  414.548 3.77816 3046.73     78.4609  3046.73     78.4609  459.294    240         339.721     240         
1 1 1 9  0  32 o 17 427.608 4.06181 3241.94     87.0061  3241.94     87.0061  305.188    120         11.5592     120         
1 1 1 9  0  33 o 10 347.646 3.70817 2143.1      64.5706  2143.1      64.5706  198.934    360         88.0851     180         
1 1 1 9  0  34 o 19 1052.38 9.44191 19649.6     497.778  19649.6     497.778  667.043    60          134.286     240         
1 1 1 9  0  35 o 7  394.496 3.8647  2759.42     76.3713  2759.42     76.3713  237.648    300         74.086      120         
1 1 1 9  0  36 o 10 62.6308 2.63159 70.2401     8.19234  70.2401     8.19234  44.0304    180         107.704     180         
1 1 1 9  0  37 o 5  227.922 3.30908 921.715     37.7607  921.715     37.7607  182.357    60          96.7602     60          
1 1 1 9  0  38 f 0  1122.19 11.5973 22369.6     651.895  22369.6     651.895  718.427    120         0           0           
1 1 1 9  0  39 o 5  73.6283 2.6864  96.8277     9.85176  96.8277     9.85176  13.0417    180         46.4082     180         
1 1 1 9  0  40 o 9  566.47  5.88434 5692.71     166.964  5692.71     166.964  387.831    60          5.08571     240         
1 1 1 9  0  41 o 7  55.0089 2.59191 54.3323     7.07129  54.3323     7.07129  5.24173    300         14.2862     300         
1 1 1 9  0  42 o 16 283.802 3.20959 1428.5      45.6221  1428.5      45.6221  246.442    3.03059e-06 103.595     3.03059e-06 
1 1 1 9  0  43 o 9  607.631 5.46069 6549.78     166.223  6549.78     166.223  438.694    240         45.6531     240         
1 1 1 9  0  44 o 10 206.216 2.60396 754.319     26.8908  754.319     26.8908  138.377    300         114.476     300         
1 1 1 9  0  45 o 18 58.0567 2.36197 60.3211     6.81958  60.3211     6.81958  8.35564    180         30.0877     180         
1 1 1 9  0  46 o 18 7.38451 3.55518 -2.35718    4.03131  -2.35718    4.03131  54.039     60          108.633     60          
1 1 1 9  0  47 o 7  421.858 3.87988 3156.52     81.9936  3156.52     81.9936  364.389    120         157.049     120         
1 1 1 9  0  48 o 18 60.3384 2.44252 65.1533     7.32987  65.1533     7.32987  28.982     180         108.034     180         
1 1 1 9  0  49 o 18 393.732 3.85998 2750.01     76.1302  2750.01     76.1302  324.924    60          119.062     60          
1 1 1 9  0  50 o 7  722.947 6.14608 9279.74     222.599  9279.74     222.599  504.795    120         37.6525     120         
1 1 1 9  0  51 o 9  235.527 2.60418 983.909     30.7208  983.909     30.7208  262.12     180         209.757     180         
1 1 1 9  0  52 o 5  320.16  3.83249 1819.05     61.4509  1819.05     61.4509  198.212    60          31.5833     240         
1 1 1 9  0  53 o 3  322.318 3.48244 1843.18     56.2211  1843.18     56.2211  265.78     300         101.917     300         
1 1 1 9  0  54 o 14 74.6582 2.51925 99.466      9.3765   99.466      9.3765   10.3565    360         68.29       180         
1 1 1 9  0  55 o 7  123.355 2.5637  270.408     15.8173  270.408     15.8173  99.3847    60          51.8471     60          
1 1 1 9  0  56 o 14 213.491 2.9506  808.925     31.541   808.925     31.541   109.918    300         62.1818     120         
1 1 1 9  0  57 o 16 9.15047 4.15624 0.0769375   4.34541  0.0769375   4.34541  14.3971    9.24653e-06 29.2138     9.24653e-06 
1 1 1 9  0  58 o 16 157.075 3.05232 438.42      23.9859  438.42      23.9859  105.112    60          4.11947     60          
1 1 1 9  0  59 o 5  78.6786 2.69885 110.51      10.584   110.51      10.584   12.7044    300         73.0719     120         
1 1 1 9  0  60 o 12 75.3808 3.29259 101.911     12.3283  101.911     12.3283  28.9041    180         23.6876     8.76229e-06 
1 1 1 9  0  61 o 15 187.844 3.68644 627.374     34.6424  627.374     34.6424  105.852    60          32.4547     240         
1 1 1 9  0  62 o 9  238.632 3.76296 1011.88     44.9501  1011.88     44.9501  198.408    300         87.6948     300         
1 1 1 9  0  63 o 12 49.5545 4.09341 45.3367     9.80329  45.3367     9.80329  7.56305    1.25125e-05 28.6571     180         
1 1 1 9  0  64 o 12 125.103 3.45023 278.983     21.5561  278.983     21.5561  120.843    240         83.7427     240         
1 1 1 9  0  65 o 18 237.771 3.99583 1005.73     47.5524  1005.73     47.5524  122.59     300         59.5988     120         
1 1 1 9  0  66 o 10 156.93  3.5719  438.62      28.025   438.62      28.025   108.754    180         17.0791     180         
1 1 1 9  0  67 o 1  271.409 4.29003 1311.68     58.2847  1311.68     58.2847  156.862    60          31.6444     240         
1 1 1 9  0  68 o 8  98.115  3.55366 172.369     17.368   172.369     17.368   65.1484    300         6.00421     300         
1 1 1 9  0  69 o 3  188.987 3.6751  636.399     34.747   636.399     34.747   86.4002    180         65.8841     360         
1 1 1 9  0  70 o 2  140.539 3.21483 352.089     22.5884  352.089     22.5884  83.4897    240         9.83737     60          
1 1 1 9  0  71 o 12 23.4669 6.87337 13.8478     8.03598  13.8478     8.03598  16.4746    300         48.0438     300         
1 1 1 9  0  72 o 19 39.8655 5.03997 30.9219     9.11123  30.9219     9.11123  4.89805    180         36.4882     8.6514e-06  
1 1 1 9  0  73 o 3  42.6076 4.80986 34.7771     9.48676  34.7771     9.48676  3.49295    239.999     1.94034     239.999     
1 1 1 9  0  74 o 7  14.901  6.16525 4.78104     7.69686  4.78104     7.69686  7.591      300         21.0932     300         
1 1 1 9  0  75 o 12 41.7627 4.99703 33.7593     9.55939  33.7593     9.55939  14.6116    180         21.7964     8.65132e-06 
1 1 1 9  0  76 f 0  68.8137 3.62029 85.8925     12.3222  85.8925     12.3222  60.7048    240         0           0           
1 1 1 9  0  77 o 9  26.2458 6.51216 16.2624     7.76102  16.2624     7.76102  5.35347    300         5.92729     120         
1 1 1 9  0  78 o 6  91.7218 3.03202 150.942     13.8672  150.942     13.8672  60.8506    360         10.0184     360         
1 1 1 9  0  79 o 6  138.574 2.92524 343.193     20.2733  343.193     20.2733  87.6232    60          7.2463      60          
1 1 1 9  0  80 o 7  74.1227 3.2713  99.2513     12.0418  99.2513     12.0418  30.03      300         29.4087     120         
1 1 1 9  0  81 o 1  12.3512 5.47873 1.64106     7.04701  1.64106     7.04701  5.37799    8.74833e-06 15.4935     8.74832e-06 
1 1 1 9  0  82 o 9  63.5818 3.45743 73.6527     10.8628  73.6527     10.8628  49.8025    60          23.5475     60          
1 1 1 9  0  83 o 12 26.4245 6.8315  16.997      8.33977  16.997      8.33977  12.0072    120         1.63119     300         
1 1 1 9  0  84 f 0  15.203  6.20051 5.53812     7.6096   5.53812     7.6096   47.4934    0           0           0           
1 1 1 9  0  85 o 14 8.54914 4.22519 -6.3311     6.67867  -6.3311     6.67867  3.23901    59.9999     7.86071     59.9999     
1 1 1 9  0  86 o 13 48.3942 5.64438 46.254      12.5708  46.254      12.5708  17.6761    300         21.475      120         
1 1 1 9  0  87 o 13 17.0429 7.08972 6.91267     10.2721  6.91267     10.2721  0.0111516  180         1.15716     360         
1 1 1 9  0  88 o 16 17.1734 7.54184 5.15708     13.013   5.15708     13.013   2.51232    240         16.5555     240         
1 1 1 9  0  89 o 7  26.4263 9.14571 20.3775     14.3373  20.3775     14.3373  9.3612     300         0.0429908   119.999     
1 1 1 9  0  90 o 13 49.8791 12.0777 65.0007     27.1168  65.0007     27.1168  25.5958    180         6.24254     8.7382e-06  
1 1 1 9  0  91 x 2  ?       ?       ?           ?        ?           ?        19.2122    240         0           0           
1 1 1 9  0  92 x 19 ?       ?       ?           ?        ?           ?        4.84506    300         0           0           
1 1 1 9  0  93 x 1  ?       ?       ?           ?        ?           ?        33.1453    180         0           0           
1 1 1 9  0  94 x 12 ?       ?       ?           ?        ?           ?        12.9699    60          0           0           
1 1 1 9  0  95 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  1  0  o 11 704.284 5.76141 8795.75     203.285  8795.75     203.285  363.172    180         288.586     1.03761e-05 
1 1 1 9  1  1  o 5  362.303 3.22716 2354.22     60.5387  2298.67     56.6243  199.576    255.403     80.3964     75.4028     
1 1 1 9  1  2  o 12 907.558 7.22769 14668.5     345.366  14559.2     311.324  664.529    63.2532     39.6462     63.2532     
1 1 1 9  1  3  o 18 446.715 3.86078 3558.02     87.9159  3516.29     84.9345  268.314    247.388     72.9546     67.3883     
1 1 1 9  1  4  o 19 419.311 3.69464 3079.63     81.4968  3153.36     73.4659  282.633    183.602     2.85115     183.602     
1 1 1 9  1  5  o 16 434.323 3.83839 3294.86     83.5348  3392.83     83.5427  319.073    280.567     56.6395     280.567     
1 1 1 9  1  6  o 18 231.375 2.65081 967.787     31.9177  929.85      29.548   91.7921    1.87132     69.2368     181.871     
1 1 1 9  1  7  o 9  694.182 5.8627  8506.34     214.922  8587.64     192.24   484.242    335.7       8.28839     155.7       
1 1 1 9  1  8  o 2  339.566 3.15191 2036.75     54.5497  2050.47     52.7004  207.187    312.13      25.5663     132.13      
1 1 1 9  1  9  o 3  285.904 2.78012 1459.52     41.1487  1437.79     38.4912  29.0305    22.0235     321.908     202.024     
1 1 1 9  1  10 o 9  654.548 5.24441 7637.05     177.698  7558.37     166.221  417.164    209.933     85.6581     29.9327     
1 1 1 9  1  11 o 5  516.32  4.27543 4699.84     114.228  4752.61     106.858  319.125    200.36      77.5202     20.3602     
1 1 1 9  1  12 o 10 147.335 2.0483  367.187     15.5812  402.557     14.5797  16.9923    235.468     164.725     235.468     
1 1 1 9  1  13 o 6  645.813 5.19001 7344.99     173.43   7447.09     162.243  455.675    275.077     6.58394     275.077     
1 1 1 9  1  14 o 11 281.015 2.79631 1364.31     40.0229  1435.17     38.6722  177.452    299.884     101.93      299.884     
1 1 1 9  1  15 o 14 352.996 3.48822 2205.52     62.9221  2211.57     60.4637  250.038    260.725     39.6826     260.725     
1 1 1 9  1  16 o 13 603.138 5.4421  6434.18     164.479  6466.92     164.503  492.668    216.029     148.051     216.029     
1 1 1 9  1  17 o 13 477.504 4.48423 3976.3      109.549  4108.07     104.917  460.865    149.604     290.859     149.604     
1 1 1 9  1  18 o 5  358.994 3.7526  2264.62     67.5031  2303.8      67.517   317.366    301.043     194.434     301.043     
1 1 1 9  1  19 o 10 200.588 2.69615 728.159     27.0928  697.999     27.1027  37.2967    281.531     170.311     101.531     
1 1 1 9  1  20 o 3  824.546 7.49406 12091.4     309.644  12026       309.685  574.277    104.556     13.8        284.556     
1 1 1 9  1  21 o 11 870.731 7.43233 13524.2     317.701  13368.2     330.718  733.247    224.512     241.554     224.512     
1 1 1 9  1  22 f 0  184.064 2.39055 616.913     22.0395  583.975     22.0495  42.9668    150.29      0           0           
1 1 1 9  1  23 o 15 1125.07 9.07497 22505       521.047  22405       502.146  897.546    189.854     206.933     189.854     
1 1 1 9  1  24 o 10 1510.61 12.3527 40480.7     935.08   40561.9     935.194  1089.71    181.126     43.0777     181.126     
1 1 1 9  1  25 o 14 770.336 6.41246 10659.7     237.698  10382.1     256.753  430.933    65.0617     219.653     245.062     
1 1 1 9  1  26 o 8  540.41  4.74643 5147.52     123.517  5204.83     133.431  350.767    239.178     47.6177     59.1781     
1 1 1 9  1  27 o 18 315.733 3.17563 1751.59     48.2856  1781.54     52.1637  196.712    338.644     25.6057     158.644     
1 1 1 9  1  28 o 6  607.343 5.24585 6571.55     153.367  6505.29     165.66   427.323    260.598     11.7225     260.598     
1 1 1 9  1  29 o 8  390.767 3.76636 2686.26     69.2137  2726.12     78.0941  158.393    232.239     218.845     52.2389     
1 1 1 9  1  30 o 1  1068.43 9.49096 20268.6     508.176  20243.4     508.179  814.673    150.44      135.88      150.44      
1 1 1 9  1  31 o 4  628.462 5.7332  7021.66     176.585  6982.22     184.439  501.251    22.9962     136.899     22.9962     
1 1 1 9  1  32 o 3  594.99  5.56453 6286.9      165.919  6265.01     165.92   424.353    172.831     30.9264     172.831     
1 1 1 9  1  33 o 7  350.887 3.71047 2147.06     65.2318  2217.32     65.2487  236.483    76.8151     11.4783     76.815      
1 1 1 9  1  34 o 11 905.616 8.32702 14379.2     386.634  14726.1     368.728  639.062    247.272     24.9232     247.272     
1 1 1 9  1  35 o 2  673.866 6.45739 8029.19     218.059  8077.15     218.074  553.07     93.1588     184.677     93.1588     
1 1 1 9  1  36 o 9  250.38  3.0796  1136.52     40.5703  1085.77     36.6887  116.259    297.694     86.0404     117.693     
1 1 1 9  1  37 o 18 302.716 3.47171 1611.47     56.2771  1636.89     48.724   218.581    235.772     48.3        235.772     
1 1 1 9  1  38 o 19 169.639 2.50369 522.91      22.2628  497.203     20.3006  83.417     72.9432     24.9382     72.9433     
1 1 1 9  1  39 o 14 61.0383 2.46615 66.8677     7.75889  65.6165     7.2614   18.0703    277.624     51.0634     277.624     
1 1 1 9  1  40 o 15 595.314 5.80617 6117.96     184.756  6458.92     160.027  435.684    73.8077     60.1274     73.8077     
1 1 1 9  1  41 o 6  694.005 6.36232 8552.86     221.274  8543.92     221.283  548.765    79.8062     151.07      79.8062     
1 1 1 9  1  42 o 5  465.288 4.48193 3797.86     106.721  3881.25     102.186  291.919    249.563     45.9456     69.5631     
1 1 1 9  1  43 o 18 109.965 2.32615 205.387     13.047   223.823     12.5154  20.9981    95.0995     1.07221     95.0995     
1 1 1 9  1  44 o 6  491.476 4.56832 4286.75     112.516  4283.2      112.519  303.061    222.087     58.1402     42.0868     
1 1 1 9  1  45 o 8  345.106 3.70348 2113.5      62.4886  2110.6      65.5731  259.133    222.091     60.7967     222.091     
1 1 1 9  1  46 f 0  299.038 3.57183 1560.48     54.8734  1611.39     52.0904  192.622    75.6679     0           0           
1 1 1 9  1  47 o 13 501.848 4.99148 4526.46     122.446  4415.4      128.46   415.893    94.4284     160.956     94.4284     
1 1 1 9  1  48 o 15 158.303 2.65934 445.092     21.3953  443.434     20.7957  39.9193    275.621     120.474     95.6212     
1 1 1 9  1  49 o 4  567.932 5.37763 5684.28     145.948  5773.83     159.942  433.473    236.17      106.688     236.17      
1 1 1 9  1  50 o 16 418.123 4.31683 3250.17     88.463   2958.89     92.0886  339.532    278.982     123.855     278.982     
1 1 1 9  1  51 o 19 92.9343 2.65695 154.188     11.5827  152.578     13.0611  1.813      267.556     115.904     267.556     
1 1 1 9  1  52 o 15 382.572 4.07715 2638.39     72.8262  2557.3      83.0028  250.102    255.952     6.16343     75.9521     
1 1 1 9  1  53 o 19 152.519 2.69369 424.43      20.1136  400.987     20.9972  68.2189    84.8775     55.8225     264.878     
1 1 1 9  1  54 o 14 341.581 3.9786  2078.08     66.2913  2064.12     69.8607  265.25     274.503     83.8425     274.503     
1 1 1 9  1  55 o 3  35.7525 3.93386 22.3195     6.32541  24.1519     7.30774  21.4018    298.629     57.3226     298.629     
1 1 1 9  1  56 o 15 171.671 3.14241 532.147     27.1167  514.277     26.9042  113.858    348.697     14.3148     348.697     
1 1 1 9  1  57 o 10 191.67  3.01406 656.701     27.432   646.726     30.3714  79.8412    117.278     84.9546     297.278     
1 1 1 9  1  58 o 2  149.256 2.68456 407.169     20.2356  383.485     19.902   49.9804    252.152     87.0128     72.1521     
1 1 1 9  1  59 o 12 205.673 3.16969 756.904     33.6774  744.377     31.647   111.983    161.144     37.5095     341.144     
1 1 1 9  1  60 o 19 276.302 4.05513 1358.47     51.9617  1354.1      60.0316  226.457    136.086     101.102     136.086     
1 1 1 9  1  61 o 5  115.152 2.8687  235.496     17.6815  235.68      15.2861  61.6636    56.3845     13.4132     236.384     
1 1 1 9  1  62 o 7  311.847 3.86057 1777.21     63.4619  1680.23     57.1796  242.045    119.954     85.0531     119.954     
1 1 1 9  1  63 o 2  95.9714 2.96897 168.365     14.2272  159.372     14.2532  59.2859    281.578     8.82005     281.578     
1 1 1 9  1  64 o 8  213.781 3.18418 808.171     35.4515  815.767     32.706   185.356    52.6962     103.393     52.6962     
1 1 1 9  1  65 f 0  192.01  3.29507 659.848     33.0421  651.357     30.2997  99.8634    203.413     0           0           
1 1 1 9  1  66 o 2  117.961 3.05394 240.895     18.6683  254.534     17.3015  69.0312    254.204     5.07425     74.204      
1 1 1 9  1  67 o 6  109.83  3.08315 208.743     17.4747  221.083     16.3328  37.6712    245.266     59.1965     65.2662     
1 1 1 9  1  68 o 4  85.4424 3.15021 133.772     13.9387  126.845     12.9465  29.466     90.9326     42.9431     270.933     
1 1 1 9  1  69 o 4  113.078 2.98364 232.587     17.2498  223.324     16.5082  52.1091    355.701     33.4187     175.701     
1 1 1 9  1  70 f 0  42.2636 4.41398 37.3376     9.54239  28.3327     8.56851  43.0624    126.266     0           0           
1 1 1 9  1  71 f 0  119.818 3.01206 253.699     18.3965  258.702     17.7028  42.5902    67.2609     0           0           
1 1 1 9  1  72 o 9  114.911 3.19419 230.981     18.1108  241.194     18.6071  54.9973    1.77904     30.1342     181.779     
1 1 1 9  1  73 o 10 12.5527 4.14223 -7.58507    6.68329  -4.76327    6.19873  13.4784    129.377     32.5344     129.377     
1 1 1 9  1  74 o 1  110.104 3.06876 226.114     17.5054  208.077     16.3003  64.547     314.827     4.64626     134.827     
1 1 1 9  1  75 o 6  15.5578 4.76796 -2.58779    7.20789  0.621896    6.63414  8.53763    242.347     24.8728     242.347     
1 1 1 9  1  76 o 18 37.897  4.85344 26.2495     9.22218  27.522      8.51106  10.7419    58.3295     19.0049     238.33      
1 1 1 9  1  77 o 9  40.8853 4.36594 34.5857     8.53483  27.5269     8.68535  19.6316    209.38      3.35576     29.3804     
1 1 1 9  1  78 o 19 97.0173 2.92805 165.357     14.2651  172.717     14.1327  63.8356    157.029     12.2704     157.029     
1 1 1 9  1  79 o 3  49.218  3.97942 51.5277     9.4645   37.832      9.56535  32.1039    283.957     11.689      283.957     
1 1 1 9  1  80 o 2  72.8659 3.51146 96.7414     12.7187  95.8089     12.7725  48.6008    30.2469     12.7704     30.2469     
1 1 1 9  1  81 o 16 84.1997 3.10756 122.305     13.0367  133.768     13.0785  48.3224    288.603     2.42855     108.603     
1 1 1 9  1  82 o 4  114.901 2.92409 245.055     17.45    231.046     16.1719  68.9126    217.097     1.70766     217.097     
1 1 1 9  1  83 f 0  19.3385 5.35115 8.63595     8.13289  -0.930344   7.63956  17.7744    53.292      0           0           
1 1 1 9  1  84 o 2  90.5277 3.31803 143.146     14.9702  155.718     15.013   57.8716    70.4361     10.1689     70.4361     
1 1 1 9  1  85 o 5  69.1311 4.14035 90.73       14.5067  87.2773     13.9128  53.6141    239.025     29.3445     239.025     
1 1 1 9  1  86 o 15 50.6715 5.52901 54.8302     14.1996  45.7055     12.9786  32.9252    259.149     10.7756     259.149     
1 1 1 9  1  87 o 17 28.964  7.04483 16.429      13.6341  16.5913     11.2032  9.0678     216.033     8.68707     36.0331     
1 1 1 9  1  88 o 19 21.176  6.38722 -8.64732    12.4144  9.28168     12.8033  4.04141    46.7748     27.0186     46.7748     
1 1 1 9  1  89 o 12 30.8023 7.21106 29.7658     14.0787  6.16326     14.4298  12.6942    9.88521     2.68194     189.885     
1 1 1 9  1  90 o 1  33.0978 12.5516 22.4143     20.254   0           0        9.80856    355.657     12.3668     175.657     
1 1 1 9  1  91 o 12 26.3965 12.2248 0           0        -6.08454    27.1089  6.14728    300.247     4.0411      120.247     
1 1 1 9  1  92 x 15 ?       ?       ?           ?        ?           ?        18.5489    329.727     0           0           
1 1 1 9  1  93 x 0  ?       ?       ?           ?        ?           ?        24.8406    29.3674     0           0           
1 1 1 9  1  94 x 5  ?       ?       ?           ?        ?           ?        12.1738    97.78       0           0           
1 1 1 9  1  95 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  2  0  o 19 146.934 2.14711 383.04      15.7949  383.04      15.7949  12.9658    360         149.797     360         
1 1 1 9  2  1  o 6  173.133 2.28375 541.146     20.1843  521.312     19.4471  1.96173    192.102     169.261     12.1019     
1 1 1 9  2  2  o 13 491.762 4.2832  4320.71     107.507  4253.67     103.595  389.647    268.404     110.195     268.404     
1 1 1 9  2  3  o 6  382.499 3.54757 2555.69     66.7415  2631.07     69.2652  272.864    230.178     43.713      230.178     
1 1 1 9  2  4  f 0  758.72  6.29709 10163       243.796  10261       234.938  552.319    11.4779     0           0           
1 1 1 9  2  5  o 13 385.658 3.56982 2622.78     67.7075  2649.82     70.2679  260.251    69.9636     8.75781     69.9637     
1 1 1 9  2  6  o 1  121.13  2.14187 268.385     12.4673  251.941     13.4627  12.3607    199.881     56.1442     199.881     
1 1 1 9  2  7  o 6  665.25  6.02354 7845.5      216.889  7855.2      183.309  579.559    145.427     231.433     145.427     
1 1 1 9  2  8  f 0  386.902 3.65232 2640.99     68.0469  2665.88     73.5039  298.703    26.6556     0           0           
1 1 1 9  2  9  o 3  578.908 4.94531 5948.51     140.781  5936.72     146.105  365.442    123.505     79.1085     303.505     
1 1 1 9  2  10 o 6  162.324 2.24549 472.716     17.9199  461.182     18.5965  1.58568    313.668     153.915     133.667     
1 1 1 9  2  11 o 9  433.977 3.97794 3358.84     86.5107  3318.41     86.5146  314.416    64.6614     41.396      64.6614     
1 1 1 9  2  12 o 8  766.539 6.88961 10391.2     258.849  10460.9     270.383  419.676    268.289     247.248     88.289      
1 1 1 9  2  13 o 8  355.056 3.63696 2242.12     63.2856  2226.86     66.1011  103.486    192.509     278.071     12.5092     
1 1 1 9  2  14 o 18 264.593 3.02338 1256.83     40.088   1224.77     40.0862  138.415    12.9393     52.0547     192.939     
1 1 1 9  2  15 o 12 347.422 3.76111 2136.07     63.9045  2142.72     67.0304  226.858    26.5116     5.51492     206.512     
1 1 1 9  2  16 o 6  201.413 2.68116 727.736     27.0605  710.106     27.0618  71.5285    300.03      82.9163     120.03      
1 1 1 9  2  17 o 10 106.158 2.38899 202.055     12.6843  197.755     12.7009  76.5729    311.585     248.248     311.585     
1 1 1 9  2  18 o 2  676.009 6.14391 8129.92     203.535  8076.23     212.615  579.359    270.095     214.202     270.095     
1 1 1 9  2  19 o 5  481.616 4.31005 4122.22     104.018  4100.13     104.034  360.243    231.058     58.0015     231.058     
1 1 1 9  2  20 f 0  370.734 3.60313 2427.31     65.5851  2444.25     68.2817  402.903    269.184     0           0           
1 1 1 9  2  21 o 1  1231.23 10.3077 26989.5     623.057  26819.5     648.606  1016.66    325.977     289.17      325.977     
1 1 1 9  2  22 o 6  759.629 6.40259 10254.8     234.127  10205.7     252.933  500.418    65.6942     68.0914     245.694     
1 1 1 9  2  23 o 7  858.212 7.19352 13218       297.069  12902.3     320.913  598.657    1.39915     11.4409     181.399     
1 1 1 9  2  24 o 15 285.926 3.12337 1545.89     42.663   1354.69     46.378   218.761    71.1376     79.785      71.1376     
1 1 1 9  2  25 o 6  1273.74 10.4447 28957.5     640.348  28626.5     691.759  898.671    151.224     0.788426    331.221     
1 1 1 9  2  26 o 17 336.88  3.3469  2068.3      52.8927  1954.76     59.6852  128.83     217.839     201.081     37.8394     
1 1 1 9  2  27 o 8  433.264 4.2066  3362.21     89.2936  3291.78     93.2859  211.43     174.508     174.607     354.508     
1 1 1 9  2  28 o 13 375.479 3.96056 2530.83     72.6985  2466.58     76.2544  279.308    306.248     53.3949     306.248     
1 1 1 9  2  29 f 0  502.86  4.82536 4487.07     121.585  4477.06     121.617  318.724    273.271     0           0           
1 1 1 9  2  30 o 1  221.712 2.81683 884.135     31.2794  858.103     31.3099  137.684    47.4573     19.1856     47.4573     
1 1 1 9  2  31 o 10 703.524 6.44025 8864.6      227.039  8687.86     227.065  339.269    199.205     299.573     19.2046     
1 1 1 9  2  32 o 13 719.194 6.56509 9251.33     236.602  9093.05     236.62   573.451    109.229     154.155     109.229     
1 1 1 9  2  33 o 15 670.965 6.28104 8050.44     206.05   7915.79     216.131  527.455    123.564     133.014     123.564     
1 1 1 9  2  34 o 19 273.949 3.22738 1320.02     41.0362  1340.03     47.3967  197.004    140.203     65.4148     140.203     
1 1 1 9  2  35 f 0  1432.37 12.6446 36562.1     865.244  36417.9     947.986  878.428    325.587     0           0           
1 1 1 9  2  36 o 17 390.475 4.12368 2753.67     76.7892  2652.17     84.2626  258.049    235.051     6.61765     55.0508     
1 1 1 9  2  37 o 2  629.688 6.11058 6998.72     182.93   7067.39     202.326  503.958    68.9387     147.12      68.9387     
1 1 1 9  2  38 o 5  675.356 6.48008 8134.7      219.272  8050.26     219.358  539.911    167.162     155.015     167.162     
1 1 1 9  2  39 o 16 570.335 5.47009 5781.93     160.008  5757.39     152.609  346.152    211.564     87.5656     31.5644     
1 1 1 9  2  40 o 5  393.465 4.06014 2715.05     78.1256  2774.81     81.9799  280.244    331.495     31.5351     331.495     
1 1 1 9  2  41 o 3  541.13  5.23937 5214.68     138.625  5174.65     145.43   399.862    275.259     64.2678     275.259     
1 1 1 9  2  42 o 13 759.104 7.28129 10216.5     262.763  10257.5     290.573  554.468    32.9687     72.465      32.9687     
1 1 1 9  2  43 o 16 215.48  2.81313 800.079     31.0642  846.327     29.6154  155.463    326.776     38.6728     326.776     
1 1 1 9  2  44 o 18 163.396 2.76136 471.518     20.6812  475.325     24.3811  92.9437    359.146     11.5177     179.146     
1 1 1 9  2  45 o 13 207.245 2.91354 750.275     31.5508  772.681     28.8646  129.525    7.11037     4.26775     187.11      
1 1 1 9  2  46 o 8  373.1   4.28885 2434.36     77.7829  2505.4      82.584   326.248    285.709     160.029     285.709     
1 1 1 9  2  47 o 17 95.143  2.46442 167.419     12.0439  154.076     11.4196  23.6794    320.435     17.3926     140.435     
1 1 1 9  2  48 f 0  156.375 2.50207 413.37      17.7649  454.085     21.4191  177.457    84.9157     0           0           
1 1 1 9  2  49 f 0  216.041 2.82266 841.431     29.2963  813.778     31.7283  136.3      339.549     0           0           
1 1 1 9  2  50 o 4  373.542 4.37114 2519.06     77.0716  2434.73     86.1545  286.898    102.289     77.854      102.289     
1 1 1 9  2  51 o 8  305.118 3.64367 1656.73     57.1735  1646.7      54.2246  256.785    65.8898     113.635     65.8898     
1 1 1 9  2  52 o 17 286.944 3.37758 1480.05     47.3851  1441.31     49.6892  156.261    62.7166     65.2802     242.717     
1 1 1 9  2  53 o 15 88.0235 2.65204 143.946     10.9271  131.477     12.2934  32.8284    219.564     24.0753     39.5643     
1 1 1 9  2  54 o 12 246.496 3.10004 1067.03     39.2011  1088.59     37.3439  105.276    140.917     111.084     320.917     
1 1 1 9  2  55 o 16 141.08  2.73975 351.202     17.8284  355.298     20.7781  54.0924    245.458     67.8101     65.4578     
1 1 1 9  2  56 o 12 214.929 3.13955 830.463     35.7455  808.676     31.8199  192.081    141.855     118.014     141.855     
1 1 1 9  2  57 o 17 184.103 2.99169 623.74      26.0874  579.209     28.9105  98.3161    342.024     36.5615     162.024     
1 1 1 9  2  58 o 4  299.162 3.40028 1626.71     49.7757  1550.48     52.0765  203.046    41.342      19.5677     41.3421     
1 1 1 9  2  59 o 11 181.661 2.7687  585.198     24.6963  585.614     25.7054  93.4005    259.301     42.7782     79.3009     
1 1 1 9  2  60 o 12 366.977 4.2688  2411.44     82.8139  2375.78     74.0118  263.422    271.888     52.733      271.888     
1 1 1 9  2  61 o 18 137.101 2.81502 322.28      19.9185  345.589     18.638   77.1186    236.493     14.2733     56.4926     
1 1 1 9  2  62 o 2  272.466 3.63588 1326.58     51.134   1311.68     48.1273  210.17     329.048     72.5003     329.048     
1 1 1 9  2  63 o 19 119.358 2.73397 262.669     17.3039  243.799     15.3569  81.3192    72.9304     19.3857     72.9304     
1 1 1 9  2  64 o 16 59.246  3.16169 60.1007     9.96417  65.3979     8.53082  14.1347    237.841     33.1532     57.8412     
1 1 1 9  2  65 o 12 155.865 2.845   429.255     23.4599  434.193     20.8685  110.286    29.6922     27.7105     29.6921     
1 1 1 9  2  66 o 8  210.783 3.17267 812.917     36.4481  767.632     30.4596  139.447    310.929     13.7282     310.929     
1 1 1 9  2  67 o 15 73.2366 3.06989 105.917     11.8696  86.0795     10.5694  25.4175    166.129     33.8134     346.129     
1 1 1 9  2  68 o 3  90.8686 2.85126 152.534     13.7336  141.883     12.1659  61.7154    216.01      19.2851     216.01      
1 1 1 9  2  69 o 18 141.001 2.74745 385.33      20.8441  324.004     17.9799  70.5813    169.317     32.8086     349.317     
1 1 1 9  2  70 o 15 103.921 2.88104 205.887     16.3995  179.81      13.5557  59.7454    166.006     4.63772     346.006     
1 1 1 9  2  71 f 0  103.675 3.00221 201.323     16.9514  182.761     14.1593  56.5754    240.669     0           0           
1 1 1 9  2  72 o 6  100.869 3.16572 197.01      16.8388  167.584     15.1016  60.6551    39.4794     0.522097    219.479     
1 1 1 9  2  73 o 19 132.979 3.12953 326.133     21.8553  306.588     19.795   97.028     347.202     31.4934     347.202     
1 1 1 9  2  74 o 10 70.9362 3.49224 97.5002     13.0394  84.0156     11.6478  49.8599    25.7883     17.5557     25.7883     
1 1 1 9  2  75 o 18 26.2763 5.66844 11.089      8.64949  14.2123     7.7775   3.48834    69.8082     6.18227     249.808     
1 1 1 9  2  76 o 5  33.3436 5.35062 14.1913     9.37429  28.2742     8.45136  0.181882   179.792     35.6559     359.792     
1 1 1 9  2  77 o 3  49.0315 4.5463  43.342      12.0007  45.4957     9.52787  31.5828    34.2791     11.3413     34.2791     
1 1 1 9  2  78 o 17 26.741  5.43199 21.4322     8.82002  4.98719     7.85508  5.4949     236.005     3.28866     56.0046     
1 1 1 9  2  79 o 16 30.9681 5.61956 18.2965     9.24925  18.545      8.29245  8.79974    117.743     12.4411     297.743     
1 1 1 9  2  80 o 9  33.0891 5.48938 15.6727     9.62118  26.471      8.56104  14.0049    255.897     3.78608     75.8969     
1 1 1 9  2  81 o 4  63.2296 3.84338 66.3316     12.7116  80.2453     11.0531  32.1691    20.8957     9.12166     200.896     
1 1 1 9  2  82 o 17 26.8473 5.86868 13.7189     9.05959  13.773      8.33908  8.49998    319.802     8.1209      139.802     
1 1 1 9  2  83 f 0  27.8513 5.68625 22.2739     9.20919  7.51906     8.62743  26.8919    231.423     0           0           
1 1 1 9  2  84 o 4  66.7573 3.85476 93.9103     13.9085  71.4797     11.6863  42.4315    86.447      8.21814     86.447      
1 1 1 9  2  85 f 0  60.6584 4.49315 77.9956     14.0256  61.1474     12.8393  33.9265    104.332     0           0           
1 1 1 9  2  86 o 12 39.9065 6.43981 34.3688     12.4814  30.6384     12.7233  20.9219    270.627     0.0943279   270.627     
1 1 1 9  2  87 o 8  29.3761 7.03643 25.1643     13.8033  9.05662     11.7387  8.40907    288.613     11.1204     108.613     
1 1 1 9  2  88 o 19 46.6601 6.50714 49.9779     15.7734  39.3918     13.6156  27.2207    143.253     5.37704     143.253     
1 1 1 9  2  89 o 17 23.7579 7.05069 5.61685     14.0104  5.30253     14.3451  3.62882    9.60929     0.435755    189.609     
1 1 1 9  2  90 f 0  31.743  8.1228  -51.7662    34.0092  36.3465     17.4556  14.3026    95.7514     0           0           
1 1 1 9  2  91 o 10 46.222  15.5706 0           0        57.448      30.1904  14.2819    84.2541     19.8103     264.254     
1 1 1 9  2  92 x 16 ?       ?       ?           ?        ?           ?        20.0173    230.425     0           0           
1 1 1 9  2  93 x 10 ?       ?       ?           ?        ?           ?        15.9645    249.446     0           0           
1 1 1 9  2  94 x 7  ?       ?       ?           ?        ?           ?        4.84432    248.428     0           0           
1 1 1 9  2  95 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  3  0  o 18 892.457 8.12489 14134.1     363.248  14134.1     363.248  691.412    180         95.5709     180         
1 1 1 9  3  1  o 12 426.483 3.9874  3214.98     83.506   3233.73     86.913   220.139    298.472     146.304     118.472     
1 1 1 9  3  2  o 13 215.25  2.58487 816.166     26.1656  826.055     29.5193  86.8455    297.919     37.4763     117.919     
1 1 1 9  3  3  o 12 519.788 4.68518 4799.2      119.575  4781.78     124.453  370.78     49.4405     21.6295     49.4404     
1 1 1 9  3  4  o 14 138.46  2.30072 347.493     15.2681  332.066     16.5965  20.2739    271.978     145.79      271.978     
1 1 1 9  3  5  o 13 513.618 4.60996 4620.87     111.382  4734.09     125.663  316.003    38.8343     82.8906     218.834     
1 1 1 9  3  6  o 15 648.353 5.69413 7430.25     173.586  7481.28     195.84   567.793    103.988     231.105     103.988     
1 1 1 9  3  7  o 10 434.692 4.42565 3337.16     94.0924  3362.93     98.6881  397.118    274.76      229.501     274.76      
1 1 1 9  3  8  o 15 718.583 6.95248 9139.89     250.359  9185.79     250.374  647.727    188.051     287.8       188.051     
1 1 1 9  3  9  o 5  776.078 7.27898 10672.7     276.282  10705.5     289.772  574.914    253.096     51.0618     253.096     
1 1 1 9  3  10 o 14 268.248 3.18286 1281.9      41.7496  1268.78     43.7893  89.8627    203.001     168.339     23.0013     
1 1 1 9  3  11 o 3  729.902 6.87642 9426.27     245.477  9478.28     257.468  509.041    229.391     13.7758     49.391      
1 1 1 9  3  12 o 19 385.88  4.04125 2635.86     76.2661  2643.05     79.9941  95.8486    77.6195     342.196     257.619     
1 1 1 9  3  13 o 1  678.5   6.43732 8130.21     213.622  8200.98     224.065  566.475    62.1758     181.416     62.1758     
1 1 1 9  3  14 o 2  608.727 5.72886 6552.25     166.64   6589        182.567  440.012    194.261     27.1934     194.261     
1 1 1 9  3  15 o 11 184.535 2.46328 608.262     21.7982  598.635     23.7056  24.2238    216.539     168.867     36.5388     
1 1 1 9  3  16 o 16 47.7973 2.19685 43.8738     4.9881   37.5582     5.40987  113.317    235.688     245.73      235.688     
1 1 1 9  3  17 o 10 850.451 7.41873 12838.6     302.699  12818.1     329.093  792.188    204.624     386.205     204.624     
1 1 1 9  3  18 o 19 605.81  5.21266 6610.29     151.933  6402.02     164.115  404.269    207.444     41.0463     27.4443     
1 1 1 9  3  19 o 16 644.367 5.65149 7383.92     171.145  7337.23     193.116  348.572    96.2956     210.528     276.296     
1 1 1 9  3  20 o 4  735.148 6.23675 9509.02     220.789  9653.98     238.532  425.218    147.523     187.251     327.523     
1 1 1 9  3  21 o 8  520.476 4.54694 4777.89     113.951  4824.6      123.112  402.897    102.269     84.998      102.269     
1 1 1 9  3  22 o 2  753.997 6.63409 10201.3     239.847  9958.17     260.785  506.802    331.928     47.9656     151.928     
1 1 1 9  3  23 o 17 631.985 5.93109 7146.69     179.006  7014.22     196.122  366.5      114.473     153.376     294.473     
1 1 1 9  3  24 o 5  472.446 4.72493 3954.46     109.161  3957.66     114.514  303.671    287.576     46.0141     107.576     
1 1 1 9  3  25 o 7  943.038 8.65653 15861.1     399.135  15688.9     418.721  653.578    295.156     21.1158     115.156     
1 1 1 9  3  26 o 4  119.4   2.45516 251.661     13.9026  254.003     15.415   17.6956    115.392     155.697     115.392     
1 1 1 9  3  27 o 7  680.329 6.6351  8364.04     214.35   8050.75     237.021  483.031    339.262     15.9972     339.262     
1 1 1 9  3  28 o 11 104.069 2.37314 196.012     12.0213  188.251     12.6739  13.1111    81.931      96.5187     81.931      
1 1 1 9  3  29 o 5  664.341 6.42542 7885.93     202.834  7764.98     224.292  608.843    60.3987     300.62      60.3987     
1 1 1 9  3  30 o 12 405.741 4.10803 2933.16     79.6023  2902.33     87.2406  180.755    168.628     192.909     348.628     
1 1 1 9  3  31 o 9  617.954 5.81585 6942.36     171.466  6600.4      187.872  455.99     352.303     60.0381     352.303     
1 1 1 9  3  32 o 4  783.244 7.17142 11118.1     268.051  10646.1     293.686  572.738    212.4       60.0606     212.4       
1 1 1 9  3  33 o 8  1128.86 10.1428 23263.7     546.203  22003.1     598.399  875.121    6.1284      179.815     6.1284      
1 1 1 9  3  34 o 5  561.769 5.15304 5688.64     141.793  5502.17     148.144  443.753    80.0173     121.562     80.0173     
1 1 1 9  3  35 o 3  438.953 4.2531  3536.59     91.3684  3296.51     95.4728  301.98     292.085     10.8135     292.085     
1 1 1 9  3  36 f 0  541.992 4.93129 5296.32     131.034  5121.2      136.666  394.886    300.839     0           0           
1 1 1 9  3  37 o 17 346.651 3.70567 2098.66     65.8433  2161.7      62.8167  301.992    268.294     151.754     268.294     
1 1 1 9  3  38 o 18 279.609 3.24732 1380.81     44.3785  1390.69     46.6071  248.369    102.377     149.498     102.377     
1 1 1 9  3  39 o 7  495.124 4.84407 4291.85     117.286  4403.66     123.093  299.722    126.441     76.0305     306.441     
1 1 1 9  3  40 o 5  784.33  6.91088 10843.9     265.641  11001.5     277.581  533.128    167.334     10.2233     347.334     
1 1 1 9  3  41 f 0  564.101 5.0439  5585.73     142.553  5704.68     142.612  325.388    63.3173     0           0           
1 1 1 9  3  42 o 8  151.162 2.3847  403.82      18.0579  406.145     18.072   45.1053    117.023     98.4548     297.023     
1 1 1 9  3  43 o 7  112.452 2.27513 219.582     12.8012  229.079     12.811   43.0182    72.0596     13.9846     252.06      
1 1 1 9  3  44 o 8  473.073 4.7211  3952.97     109.235  3989.27     114.576  341.239    65.9607     44.1412     65.9607     
1 1 1 9  3  45 f 0  345.598 3.53252 2158.55     61.4987  2078.05     60.8573  222.301    183.491     0           0           
1 1 1 9  3  46 o 18 138.096 2.5492  332.976     17.6165  343.647     17.6341  52.7665    199.757     59.2985     19.7565     
1 1 1 9  3  47 o 16 385.661 4.14943 2632.39     80.1959  2645.58     80.1965  305.567    145.153     98.0359     145.153     
1 1 1 9  3  48 o 6  241.32  3.03812 1045.01     35.8495  1020.33     37.5885  104.513    184.543     109.031     4.54253     
1 1 1 9  3  49 o 5  238.924 2.93873 1004.59     35.1916  1019.9      35.1805  184.168    307.307     57.9808     307.307     
1 1 1 9  3  50 o 6  588.654 5.90714 6180.9      169.606  6140.5      178.761  398.909    264.586     8.89466     264.586     
1 1 1 9  3  51 o 5  187.423 2.64136 626.423     24.9132  619.27      24.7052  131.53     169.13      24.2597     169.13      
1 1 1 9  3  52 o 12 153.221 2.60069 429.557     20.2269  403.191     19.71    107.33     299.664     27.085      299.664     
1 1 1 9  3  53 o 4  155.536 2.72975 445.34      21.5277  413.222     21.0028  116.71     35.7424     45.8778     35.7424     
1 1 1 9  3  54 o 1  354.685 4.18616 2226.35     74.423   2241.15     74.3918  233.112    315.447     0.0394262   135.408     
1 1 1 9  3  55 o 1  205.971 2.82646 776.424     29.8992  728.846     28.4565  82.7198    25.4008     100.651     205.401     
1 1 1 9  3  56 o 8  246.896 3.3555  1096.06     41.5621  1067.4      41.4687  128.856    343.685     62.0837     163.685     
1 1 1 9  3  57 o 12 89.5375 2.85201 156.75      13.6661  128.919     11.8832  27.3491    69.1462     44.6317     249.146     
1 1 1 9  3  58 o 12 108.768 2.70324 219.399     14.5332  201         14.8529  48.5177    24.5084     30.4537     204.508     
1 1 1 9  3  59 o 9  537.531 5.51883 5178.69     144.721  5111.09     152.452  391.208    352.329     81.7308     352.329     
1 1 1 9  3  60 o 16 401.297 4.40443 2885.41     90.89    2841.34     86.2318  328.471    140.354     137.956     140.354     
1 1 1 9  3  61 o 17 201.296 3.03436 742.234     32.343   696.725     28.8649  153.99     14.8704     54.245      14.8704     
1 1 1 9  3  62 f 0  345.471 4.1059  2133.72     74.9739  2111.97     67.0098  216.185    138.898     0           0           
1 1 1 9  3  63 o 4  107.88  2.89807 218.293     17.0509  195.927     14.2174  64.5828    96.2666     0.0394508   276.266     
1 1 1 9  3  64 o 13 44.4167 3.79169 41.7882     9.1861   29.9289     7.37977  4.53329    262.754     17.949      82.7539     
1 1 1 9  3  65 o 1  139.717 2.78686 347.547     20.5684  346.573     18.3577  110.897    216.083     52.2137     216.083     
1 1 1 9  3  66 o 4  70.7081 2.96812 94.4776     11.1024  84.0695     9.84672  41.1011    28.7353     15.3145     28.7353     
1 1 1 9  3  67 o 10 197.608 2.91511 722.767     29.9199  666.808     27.8278  127.681    314.588     7.48457     314.588     
1 1 1 9  3  68 o 17 42.526  3.81147 32.7232     8.49756  32.8462     7.32498  10.2775    304.116     65.5462     304.116     
1 1 1 9  3  69 o 8  36.8937 4.1916  24.9837     8.06513  24.9249     6.86202  2.38534    274.553     35.5875     274.553     
1 1 1 9  3  70 o 8  28.5577 4.84583 17.1        7.45979  13.4972     6.25269  15.7338    37.2554     54.7634     37.2554     
1 1 1 9  3  71 o 16 157.829 2.82483 453.163     22.5817  435.232     22.0688  99.9853    104.036     5.19419     104.036     
1 1 1 9  3  72 o 10 76.4648 3.03538 104.076     11.8253  105.281     11.3354  52.1198    130.551     14.5669     130.551     
1 1 1 9  3  73 o 19 80.1517 2.91011 130.156     11.874   100.763     11.3402  56.4025    70.5995     17.9303     70.5995     
1 1 1 9  3  74 o 12 12.989  4.06049 -0.930473   6.36465  -1.17341    3.80203  9.31405    249.736     23.616      249.736     
1 1 1 9  3  75 o 13 67.5592 3.30256 79.1867     11.79    85.3655     10.3045  27.1111    249.349     26.0366     69.3493     
1 1 1 9  3  76 f 0  49.6154 4.10377 48.1106     10.1731  42.1912     9.83102  29.7287    276.048     0           0           
1 1 1 9  3  77 o 3  75.4213 2.86699 105.605     12.0291  98.8259     9.48058  52.6821    319.601     17.1608     319.601     
1 1 1 9  3  78 o 16 82.2972 3.47435 111.32      13.855   134.159     14.6385  63.2364    148.593     30.4157     148.593     
1 1 1 9  3  79 o 4  20.1015 5.48899 5.81761     7.87591  4.57519     7.81904  0.0757031  182.705     9.3199      2.70534     
1 1 1 9  3  80 o 15 73.3729 3.47542 99.2921     12.94    96.072      12.4717  45.2234    71.0651     4.62957     71.0651     
1 1 1 9  3  81 o 8  27.3091 5.78927 11.7789     8.67978  16.6339     8.57875  7.95732    237.831     10.2438     57.8313     
1 1 1 9  3  82 o 18 20.8738 5.56415 3.2244      8.07601  9.04895     8.10289  3.40478    175.785     4.66442     355.785     
1 1 1 9  3  83 o 12 39.6669 5.28643 34.8876     9.95877  26.2657     10.2135  22.2585    269.106     2.01048     269.106     
1 1 1 9  3  84 o 19 60.3046 4.32917 69.9552     13.8488  66.2169     11.9135  41.8805    261.91      15.6156     261.91      
1 1 1 9  3  85 o 4  53.6043 5.27405 48.0658     14.4971  63.342      12.2599  25.6884    110.875     9.22662     290.875     
1 1 1 9  3  86 o 16 20.702  6.17091 -0.519332   11.5409  5.56443     10.6282  2.52781    141.814     6.08004     321.814     
1 1 1 9  3  87 o 7  65.6268 5.99513 99.4924     20.073   72.2946     18.2513  45.74      255.031     18.8167     255.031     
1 1 1 9  3  88 o 13 36.8824 7.80573 25.7901     15.9406  33.0759     15.4061  18.5931    5.09308     1.3815      5.09308     
1 1 1 9  3  89 o 16 39.7926 9.30235 51.4267     22.8787  19.5814     23.2718  16.7973    207.146     8.11193     27.1463     
1 1 1 9  3  90 o 13 30.7041 9.12061 -0.0727496  20.9951  29.115      27.1359  11.1307    5.38003     4.87312     5.38003     
1 1 1 9  3  91 o 10 31.7356 11.0209 11.5497     84.0461  -6.80557    26.0615  0.716656   258.393     0.357853    258.393     
1 1 1 9  3  92 x 12 ?       ?       ?           ?        ?           ?        7.35135    27.9341     0           0           
1 1 1 9  3  93 x 19 ?       ?       ?           ?        ?           ?        11.2119    306.112     0           0           
1 1 1 9  3  94 x 15 ?       ?       ?           ?        ?           ?        8.07566    36.4564     0           0           
1 1 1 9  3  95 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  4  0  o 19 36.3913 2.42236 24.0843     4.32245  24.0843     4.32245  123.794    180         257.108     180         
1 1 1 9  4  1  o 1  300.754 3.58107 1595.36     55.3675  1611.25     52.5279  110.765    151.212     177.904     331.212     
1 1 1 9  4  2  o 16 465.767 4.90944 3880.77     117.601  3812.68     111.554  210.327    2.54574     229.426     182.546     
1 1 1 9  4  3  f 0  428.39  4.83192 3296.81     106.777  3211.4      100.668  292.114    226.81      0           0           
1 1 1 9  4  4  o 12 741.359 8.02831 9889.09     316.62   9627.13     279.205  664.021    1.32389     283.695     1.32389     
1 1 1 9  4  5  o 17 407.374 4.96759 2917.21     97.9993  2968.13     104.769  345.098    255.116     153.934     255.116     
1 1 1 9  4  6  o 15 170.376 2.90138 499.105     25.4427  530.357     23.9976  22.6378    230.002     124.819     50.0019     
1 1 1 9  4  7  o 3  517.324 5.8179  4692        150.821  4801.32     150.825  359.981    334.536     0.111687    334.527     
1 1 1 9  4  8  f 0  317.626 3.92338 1798.7      64.272   1777.91     60.5949  305.388    274.848     0           0           
1 1 1 9  4  9  o 13 331.97  3.9781  2010.18     64.1394  1897.52     68.0129  111.478    96.8464     228.431     276.846     
1 1 1 9  4  10 o 15 153.413 2.5566  424.07      19.6566  410.142     19.6506  20.3174    83.2239     49.361      263.224     
1 1 1 9  4  11 o 6  634.747 6.02304 7125.79     186.981  7164.52     196.117  494.671    240.734     97.8581     240.734     
1 1 1 9  4  12 o 3  1056.35 9.45238 19959.3     500.373  19666.7     500.39   764.227    323.572     21.1629     323.572     
1 1 1 9  4  13 o 6  664.423 6.17163 7873.16     195.876  7783.64     214.579  340.646    30.0329     259.677     210.033     
1 1 1 9  4  14 o 10 598.081 5.39042 6345.56     154.678  6337.55     168.158  383.673    30.0071     73.9621     210.007     
1 1 1 9  4  15 o 12 519.569 4.77145 4751.99     118.974  4818.34     129.352  458.554    151.37      201.878     151.37      
1 1 1 9  4  16 o 3  300.284 3.19533 1588.41     46.0487  1607.48     50.0598  95.3527    258.723     215.514     78.7235     
1 1 1 9  4  17 o 2  1153.03 9.86869 23430.4     546.07   23758.8     593.727  866.752    28.7303     91.8408     28.7303     
1 1 1 9  4  18 o 3  728.296 6.5931  9410.22     224.366  9398.59     255.85   578.623    339.986     130.772     339.986     
1 1 1 9  4  19 o 7  337.731 3.58709 2019.56     57.8866  2023.15     63.416   237.629    314.369     24.7979     314.369     
1 1 1 9  4  20 f 0  252.059 3.11621 1067.79     37.3972  1185.45     41.3557  315.258    293.818     0           0           
1 1 1 9  4  21 o 4  1006.62 9.4542  17989.6     452.396  17964.5     500.221  630.603    158.26      166.001     338.26      
1 1 1 9  4  22 o 16 955.266 9.02597 16137.4     409.94   16238       453.288  740.276    203.476     130.325     203.476     
1 1 1 9  4  23 f 0  213.913 2.83434 833.618     29.6289  788.405     31.0651  184.083    353.714     0           0           
1 1 1 9  4  24 o 17 484.33  4.94715 4169.13     113.896  4146.44     125.921  264.339    222.541     145.111     42.5411     
1 1 1 9  4  25 o 13 390.957 4.1639  2727.05     81.5819  2690.81     81.5777  303.396    181.936     77.3446     181.936     
1 1 1 9  4  26 o 15 246.446 3.03547 1074.39     36.5961  1078.18     38.365   133.085    333.436     52.0233     153.436     
1 1 1 9  4  27 o 19 315.101 3.37051 1788.42     52.0317  1730.88     54.3423  168.83     99.0701     85.1807     279.07      
1 1 1 9  4  28 o 19 811.477 7.22616 11816.7     287.302  11539.6     300.101  600.197    97.2446     65.4367     97.2446     
1 1 1 9  4  29 o 10 783.092 7.07903 10974.2     264.747  10776.6     290.046  663.26     225.084     236.718     225.084     
1 1 1 9  4  30 o 8  949.011 8.35397 16227.9     388.363  15731.3     405.715  783.064    63.0406     241.912     63.0407     
1 1 1 9  4  31 o 19 285.204 3.17002 1496.28     44.2266  1387.75     46.2435  210.93     215.746     71.5694     215.746     
1 1 1 9  4  32 o 4  748.559 6.70736 10115.2     245.933  9762.12     256.923  574.018    358.135     112.25      358.135     
1 1 1 9  4  33 o 16 670.6   5.77537 7955.05     190.148  7993.25     197.972  459.538    242.675     7.01365     62.6757     
1 1 1 9  4  34 o 7  514.908 4.55872 4745.22     112.951  4655.19     122.045  323.921    113.195     57.4352     293.195     
1 1 1 9  4  35 o 18 833.397 6.97043 12452.4     279.547  12194.5     301.999  568.119    138.472     18.0637     318.472     
1 1 1 9  4  36 o 13 1058.51 8.52159 19881.1     443.538  19914.6     460.394  767.289    175.612     66.933      175.612     
1 1 1 9  4  37 o 6  542.383 4.57809 5173.93     122.094  5258.52     126.769  466.567    193.682     193.447     193.682     
1 1 1 9  4  38 o 7  450.547 4.00544 3542.68     90.3916  3655.56     90.4689  315.266    165.643     17.648      165.643     
1 1 1 9  4  39 o 4  488.106 4.42997 4196.29     110.56   4253.54     106.083  361.222    267.12      57.7377     267.12      
1 1 1 9  4  40 o 17 593.713 5.30642 6270.77     164.308  6237.16     151.222  397.683    317.588     17.2663     137.589     
1 1 1 9  4  41 o 18 374.486 3.64574 2440.47     71.1128  2533.02     65.4882  248.663    214.596     8.14659     34.5962     
1 1 1 9  4  42 o 5  292.957 3.15834 1491.54     47.316   1551.82     45.3475  215.077    309.472     42.529      309.472     
1 1 1 9  4  43 o 15 271.906 3.2053  1337.77     44.7153  1284.14     42.6421  215.056    294.014     75.6922     294.014     
1 1 1 9  4  44 o 11 56.6257 2.63678 53.2879     7.73375  61.0186     7.05492  6.84596    260.884     24.1698     260.884     
1 1 1 9  4  45 o 7  68.7231 2.37672 84.0816     8.14479  83.7502     8.17629  3.63443    220.066     32.9463     220.066     
1 1 1 9  4  46 o 11 319.006 3.6451  1797.27     61.2115  1812.75     55.1495  223.195    16.3464     23.2551     16.3464     
1 1 1 9  4  47 o 12 432.903 4.52163 3321.64     98.0891  3330.82     98.1004  301.079    336.055     21.2349     336.055     
1 1 1 9  4  48 o 18 105.956 2.44176 205.817     13.2575  192.758     12.6413  37.3813    279.118     48.209      99.118      
1 1 1 9  4  49 o 1  263.643 3.25567 1247.59     43.0207  1218.11     43.0046  149.873    230.73      49.5712     50.7298     
1 1 1 9  4  50 o 8  338.333 3.90371 2032.64     67.9081  2030.06     64.4249  251.121    18.5462     53.3788     18.5462     
1 1 1 9  4  51 o 13 401.779 4.1714  2860.19     85.9599  2870.92     81.9651  291.712    327.973     49.3742     327.973     
1 1 1 9  4  52 o 18 209.874 2.78638 771.259     29.3045  791.061     29.3044  143.84     183.408     17.4356     183.408     
1 1 1 9  4  53 o 18 283.884 3.32829 1444.58     46.5479  1415.12     48.1197  204.912    28.1228     38.8282     28.1228     
1 1 1 9  4  54 o 6  192.354 2.95059 648.038     26.775   664.594     30.0533  81.2021    162.223     85.7477     342.223     
1 1 1 9  4  55 o 11 253.707 3.21161 1152.58     37.7931  1131.52     43.6088  153.209    159.584     22.982      339.584     
1 1 1 9  4  56 o 18 171.679 2.71488 520.943     23.0259  524.551     23.6865  103.991    357.659     7.8104      177.659     
1 1 1 9  4  57 o 17 439.338 5.09824 3473.26     121.731  3392.69     102.114  310.837    168.391     46.5765     168.391     
1 1 1 9  4  58 o 11 321.33  3.72052 1899.2      58.3621  1768.76     61.2659  213.786    172.602     10.5057     172.602     
1 1 1 9  4  59 o 7  389.925 4.17565 2706.71     77.4426  2697.33     85.5311  273.049    200.67      39.3389     200.67      
1 1 1 9  4  60 o 15 250.098 3.34523 1084.81     42.9166  1136.83     40.846   194.098    231.207     68.4743     231.207     
1 1 1 9  4  61 o 13 264.161 3.46736 1216.82     48.3098  1262.66     43.2463  207.873    186.871     77.4669     186.871     
1 1 1 9  4  62 o 16 218.417 3.15423 842.508     35.4061  852.173     33.6103  131.275    312.127     16.4293     132.127     
1 1 1 9  4  63 o 7  313.121 3.81079 1730.83     62.9979  1757.95     56.3556  237.608    131.573     74.0705     131.573     
1 1 1 9  4  64 o 14 171.659 2.83891 523.663     25.0835  523.229     23.7421  126.736    341.513     38.9205     341.513     
1 1 1 9  4  65 o 16 32.3284 4.6309  20.8587     7.78837  17.8518     6.71213  3.86191    74.5492     20.2036     74.5492     
1 1 1 9  4  66 o 16 139.993 2.68576 351.183     19.1441  345.911     18.5041  100.102    175.712     27.9738     175.712     
1 1 1 9  4  67 o 12 18.3131 4.92658 3.58369     6.87466  4.71987     5.68577  4.99591    270.099     12.1175     270.099     
1 1 1 9  4  68 o 7  96.1394 2.76834 164.504     13.9208  164.948     12.6663  50.4558    21.6831     14.2568     201.683     
1 1 1 9  4  69 o 15 117.847 2.94302 257.852     19.197   237.735     15.4329  66.5908    231.509     10.319      51.5089     
1 1 1 9  4  70 o 12 126.675 2.71803 296.344     17.9621  275.831     16.5119  71.4402    21.2846     12.4621     201.285     
1 1 1 9  4  71 f 0  120.294 2.71173 260.421     17.0154  255.739     15.6189  81.0785    257.771     0           0           
1 1 1 9  4  72 o 2  71.4549 3.07499 94.9225     11.8284  88.171      10.0706  41.4342    251.063     2.00295     71.0624     
1 1 1 9  4  73 o 12 115.695 2.78027 240.926     16.5352  237.464     15.651   70.571     26.4996     0.415213    206.5       
1 1 1 9  4  74 o 2  139.717 2.81335 367.31      20.1359  331.331     19.2183  90.6111    356.691     10.0163     356.691     
1 1 1 9  4  75 o 17 84.9862 2.94875 137.086     13.4878  122.345     11.5569  47.655     51.8147     6.70624     231.815     
1 1 1 9  4  76 o 16 48.5665 4.01968 49.7961     10.1333  37.0922     9.02357  20.2091    255.323     14.7951     75.3226     
1 1 1 9  4  77 o 11 21.4452 5.47014 6.58604     7.9864   7.889       7.1153   0.459157   46.9791     15.2222     46.9791     
1 1 1 9  4  78 o 12 43.1821 4.23275 39.636      9.73722  29.7069     8.11086  21.9672    234.547     2.87916     54.5469     
1 1 1 9  4  79 o 1  73.404  3.33734 92.8589     13.1526  102.259     11.0286  40.0722    87.6757     6.31056     267.676     
1 1 1 9  4  80 o 15 31.0825 5.96141 19.6468     10.8989  17.8493     8.18921  8.08321    243.847     16.1754     63.847      
1 1 1 9  4  81 o 8  38.7308 5.33278 37.6751     9.00057  20.6876     10.6511  17.0987    31.5523     8.30469     211.552     
1 1 1 9  4  82 o 2  23.4976 5.67891 13.0682     7.51947  4.97261     9.47874  6.25981    123.769     1.90222     303.769     
1 1 1 9  4  83 o 17 36.8847 5.99759 25.2837     9.73142  28.944      11.9869  21.2122    156.295     4.47127     156.295     
1 1 1 9  4  84 o 11 27.8719 6.46145 17.4936     9.80466  12.2695     11.4108  10.8801    50.1095     3.29675     230.109     
1 1 1 9  4  85 o 17 17.5476 5.50924 -1.15345    8.82536  -2.43455    10.526   0.407764   120.679     3.03325     300.68      
1 1 1 9  4  86 o 4  26.2155 6.78858 14.4298     13.0828  10.7887     10.1989  6.56713    163.849     0.0497283   163.849     
1 1 1 9  4  87 o 9  44.4723 6.81883 54.6275     16.3508  29.2402     13.4928  24.7941    14.1704     3.16116     14.1704     
1 1 1 9  4  88 o 5  51.1394 6.61841 49.6575     17.6566  57.3639     14.6968  23.9501    158.743     8.55759     338.743     
1 1 1 9  4  89 o 13 21.825  6.89157 6.06796     17.3324  -9.26124    13.3793  3.1813     115.249     12.3517     295.249     
1 1 1 9  4  90 o 7  30.2556 8.59836 13.4819     19.3823  19.8329     20.5509  13.0096    355.666     0.884935    175.666     
1 1 1 9  4  91 o 11 39.6603 10.3466 -7.2327     35.3886  71.1903     31.1852  11.5032    147.754     18.8069     327.754     
1 1 1 9  4  92 o 3  33.8339 16.638  0           0        -0.277392   69.6657  8.22313    353.605     1.00003     173.605     
1 1 1 9  4  93 x 3  ?       ?       ?           ?        ?           ?        4.19581    0.279958    0           0           
1 1 1 9  4  94 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  5  0  o 16 264.625 4.05599 1242.76     53.7313  1242.76     53.7313  203.518    180         54.2344     180         
1 1 1 9  5  1  o 13 69.5131 2.90465 78.9816     10.3831  93.1845     9.62881  69.825     140.867     166.088     140.867     
1 1 1 9  5  2  o 1  171.555 3.34551 517.304     29.8071  526.766     27.5982  36.4447    359.413     89.7581     179.413     
1 1 1 9  5  3  f 0  336.164 4.44203 2022.82     74.8312  1983.97     74.8297  269.472    10.0529     0           0           
1 1 1 9  5  4  o 5  205.724 3.28829 751.712     35.0123  748.469     32.7572  63.608     246.767     113.866     66.7673     
1 1 1 9  5  5  o 1  297.518 4.14967 1554.35     61.8669  1583.87     61.8713  222.42     93.4734     86.4893     93.4734     
1 1 1 9  5  6  o 15 502.841 5.21622 4432.22     127.965  4534.43     134.902  372.676    167.06      46.6294     167.06      
1 1 1 9  5  7  o 3  482.872 4.90608 4160.89     118.715  4106.66     118.723  260.887    139.511     153.977     319.511     
1 1 1 9  5  8  o 1  356.797 4.01326 2239.2      73.6022  2273.77     69.8353  235.687    274.042     7.60437     94.0423     
1 1 1 9  5  9  o 15 93.0456 2.42479 154.753     11.5775  152.497     10.9931  66.2016    61.4758     195.268     61.4758     
1 1 1 9  5  10 o 18 807.107 7.48449 11620.2     295.385  11492.3     309.813  513.342    88.6659     122.993     268.666     
1 1 1 9  5  11 o 17 517.001 4.91775 4731.07     127.41   4745.41     127.418  398.807    67.2229     78.2514     67.2229     
1 1 1 9  5  12 o 5  1074.56 9.56707 20462.8     515.177  20528       515.207  750.003    157.98      35.8174     337.98      
1 1 1 9  5  13 o 2  894.692 7.86666 14246.5     360.311  14151.8     345.001  560.945    269.481     153.67      89.4808     
1 1 1 9  5  14 o 7  795.006 7.0611  11234.9     275.112  11181.5     287.367  687.316    73.5412     249.314     73.5412     
1 1 1 9  5  15 o 7  438.069 4.53443 3398.84     99.545   3403.84     99.5482  239.497    91.5581     130.654     271.558     
1 1 1 9  5  16 o 15 982.696 9.46455 17093.5     478.152  17175.4     453.665  671.196    161.068     57.3604     341.068     
1 1 1 9  5  17 o 7  1042.16 9.73985 19210.1     508.648  19332.6     508.709  827.639    245.273     172.461     245.273     
1 1 1 9  5  18 o 14 918.478 8.85235 15022.3     418.074  14906.7     396.647  652.374    220.3       0.192313    220.302     
1 1 1 9  5  19 o 8  805.049 8.01957 11387.6     323.509  11600.9     323.56   657.315    205.847     176.841     205.847     
1 1 1 9  5  20 o 1  507.246 5.23156 4569.52     136.448  4551.81     129.448  268.006    79.9749     174.426     259.975     
1 1 1 9  5  21 o 18 908.842 8.57918 14737.4     370.561  14565       409.705  740.655    21.3127     195.835     21.3127     
1 1 1 9  5  22 o 19 609.06  5.79317 6648.34     172.513  6503.93     180.923  382.833    126.643     89.7901     306.643     
1 1 1 9  5  23 o 17 623.873 5.66549 6898.89     173.23   6900.43     180.949  409.394    212.584     56.8769     32.5837     
1 1 1 9  5  24 o 11 424.551 4.03653 3229.63     83.9702  3159.37     87.703   294.314    322.519     4.34691     322.519     
1 1 1 9  5  25 f 0  239.238 2.79871 998.95      32.1382  1029.61     34.9484  328.604    221.311     0           0           
1 1 1 9  5  26 o 12 438.776 4.24983 3364.57     87.201   3460.16     99.4526  185.391    17.4454     237.422     197.445     
1 1 1 9  5  27 o 2  941.668 8.07559 15749.6     364.835  15709       396.645  693.132    349.006     63.0326     349.006     
1 1 1 9  5  28 o 15 245.122 2.78933 1065.91     32.1354  1063.57     36.2642  93.5094    295.125     130.743     115.125     
1 1 1 9  5  29 o 2  381.817 3.60098 2621.08     67.4843  2546.51     70.2431  351.893    356.953     213.164     356.953     
1 1 1 9  5  30 o 14 120.039 2.22147 263.756     13.0737  247.227     13.6062  51.2102    225.162     227.213     225.162     
1 1 1 9  5  31 o 17 699.343 6.02329 8624.53     206.84   8720.64     215.313  573.359    78.0514     179.956     78.0514     
1 1 1 9  5  32 o 16 793.344 6.77486 11166.6     263.898  11161.2     274.697  688.728    156.108     278.423     156.108     
1 1 1 9  5  33 o 11 982.725 8.2698  17123.7     399.029  17159.7     415.373  823.527    69.3308     280.043     69.3308     
1 1 1 9  5  34 o 2  717.451 6.30839 9158.47     217.11   9102.72     236.062  434.641    257.648     125.455     77.6481     
1 1 1 9  5  35 o 8  76.3657 2.26755 101.614     8.44421  105.455     8.87339  23.252     296.212     84.1942     296.212     
1 1 1 9  5  36 o 17 286.273 3.08744 1453.53     42.4024  1451.53     46.1044  54.7705    303.658     277.762     123.658     
1 1 1 9  5  37 o 19 306.145 3.07768 1655.91     47.187   1666.57     47.2498  182.264    312.225     45.4307     132.225     
1 1 1 9  5  38 o 4  61.4115 2.32676 68.655      6.99499  65.4221     7.26173  57.9151    127.68      164.549     127.68      
1 1 1 9  5  39 o 16 440.486 3.93828 3380.49     86.8864  3500.73     86.967   220.346    106.497     161.402     286.497     
1 1 1 9  5  40 o 14 320.947 3.16162 1818.92     50.8733  1833.17     50.8286  200.47     133.722     30.7221     313.722     
1 1 1 9  5  41 o 17 376.756 3.76167 2491.51     72.5112  2542.76     69.4662  286.291    85.931      64.8852     85.931      
1 1 1 9  5  42 o 10 95.6793 2.27518 161.564     10.7978  163.314     10.9896  21.494     183.386     21.3744     3.38598     
1 1 1 9  5  43 o 12 620.024 5.64769 6778.54     179.172  6874.79     171.656  409.49     105.521     26.0625     285.521     
1 1 1 9  5  44 o 10 101.997 2.18495 170.206     11.478   199.504     10.7037  7.65491    235.072     98.3515     55.0722     
1 1 1 9  5  45 o 2  365.562 3.72836 2336.36     69.9682  2404.67     66.5339  300.291    48.1111     113.61      48.1111     
1 1 1 9  5  46 o 3  461.24  4.50208 3676.89     104.006  3876.08     104.07   327.216    323.475     32.9137     323.475     
1 1 1 9  5  47 o 4  287.008 3.33115 1460.35     46.7363  1461.53     49.0613  179.682    38.5708     22.1817     218.571     
1 1 1 9  5  48 o 4  293.233 3.27534 1526.79     48.1213  1523.33     48.1417  227.805    44.5736     66.9632     44.5736     
1 1 1 9  5  49 o 14 340.423 4.01316 2061.57     68.4452  2051.78     68.4833  234.133    121.373     14.3568     121.373     
1 1 1 9  5  50 o 16 455.448 4.49312 3678.89     102.545  3687.64     102.56   288.463    209.523     32.6666     29.5233     
1 1 1 9  5  51 o 12 306.325 3.44864 1662.42     51.6593  1667.25     54.1953  191.465    162.764     22.4148     342.764     
1 1 1 9  5  52 o 17 114.752 2.51416 238.038     14.0829  229.423     14.7735  0.646399   347.725     142.863     167.725     
1 1 1 9  5  53 o 12 403.227 4.30117 2889.73     86.9199  2885.3      86.9113  343.479    25.8855     155.213     25.8854     
1 1 1 9  5  54 o 8  237.466 3.24525 986.097     36.3694  1015.02     40.8005  141.496    89.7226     25.5337     269.723     
1 1 1 9  5  55 o 11 140.368 2.6401  361.992     17.6402  337.379     19.362   103.949    118.707     44.3303     118.707     
1 1 1 9  5  56 o 19 254.898 3.19904 1132.23     40.8852  1173.71     40.8329  227.568    83.9856     130.156     83.9856     
1 1 1 9  5  57 o 10 109.77  2.55569 210.922     13.2832  216.973     14.7752  58.2565    341.768     10.6863     161.768     
1 1 1 9  5  58 o 7  227.455 3.04539 920.968     32.9378  915.201     36.3917  122.299    71.656      48.4183     251.656     
1 1 1 9  5  59 o 1  323.85  3.50628 1904.74     54.3789  1820.77     59.197   252.822    324.122     86.4902     324.122     
1 1 1 9  5  60 o 15 278.165 3.40208 1324.13     48.4082  1425.37     46.2909  194.052    121.524     29.2904     121.524     
1 1 1 9  5  61 o 8  198.1   2.81522 710.628     29.3292  682.745     26.5454  121.967    311.739     9.01883     131.739     
1 1 1 9  5  62 o 12 174.817 2.78075 537.25      25.1823  548.005     23.4926  140.6      200.215     62.42       200.215     
1 1 1 9  5  63 o 12 27.6026 4.94598 16.2694     7.25487  12.0797     6.48763  21.2081    199.129     60.3519     199.129     
1 1 1 9  5  64 o 10 170.009 2.7857  517.101     23.9838  509.89      23.4838  138.899    165.836     66.3166     165.836     
1 1 1 9  5  65 o 12 134.454 2.72081 346.944     19.0896  297.037     17.5432  83.4358    293.05      0.325568    293.05      
1 1 1 9  5  66 o 4  37.9939 4.29721 28.597      8.02253  24.3252     7.7719   24.023     10.0967     88.6033     10.0967     
1 1 1 9  5  67 o 8  87.3645 2.7729  134.554     12.4283  137.545     11.7725  62.0179    296.929     25.6093     296.929     
1 1 1 9  5  68 o 15 117.333 2.71491 252.714     16.0258  237.891     15.8525  68.9107    349.839     5.40725     169.839     
1 1 1 9  5  69 o 3  117.821 2.73303 253.029     16.194   241.868     16.0337  66.9761    107.817     9.89462     287.817     
1 1 1 9  5  70 o 7  84.7992 3.13705 119.872     14.1503  137.737     12.14    46.5433    312.29      8.00291     132.29      
1 1 1 9  5  71 o 2  31.23   5.01388 13.9018     8.5381   22.5843     6.9586   3.8282     332.461     20.5267     152.461     
1 1 1 9  5  72 o 3  126.972 3.04724 302.773     20.2023  274.343     18.5323  81.6877    95.3361     6.98481     95.3361     
1 1 1 9  5  73 o 6  99.9404 3.32061 172.936     17.9617  185.853     14.9242  72.0501    142.023     23.1867     142.023     
1 1 1 9  5  74 o 11 46.5527 4.08579 40.6371     10.007   38.7531     8.61564  24.5584    200.174     1.8415      20.1735     
1 1 1 9  5  75 o 17 89.6471 3.12134 141.475     14.7923  147.507     13.066   41.2916    81.1814     25.9036     261.181     
1 1 1 9  5  76 o 13 97.5478 2.88668 172.943     14.2773  168.635     13.8841  68.0701    103.09      19.044      103.09      
1 1 1 9  5  77 o 6  133.954 2.91267 320.836     20.2023  323.339     18.8252  81.3875    257.696     0.267731    257.696     
1 1 1 9  5  78 o 11 55.1396 3.50821 56.9807     9.52078  53.6235     9.64734  27.5612    334.022     8.44818     154.022     
1 1 1 9  5  79 o 5  38.5912 4.32711 23.0547     7.90193  32.9429     8.13199  13.8229    216.771     14.8906     36.7713     
1 1 1 9  5  80 o 14 43.7309 4.1766  36.4123     9.60582  34.6315     8.19689  23.8037    330.363     0.973283    150.363     
1 1 1 9  5  81 o 12 25.841  5.16634 6.54254     8.42386  17.6677     6.71577  8.10474    343.644     7.79551     163.644     
1 1 1 9  5  82 o 14 24.3373 5.51437 2.98972     8.30155  17.4783     8.4121   7.56382    180.764     0.80608     0.763575    
1 1 1 9  5  83 o 7  88.3125 3.53994 139.163     14.7668  146.784     16.4268  51.0455    228.047     1.69999     48.0468     
1 1 1 9  5  84 o 5  30.2616 6.02602 26.5849     10.0079  9.30051     10.5464  14.0983    296.678     0.380814    296.678     
1 1 1 9  5  85 o 10 27.1812 6.37033 26.5619     12.5729  -1.77247    10.9284  2.55958    76.6544     22.6469     256.654     
1 1 1 9  5  86 o 18 22.7131 6.52424 8.97383     12.5468  3.79309     10.7056  1.47767    143.811     0.891011    323.811     
1 1 1 9  5  87 o 4  54.0792 6.44597 64.0284     16.9594  54.8731     16.6892  32.677     271.062     6.17046     271.062     
1 1 1 9  5  88 o 9  18.7812 6.07977 -10.2551    14.0351  -2.44141    12.0337  1.52201    26.243      6.47069     206.243     
1 1 1 9  5  89 o 16 23.4953 7.46169 -11.403     20.8709  4.15433     16.8296  4.82425    248.997     10.9597     68.9972     
1 1 1 9  5  90 o 14 24.0991 7.70289 5.54741     21.4589  -8.31086    18.2129  6.86559    104.047     3.51126     284.047     
1 1 1 9  5  91 o 19 37.2889 11.6057 33.988      90.1434  32.7598     23.4302  15.3079    41.1337     5.87058     221.134     
1 1 1 9  5  92 f 0  35.4251 17.4161 0           0        23.8488     76.1799  11.5659    259.54      0           0           
1 1 1 9  5  93 x 1  ?       ?       ?           ?        ?           ?        9.57479    294.083     0           0           
1 1 1 9  5  94 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  6  0  o 3  574.158 5.66939 5846.47     163.056  5846.47     163.056  431.548    360         33.4073     360         
1 1 1 9  6  1  o 12 407.982 4.41667 2957.31     87.8907  2943.66     92.6389  324.516    175.746     96.3358     175.746     
1 1 1 9  6  2  o 5  443.802 4.57636 3509.13     101.782  3473.76     101.78   405.007    288.234     212.438     288.234     
1 1 1 9  6  3  o 14 648.471 6.13204 7446.76     194.483  7467.35     203.97   442.493    102.257     34.8041     282.257     
1 1 1 9  6  4  o 17 220.433 3.09949 850.336     34.237   871.971     34.238   108.685    48.0483     39.3089     228.048     
1 1 1 9  6  5  o 19 893.696 8.89499 14349.2     398.371  14003.2     398.342  674.286    291.011     71.272      291.011     
1 1 1 9  6  6  o 14 416.076 4.35725 3086.7      90.8577  3050.49     90.8487  300.062    70.1495     29.1124     70.1495     
1 1 1 9  6  7  o 1  361.512 3.79386 2278.81     67.093   2354.05     70.3735  107.725    59.932      286.282     239.932     
1 1 1 9  6  8  o 16 543.005 5.42222 5151.33     147.528  5303.79     147.551  389.081    331.556     15.4745     331.556     
1 1 1 9  6  9  o 18 182.987 2.80558 587.04      25.04    599.72      26.4099  17.9036    356.632     188.12      176.632     
1 1 1 9  6  10 o 3  727.416 7.37859 9285.32     253.718  9484.21     283.695  558.664    288.686     84.6036     288.686     
1 1 1 9  6  11 o 5  319.271 3.79999 1750.33     60.7675  1863.61     60.7881  155.451    33.2052     122.512     213.205     
1 1 1 9  6  12 o 2  792.335 8.15403 10983.1     314.176  11289.3     333.305  609.216    16.9462     91.535      16.9462     
1 1 1 9  6  13 o 5  505.45  5.66335 4462.09     143.427  4596.27     143.457  277.522    43.7556     156.189     223.756     
1 1 1 9  6  14 o 13 802.523 8.23737 11369.7     321.403  11476.9     340.971  727.899    280.241     318.78      280.241     
1 1 1 9  6  15 o 11 789.438 8.11627 10897.3     311.573  11210.2     330.559  698.362    19.9824     278.71      19.9824     
1 1 1 9  6  16 o 16 675.391 6.83868 8082.21     231.449  8093.28     231.484  532.675    15.4451     111.577     15.4451     
1 1 1 9  6  17 o 5  1159.99 11.3091 23509.3     657.271  24266.2     657.448  780.289    35.1489     95.1204     215.149     
1 1 1 9  6  18 o 10 1436.73 12.9002 36186.8     906.588  37143.7     950.977  1069.36    357.916     87.3841     357.916     
1 1 1 9  6  19 o 11 1013.36 9.20553 18191.7     456.218  18244.3     478.532  656.093    341.576     129.995     161.576     
1 1 1 9  6  20 o 19 1037.03 9.24885 18978.9     458.359  19180.2     502.178  911.232    213.678     350.847     213.678     
1 1 1 9  6  21 o 6  1299.46 11.4982 29663.1     714.179  30300.4     782.47   947.229    161.357     45.7646     161.358     
1 1 1 9  6  22 o 2  985.791 8.80964 17216       414.959  17263.7     454.616  697.568    283.293     2.5445      103.294     
1 1 1 9  6  23 o 2  159.567 2.40487 450.441     18.8013  451.906     19.652   63.2051    169.285     29.2922     349.285     
1 1 1 9  6  24 o 10 848.967 7.64866 12741.7     325.394  12824.1     325.432  678.842    37.3383     161.257     37.3383     
1 1 1 9  6  25 o 1  263.712 3.02016 1252.69     39.0159  1212.23     40.7557  163.091    30.2644     13.5135     210.264     
1 1 1 9  6  26 o 8  1141.6  10.1664 23112.2     554.534  23156.7     607.543  900.511    122.689     190.453     122.689     
1 1 1 9  6  27 o 9  233.211 2.73741 977.817     30.5996  949.829     33.285   157.087    340.368     76.3535     340.368     
1 1 1 9  6  28 o 1  684.467 6.0523  8234.51     198.815  8379.7      216.167  491.546    289.62      29.2184     289.62      
1 1 1 9  6  29 f 0  222.817 2.72064 889.526     29.0662  870.112     31.6086  144.928    186.318     0           0           
1 1 1 9  6  30 o 3  245.807 2.81686 1069.03     32.5424  1072.44     36.7358  4.32829    94.2364     335.472     94.2364     
1 1 1 9  6  31 o 17 597.965 5.28544 6285.92     148.637  6393.62     167.713  592.979    285.127     371.117     285.127     
1 1 1 9  6  32 o 1  485.694 4.53162 4165.2      105.608  4198.79     114.836  447.243    128.993     237.934     128.993     
1 1 1 9  6  33 o 19 759.159 6.53533 10231.2     233.218  10217.2     263.125  541.016    260.657     26.8235     260.657     
1 1 1 9  6  34 o 4  312.426 3.1505  1692.32     47.4115  1768.15     51.235   235.284    62.0598     57.6773     62.0598     
1 1 1 9  6  35 o 19 206.424 2.56212 737.936     25.4679  772.588     27.5378  119.63     182.434     20.8745     2.43445     
1 1 1 9  6  36 o 10 250.028 2.76244 1119.4      33.2288  1096.59     35.9152  182.291    141.072     41.8157     141.072     
1 1 1 9  6  37 o 9  166.931 2.41699 498.901     18.9214  488.843     21.414   88.6581    242.656     23.8307     62.6562     
1 1 1 9  6  38 o 14 187.751 2.50518 638.514     22.0384  611.152     24.9423  118.221    180.591     2.92145     180.591     
1 1 1 9  6  39 o 12 179.735 2.48306 578.507     20.9261  566.651     23.6892  73.8385    325.426     83.7147     145.426     
1 1 1 9  6  40 o 18 281.157 3.00731 1397.45     39.7267  1405.24     44.876   255.952    340.744     147.533     340.744     
1 1 1 9  6  41 o 7  303.109 3.31062 1639.37     47.911   1618.64     52.5286  218.88     170.109     33.4024     170.109     
1 1 1 9  6  42 o 9  589.309 5.13832 6103.66     145.355  6225.91     157.992  454.251    224.494     104.55      224.494     
1 1 1 9  6  43 o 5  727.947 6.74249 9138.99     234.787  9707.74     257.147  497.234    281.721     0.126478    101.722     
1 1 1 9  6  44 o 10 227.446 2.90517 930.488     33.0547  904.01      33.1661  99.0068    355.667     102.018     175.667     
1 1 1 9  6  45 o 6  630.906 6.18003 7002.7      195.337  7148.19     195.44   455.08     215.12      53.0861     215.12      
1 1 1 9  6  46 o 15 480.721 4.69139 4031.02     112.938  4174.7      113.078  333.913    118.096     18.0614     118.096     
1 1 1 9  6  47 o 16 224.421 2.91439 878.712     31.9185  907.581     33.6347  110.881    6.32558     75.6065     186.326     
1 1 1 9  6  48 o 7  252.708 3.1107  1141.76     38.3627  1123.5      40.3825  181.296    158.172     28.7959     158.172     
1 1 1 9  6  49 o 13 233.779 2.98509 956.436     34.035   982.168     35.9047  172.571    304.392     39.1949     304.392     
1 1 1 9  6  50 o 7  554.118 5.68567 5424.19     153.672  5496.42     162.039  440.268    17.9935     137.74      17.9935     
1 1 1 9  6  51 o 15 127.234 2.72081 290.373     16.1917  284.331     18.3711  91.326     312.463     53.9711     312.463     
1 1 1 9  6  52 f 0  248.05  3.21895 1104.41     38.911   1078.83     41.0589  127.065    214.336     0           0           
1 1 1 9  6  53 o 12 195.216 2.89115 667.957     27.5078  684.017     29.0551  120.949    41.1208     8.93697     221.121     
1 1 1 9  6  54 o 15 226.46  3.11083 890.772     32.4008  929.151     38.0862  154.957    311.65      17.4327     311.65      
1 1 1 9  6  55 o 19 473.172 5.44192 3923.05     120.732  4044.69     137.056  348.497    0.0985715   72.5296     0.0985715   
1 1 1 9  6  56 o 15 19.3243 4.93038 6.17596     6.12659  4.80529     6.12319  14.2114    356.883     30.7563     356.883     
1 1 1 9  6  57 o 18 163.672 2.75389 465.957     21.9209  484.591     23.2554  103.911    229.375     2.62471     229.375     
1 1 1 9  6  58 o 15 81.2404 2.90374 118.72      11.804   116.118     11.7626  21.0431    115.986     140.605     115.986     
1 1 1 9  6  59 f 0  407.57  4.65196 3004.1      83.7426  2908.79     104.745  218.557    165.8       0           0           
1 1 1 9  6  60 o 16 283.157 3.38236 1402.97     45.5619  1445.8      50.3734  181.447    315.172     3.73706     135.171     
1 1 1 9  6  61 o 12 49.1739 3.66963 32.6859     8.80594  55.8274     8.24242  12.0299    207.473     76.9635     207.473     
1 1 1 9  6  62 o 1  190.224 2.85581 640.772     27.1423  644.612     27.3062  146.572    354.708     52.4974     354.708     
1 1 1 9  6  63 f 0  104.803 2.5652  198.606     13.2937  191.959     13.601   79.437     139.736     0           0           
1 1 1 9  6  64 o 13 239.072 3.21354 1020.41     35.5963  1012.9      41.179   188.895    61.4901     73.8928     61.4901     
1 1 1 9  6  65 o 2  148.967 2.96396 392.768     21.553   397.227     22.6489  104.843    85.1844     24.1926     85.1844     
1 1 1 9  6  66 o 4  53.581  3.63275 56.0326     9.90347  47.4666     9.35113  18.7097    99.7116     4.24501     99.7116     
1 1 1 9  6  67 o 2  143.625 3.11437 371.368     21.7892  364.331     22.961   99.1434    272.815     20.571      272.815     
1 1 1 9  6  68 o 7  187.945 3.16948 648.251     29.9984  611.689     29.6952  143.795    270.426     53.2872     270.426     
1 1 1 9  6  69 f 0  21.3355 4.98331 13.8745     7.39966  -0.468978   6.53297  26.7249    34.7369     0           0           
1 1 1 9  6  70 o 13 87.0309 3.20049 137.77      14.4932  133.486     13.319   34.9749    92.7075     36.2061     272.708     
1 1 1 9  6  71 o 9  92.1366 2.88766 160.53      13.2352  143.277     13.3259  65.4452    230.356     19.2188     230.356     
1 1 1 9  6  72 o 6  52.2732 3.63279 44.3397     9.50431  54.9233     9.13102  27.3544    308.73      4.83664     128.73      
1 1 1 9  6  73 o 15 22.9    5.31073 7.7883      7.44751  10.5059     6.74961  9.44138    2.24854     40.8598     2.24854     
1 1 1 9  6  74 o 3  114.585 2.84726 232.208     17.2713  238.233     15.2852  79.7119    240.308     19.7725     240.308     
1 1 1 9  6  75 o 8  87.3256 3.07569 139.092     13.9072  135.166     12.9211  38.0238    321.906     29.7448     141.906     
1 1 1 9  6  76 o 10 64.2742 3.2224  75.371      10.2754  73.8757     10.3472  28.5672    108.274     19.0148     288.275     
1 1 1 9  6  77 o 5  58.5702 3.25446 59.7161     9.60313  64.5118     9.32132  34.7069    29.2492     1.74897     29.2492     
1 1 1 9  6  78 o 16 77.546  3.14757 100.519     12.3147  116.884     11.9576  36.6418    286.171     19.2012     106.171     
1 1 1 9  6  79 o 3  47.1577 3.59362 34.1261     8.20506  47.8556     8.3003   32.1264    93.632      12.9209     93.632      
1 1 1 9  6  80 o 7  76.5804 2.96678 105.472     10.9789  106.489     11.6965  50.0896    161.861     9.78699     161.861     
1 1 1 9  6  81 o 8  41.5345 5.03649 23.5015     10.0914  43.7534     9.52631  26.0811    30.2175     7.47886     30.2175     
1 1 1 9  6  82 o 12 83.0245 3.40288 138.631     14.2966  113.836     13.8311  50.8743    67.963      3.92542     67.963      
1 1 1 9  6  83 o 14 21.0211 5.97522 5.53033     8.32366  4.82924     10.9908  2.50556    64.5916     1.60278     244.592     
1 1 1 9  6  84 o 8  38.2428 6.16858 30.2926     10.1566  28.8089     12.9902  21.9084    193.219     4.37133     193.219     
1 1 1 9  6  85 f 0  42.9304 6.43885 42.3268     13.2289  33.1277     13.6364  20.3787    19.1225     0           0           
1 1 1 9  6  86 o 6  47.1929 6.06167 33.3652     13.894   57.4348     13.241   28.0287    137.784     5.68009     137.784     
1 1 1 9  6  87 o 15 32.1062 7.16661 7.32908     15.3495  32.1983     13.5904  14.5891    349.266     5.73202     349.266     
1 1 1 9  6  88 o 6  24.5887 7.01732 6.74801     14.0828  9.72333     12.7149  7.22408    259.699     6.68896     79.6993     
1 1 1 9  6  89 o 16 29.4216 7.75719 6.91816     18.8664  22.6884     14.1303  12.9246    167.126     0.150535    347.126     
1 1 1 9  6  90 o 10 25.2344 7.49193 -11.1038    18.5662  17.5938     16.564   3.88568    210.984     0.921206    210.984     
1 1 1 9  6  91 o 11 30.79   8.74858 -17.5062    34.0144  30.6557     18.6166  12.0617    80.2838     2.28966     260.284     
1 1 1 9  6  92 o 7  47.425  14.5474 247.608     98.4331  65.6688     37.4233  26.113     102.119     12.419      102.119     
1 1 1 9  6  93 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  7  0  o 19 973.429 8.34146 16807.3     406.783  16807.3     406.783  827.112    2.16594e-06 246.502     2.16594e-06 
1 1 1 9  7  1  o 18 559.199 5.0478  5568.7      141.459  5517.64     141.456  293.35     11.8668     207.086     191.867     
1 1 1 9  7  2  o 2  177.379 2.57035 550.037     22.8413  565.087     22.8525  59.0398    322.051     71.3459     142.051     
1 1 1 9  7  3  o 15 124.637 2.40545 283.031     15.374   268.015     14.6497  8.7897     72.9953     117.53      72.9953     
1 1 1 9  7  4  o 16 435.52  4.74452 3381.3      103.553  3342.93     103.549  277.417    161.495     52.3109     341.495     
1 1 1 9  7  5  o 13 406.829 4.76337 2943.36     97.1129  2924.03     97.1163  337.535    26.5673     121.422     26.5673     
1 1 1 9  7  6  o 8  146.633 2.85015 381.449     20.9212  381.151     20.927   12.7012    74.3481     191.092     74.3481     
1 1 1 9  7  7  o 2  89.8547 2.75314 152.268     11.9167  134.684     12.7193  59.5607    227.046     183.872     227.046     
1 1 1 9  7  8  o 1  715.37  7.87619 9052.78     291.585  9100.49     272.775  504.058    156.563     11.133      336.563     
1 1 1 9  7  9  o 15 208.318 3.46087 776.691     33.4199  761.928     38.5696  6.96217    64.2927     289.464     64.2927     
1 1 1 9  7  10 o 10 855.966 9.57066 13202.8     410.56   12799.5     410.453  553.278    187.029     117.848     7.02879     
1 1 1 9  7  11 o 11 613.05  6.47778 6684.44     193.064  6642.2      204.753  394.003    217.601     81.624      37.6006     
1 1 1 9  7  12 o 4  771.519 7.73165 10566.6     298.936  10545.6     298.938  559.351    124.8       19.5169     124.8       
1 1 1 9  7  13 o 5  88.0321 2.36946 132.095     10.4269  143.052     10.4289  72.7289    344.937     219.802     344.937     
1 1 1 9  7  14 o 6  182.605 2.71129 593.402     24.8091  588.329     24.8129  34.3492    28.2973     158.558     208.297     
1 1 1 9  7  15 o 8  739.549 7.05769 9722.84     261.57   9672.75     261.571  638.605    279.708     229.526     279.708     
1 1 1 9  7  16 o 15 524.486 5.2292  4882.89     137.444  4869.05     137.446  216.651    226.428     308.254     46.4279     
1 1 1 9  7  17 o 10 728.462 6.80628 9483.97     254.362  9334.02     242.523  563.468    187.578     94.5379     187.578     
1 1 1 9  7  18 o 3  592.251 5.64483 6266.57     171.514  6169.36     163.524  469.313    179.255     105.804     179.255     
1 1 1 9  7  19 o 15 1006.7  9.00075 18089.8     474.381  17869.5     433.091  585.976    109.354     262.758     289.354     
1 1 1 9  7  20 o 1  403.528 3.9562  2866.44     81.7075  2905.33     78.2369  152.673    233.371     258.318     53.3711     
1 1 1 9  7  21 o 17 213.534 2.61927 798.212     28.0177  817.798     28.0374  97.8707    264.523     75.6741     84.5225     
1 1 1 9  7  22 o 17 429.047 4.07078 3241.69     87.5201  3283.34     87.5316  392.154    239.624     202.621     239.624     
1 1 1 9  7  23 o 16 785.171 6.8009  11022.9     267.588  10841.1     267.605  468.519    124.963     172.839     304.963     
1 1 1 9  7  24 o 11 915.778 7.83174 14983.9     359.401  14767.9     359.436  717.835    308.494     142.724     308.494     
1 1 1 9  7  25 o 2  321.406 3.29679 1853.15     53.1025  1808.35     53.0944  245.352    40.2813     70.8501     40.2813     
1 1 1 9  7  26 o 5  645.724 5.70559 7418.8      184.622  7366.19     184.641  531.75     72.2985     164.463     72.2985     
1 1 1 9  7  27 o 12 412.3   3.94148 3026.34     81.4386  2999.47     81.4383  298.134    183.644     37.6263     183.644     
1 1 1 9  7  28 f 0  447.513 4.12972 3575.6      90.731   3523.9      94.4335  321.18     32.5658     0           0           
1 1 1 9  7  29 o 11 548.331 4.87051 5327.91     131.13   5332.54     136.493  286.056    206.224     189.779     26.2235     
1 1 1 9  7  30 o 11 270.705 2.99158 1304.83     40.5834  1292.57     40.5844  113.306    111.365     131.775     291.365     
1 1 1 9  7  31 o 3  275.045 2.99932 1349.32     40.4977  1332.11     42.1567  234.005    100.881     141.086     100.881     
1 1 1 9  7  32 o 12 187.745 2.44861 604.004     22.1604  645.626     23.9218  112.936    305.085     15.9377     305.085     
1 1 1 9  7  33 o 17 1129.92 9.0891  22585       505.076  22784.6     524.161  822.464    77.7095     64.7176     77.7095     
1 1 1 9  7  34 o 3  364.079 3.42734 2320.61     61.3706  2378.83     63.6967  217.886    291.503     60.8294     111.503     
1 1 1 9  7  35 o 2  104.147 2.25712 203.02      11.0052  182.066     12.3842  17.526     222.059     47.3868     42.059      
1 1 1 9  7  36 f 0  343.611 3.44384 2114.7      55.6102  2071.54     62.7035  209.95     177.05      0           0           
1 1 1 9  7  37 o 5  355.911 3.44221 2250.67     58.9834  2240.74     63.7066  225.7      356.028     32.8499     176.028     
1 1 1 9  7  38 o 1  388.67  3.65679 2699.34     68.4139  2657.77     73.8878  329.714    117.843     132.903     117.843     
1 1 1 9  7  39 o 3  207.557 2.5763  766.112     25.744   761.084     27.8042  71.2163    198.071     132.59      18.0709     
1 1 1 9  7  40 o 3  284.081 3.13115 1447.36     44.5842  1414.34     44.5647  217.78     312.479     58.5897     312.479     
1 1 1 9  7  41 o 11 473.845 4.51038 3977.48     99.8817  3990.48     113.89   364.626    352.878     83.9705     352.878     
1 1 1 9  7  42 o 5  316.774 3.27807 1760.24     49.8144  1798.65     54.2134  274.706    230.894     130.243     230.894     
1 1 1 9  7  43 o 5  137.891 2.29154 329.097     15.1487  345.061     16.5179  84.5763    190.447     36.3261     190.447     
1 1 1 9  7  44 o 5  355.766 3.61206 2232.63     62.2611  2257.49     66.4895  213.356    318.899     53.4498     138.899     
1 1 1 9  7  45 f 0  242.191 2.82673 1030.57     33.096   1049.53     35.4991  133.399    282.085     0           0           
1 1 1 9  7  46 o 14 144.635 2.3316  370.221     17.2158  371.461     16.5772  89.4724    341.423     1.89039     161.423     
1 1 1 9  7  47 o 8  281.126 3.46029 1454.07     47.3815  1350.87     49.9407  205.023    359.482     35.5238     359.482     
1 1 1 9  7  48 o 6  189.157 2.80348 635.919     26.5958  633.062     26.555   141.232    157.564     39.2577     157.564     
1 1 1 9  7  49 o 17 450.82  4.52819 3612.91     104.647  3605.83     99.9079  294.352    324.621     17.0575     144.621     
1 1 1 9  7  50 o 6  348.646 3.69601 2140.04     64.5192  2174.43     64.6325  295.047    217.344     127.664     217.344     
1 1 1 9  7  51 o 12 86.8255 2.49402 133.051     10.7041  134.74      10.9545  34.57      179.868     17.6693     359.868     
1 1 1 9  7  52 o 7  330.994 3.743   1925.83     61.9951  1963.65     62.1761  222.014    44.2467     5.89748     44.2467     
1 1 1 9  7  53 o 1  144.857 2.60238 348.626     19.1308  396.677     18.529   111.41     198.397     52.2659     198.397     
1 1 1 9  7  54 o 9  293.991 3.34936 1525.23     48.1403  1542.45     50.536   201.785    181.255     18.084      181.255     
1 1 1 9  7  55 o 10 331.261 3.8209  1914.13     61.6663  1983.22     65.1924  223.718    312.145     12.3575     312.145     
1 1 1 9  7  56 o 8  145.368 2.75443 376.557     19.5298  373.727     20.5487  79.2409    101.542     23.229      281.542     
1 1 1 9  7  57 o 2  63.1784 2.96001 69.6167     9.30316  72.6823     9.33184  10.3004    269.126     90.1268     269.126     
1 1 1 9  7  58 f 0  95.2734 2.79326 169.101     12.9654  153.789     13.5888  23.2124    217.42      0           0           
1 1 1 9  7  59 o 17 216.132 3.14842 851.252     32.2959  808.014     35.7135  140.879    169.138     3.24161     169.138     
1 1 1 9  7  60 o 7  418.22  4.33903 3168.11     84.3053  3059.61     96.8891  347.854    157.705     151.543     157.705     
1 1 1 9  7  61 o 5  263.216 3.45968 1236.85     45.6676  1226.76     45.6042  188.844    180.042     38.3718     180.042     
1 1 1 9  7  62 o 6  147.715 2.90762 396.992     20.8934  379.032     22.0603  104.381    131.566     24.0325     131.566     
1 1 1 9  7  63 o 7  17.1118 4.72999 -0.719273   6.50775  5.44654     5.77548  31.9874    19.1288     72.4277     19.1288     
1 1 1 9  7  64 o 15 180.175 2.94039 565.784     26.6323  588.865     26.4552  118.815    211.679     9.51855     211.679     
1 1 1 9  7  65 o 18 81.0259 2.91215 113.971     11.7255  120.254     11.8431  43.0305    229.134     9.1244      49.1341     
1 1 1 9  7  66 o 19 133.089 2.80638 321.967     18.9212  309.026     18.4725  92.1238    41.2259     19.7755     41.2259     
1 1 1 9  7  67 o 12 69.1954 2.91754 88.9258     9.75026  82.2913     10.3457  14.5686    57.5805     52.6581     237.581     
1 1 1 9  7  68 o 16 44.1617 3.50716 40.9998     7.71219  29.9719     7.41671  9.67236    342.352     23.1199     162.352     
1 1 1 9  7  69 f 0  72.7935 3.03811 95.9675     11.5131  93.7487     10.5421  49.4276    310.195     0           0           
1 1 1 9  7  70 o 5  77.2006 2.72978 115.838     11.1362  97.5794     9.92975  54.7657    124.295     17.524      124.295     
1 1 1 9  7  71 o 2  32.1312 4.91364 23.2034     7.90005  15.8167     7.51493  3.54939    129.568     26.155      309.568     
1 1 1 9  7  72 o 11 64.9379 3.42315 73.6982     10.9179  78.4196     11.2004  46.174     188.692     17.2543     188.692     
1 1 1 9  7  73 o 19 139.983 2.86203 360.168     20.3252  341.588     19.7877  70.3727    68.5108     32.3766     248.511     
1 1 1 9  7  74 o 2  72.8918 3.38478 96.4355     11.9569  95.4123     12.6205  52.7577    91.9462     19.7097     91.9462     
1 1 1 9  7  75 o 13 37.5773 5.59521 23.0533     10.6756  31.0036     9.72603  11.3029    294.797     18.3906     114.797     
1 1 1 9  7  76 o 16 81.2139 3.4704  137.676     13.0842  102.221     14.5061  60.6481    356.921     25.1234     356.921     
1 1 1 9  7  77 o 13 130.513 3.35824 306.299     20.4898  308.61      23.2805  94.7615    144.263     31.3611     144.263     
1 1 1 9  7  78 f 0  43.8882 3.62975 26.8582     7.23648  44.9216     8.19791  42.1219    197.685     0           0           
1 1 1 9  7  79 o 5  23.9458 5.14909 15.6334     6.64186  3.46255     8.37538  4.63395    279.488     12.7541     99.488      
1 1 1 9  7  80 o 18 27.2791 5.70246 13.2703     8.61769  15.415      8.11673  8.37055    271.99      10.3402     91.9902     
1 1 1 9  7  81 o 17 72.5559 3.47248 97.4022     12.8148  95.175      12.2877  49.2676    252.682     13.457      252.682     
1 1 1 9  7  82 o 15 45.8496 4.65493 28.4201     10.0457  53.1771     9.78637  14.2299    7.25661     24.245      187.257     
1 1 1 9  7  83 o 16 26.9418 6.22048 13.6909     8.7258   14.6215     10.6207  10.4617    273.439     0.37542     273.439     
1 1 1 9  7  84 f 0  24.6453 6.46706 8.35952     10.7862  12.4431     10.6109  16.9691    221.296     0           0           
1 1 1 9  7  85 o 18 21.5    6.11253 10.3661     10.5293  -0.752432   10.4131  2.82083    194.06      8.48904     14.0597     
1 1 1 9  7  86 o 9  21.5578 6.21212 4.32992     10.5931  6.39188     10.5777  3.0024     216.852     7.26445     36.8517     
1 1 1 9  7  87 o 10 25.4465 6.67388 11.9615     11.3423  11.1276     11.2999  6.87271    126.194     9.36379     306.194     
1 1 1 9  7  88 o 19 28.3681 6.92541 7.18899     12.0229  23.8256     13.1121  9.38876    31.9188     4.30416     31.9188     
1 1 1 9  7  89 o 10 52.5269 7.5059  53.5377     20.6981  66.1043     17.2399  29.3279    287.993     0.863301    287.993     
1 1 1 9  7  90 o 14 34.3622 8.58246 23.7971     17.5851  31.635      19.334   16.3108    307.529     0.197233    127.529     
1 1 1 9  7  91 o 6  32.4454 9.73814 46.5112     34.9747  9.87605     18.7797  12.8854    188.546     1.4774      8.54586     
1 1 1 9  7  92 o 8  41.2056 11.6704 80.8247     38.5818  38.6804     37.1305  20.215     25.5695     8.40705     25.5695     
1 1 1 9  7  93 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  8  0  o 17 419.014 4.91007 3113.95     103.04   3113.95     103.04   326.136    180         45.8192     180         
1 1 1 9  8  1  o 11 188.927 3.31556 633.613     31.3957  631.447     31.3873  52.2914    140.195     128.004     320.195     
1 1 1 9  8  2  o 10 995.251 11.1215 17745.1     554.693  17424.8     554.669  842.148    316.089     255.484     316.089     
1 1 1 9  8  3  o 11 467.588 6.46051 3817.91     144.434  3935.35     158.21   338.367    34.7687     21.4943     34.7687     
1 1 1 9  8  4  o 6  850.299 9.24082 12748.4     380.479  12906.8     406.772  648.887    150.91      79.3715     150.91      
1 1 1 9  8  5  o 12 219.076 3.51888 859.689     38.6308  841.417     38.6321  58.4046    213.483     169.544     33.4827     
1 1 1 9  8  6  o 17 131.731 2.56818 307.266     17.3732  308.19      16.4896  13.8737    325.299     167.56      325.299     
1 1 1 9  8  7  o 17 608.962 5.93825 6623.25     181.222  6524.93     181.213  477.018    133.118     90.8051     133.118     
1 1 1 9  8  8  o 18 692.615 6.64983 8433.47     230.802  8577.41     230.814  382.93     333.659     224.18      153.659     
1 1 1 9  8  9  o 12 593.308 5.79203 6295.88     172.214  6184.65     172.206  470.984    232.792     102.584     232.792     
1 1 1 9  8  10 o 17 929.564 9.13958 15303.6     425.756  15354.8     425.766  718.498    21.8185     105.625     21.8185     
1 1 1 9  8  11 o 18 367.307 4.17007 2373.5      76.7565  2408.65     76.7598  173.725    290.429     163.746     110.429     
1 1 1 9  8  12 o 14 399.025 4.20119 2795.96     84.0054  2847.81     84.0098  227.29     190.502     101.843     10.5023     
1 1 1 9  8  13 o 5  532.923 5.29585 5031.76     141.436  5036.63     141.436  446.504    73.8665     145.458     73.8665     
1 1 1 9  8  14 o 2  97.6182 2.37793 169.849     11.6194  168.264     11.6116  17.9659    14.2443     94.0338     14.2443     
1 1 1 9  8  15 o 6  177.664 2.64006 571.123     24.0689  547.644     22.945   87.8374    257.931     5.09988     77.9306     
1 1 1 9  8  16 f 0  532.359 5.03236 5018.81     134.257  5028.07     134.257  427.925    37.2213     0           0           
1 1 1 9  8  17 o 19 489.429 4.69888 4260.96     115.253  4230.52     115.248  393.319    73.628      103.24      73.628      
1 1 1 9  8  18 o 3  731.693 6.88327 9534.74     246.306  9452.01     258.289  499.037    246.563     41.4308     66.5628     
1 1 1 9  8  19 o 14 1250.7  11.3728 27905.1     695.618  27647.8     729.449  925.38     303.858     65.0539     303.858     
1 1 1 9  8  20 o 19 352.265 3.76793 2186.95     64.923   2211.44     68.0893  293.658    92.7389     116.305     92.7389     
1 1 1 9  8  21 o 14 186.035 2.73551 611.928     25.5076  614.649     25.4986  32.9801    208.981     168.977     28.981      
1 1 1 9  8  22 o 7  1171.8  10.9655 24342.3     643.932  24422.9     643.943  949.787    35.4039     234.598     35.4039     
1 1 1 9  8  23 o 5  331.854 3.71465 1962.91     61.7762  1940.62     61.7761  219.194    349.901     6.7394      169.901     
1 1 1 9  8  24 o 14 469.789 4.82288 3918.54     113.546  3905.91     113.545  305.217    148.146     40.1294     328.146     
1 1 1 9  8  25 o 18 668.212 6.34941 7898.89     207.51   7936.98     217.636  561.698    305.951     190.593     305.951     
1 1 1 9  8  26 o 7  412.004 4.24844 3047.69     85.5777  2970.14     89.745   311.117    42.2591     64.6213     42.2591     
1 1 1 9  8  27 o 4  110.578 2.48045 236.048     13.3256  198.556     13.9865  50.1305    212.068     210.572     212.068     
1 1 1 9  8  28 o 9  414.862 4.261   3068.69     86.4403  3033.06     90.6585  327.998    350.785     93.3843     350.785     
1 1 1 9  8  29 o 19 463.277 4.67055 3856.13     105.782  3754.23     110.942  289.695    338.466     60.5429     158.466     
1 1 1 9  8  30 o 18 789.729 7.2346  11080.6     286.312  11054.5     286.33   427.73     248.943     252.408     68.9435     
1 1 1 9  8  31 o 1  189.108 2.603   649.208     25.1947  618.519     24.146   119.227    205.346     21.8736     205.346     
1 1 1 9  8  32 o 9  413.631 4.17885 2994.36     86.6023  3072.47     86.632   365.224    94.0667     168.149     94.0667     
1 1 1 9  8  33 o 3  701.153 6.52029 8717.89     239.263  8732.19     218.46   426.07     265.348     126.083     85.348      
1 1 1 9  8  34 o 15 563.788 5.50967 5627.79     159.322  5650.53     151.912  352.592    47.8068     77.3854     227.807     
1 1 1 9  8  35 o 9  318.249 3.43584 1777.33     55.9482  1813.81     53.5934  198.865    46.0154     34.1935     226.015     
1 1 1 9  8  36 o 12 90.4562 2.50014 145.674     10.4612  144.812     12.0965  28.3251    223.332     158.179     223.332     
1 1 1 9  8  37 o 4  759.409 6.70211 10100.4     244.319  10388.6     265.621  591.609    184.265     130.534     184.265     
1 1 1 9  8  38 o 5  306.043 3.16655 1674.92     47.5735  1646.22     49.5186  196.39     34.9948     21.0079     214.995     
1 1 1 9  8  39 o 13 81.1647 2.30983 114.174     9.16764  119.764     9.58575  20.5632    265.11      125.653     265.11      
1 1 1 9  8  40 o 18 208.218 2.89247 768.091     30.1754  769.16      30.1883  95.5239    218.211     83.1665     38.2114     
1 1 1 9  8  41 o 18 125.58  2.27059 272.934     14.5528  286.41      13.9871  61.6348    128.037     19.9348     128.037     
1 1 1 9  8  42 o 19 69.2892 2.26032 91.4359     7.79925  79.341      7.82338  7.97971    9.83483     66.6636     9.83483     
1 1 1 9  8  43 o 13 93.6825 2.27383 155.786     11.0908  155.72      10.2096  6.2914     110.878     94.4725     290.878     
1 1 1 9  8  44 o 11 272.769 3.01875 1291.61     39.5036  1347.41     43.0123  157.978    100.893     50.0573     280.893     
1 1 1 9  8  45 o 9  48.5244 2.56347 43.9387     5.9259   40.0639     6.40629  2.82921    141.131     15.1777     141.131     
1 1 1 9  8  46 o 11 361.75  3.48445 2277.01     60.4955  2366.49     65.8148  260.94     183.936     33.9535     183.936     
1 1 1 9  8  47 o 5  290.289 3.28818 1542.49     48.7328  1447.87     46.9413  182.258    199.114     24.2206     19.1136     
1 1 1 9  8  48 o 16 292.95  3.38886 1555.34     49.0543  1490.11     50.3939  218.567    17.3518     47.1961     17.3518     
1 1 1 9  8  49 o 5  187.979 2.64025 642.466     25.4883  610.947     24.2601  76.3079    154.504     93.9743     334.504     
1 1 1 9  8  50 o 15 259.75  3.24338 1193.94     42.2139  1200.1      42.2248  155.153    8.85966     33.4545     188.86      
1 1 1 9  8  51 o 19 234.543 3.19042 963.986     36.4899  988.046     38.5033  146.148    196.002     15.4561     16.0021     
1 1 1 9  8  52 o 3  87.8154 2.70671 143.926     11.67    130.303     12.0508  29.6633    157.832     36.7021     337.832     
1 1 1 9  8  53 o 10 301.715 3.73439 1603.44     59.3802  1628.84     53.3359  229.353    82.8013     62.1011     82.8013     
1 1 1 9  8  54 o 17 31.3637 4.55084 16.4988     7.20128  19.7623     6.60888  25.0421    240.406     63.7096     240.406     
1 1 1 9  8  55 o 9  230.597 2.99314 925.63      35.2218  961.572     33.9097  180.37     240.871     63.3744     240.871     
1 1 1 9  8  56 o 16 356.974 4.76087 2263.23     85.2108  2270.5      85.128   273.303    306.602     78.0994     306.602     
1 1 1 9  8  57 o 12 25.9971 5.15691 7.36908     7.45507  16.8426     7.14285  14.9013    256.776     36.94       256.776     
1 1 1 9  8  58 o 1  63.002  3.28107 64.3535     10.1968  77.7122     10.312   11.1124    150.859     1.96825     150.859     
1 1 1 9  8  59 o 10 105.164 3.17233 212.02      17.0078  182.135     16.3246  55.2152    100.337     18.5049     280.337     
1 1 1 9  8  60 o 11 179.606 3.04439 585.504     26.8012  560.748     27.9557  132.961    242.135     37.2064     242.135     
1 1 1 9  8  61 o 7  159.832 2.87689 448.127     23.0549  460.145     22.9907  129.174    259.598     58.0589     259.598     
1 1 1 9  8  62 o 17 132.003 2.68901 313.157     17.7713  306.439     17.7667  58.6395    351.561     49.3788     171.561     
1 1 1 9  8  63 o 3  50.248  3.42665 42.2663     8.7253   48.5677     8.23251  3.31964    11.1072     47.3146     191.107     
1 1 1 9  8  64 f 0  121.357 2.63711 264.968     16.4273  259.121     15.608   51.9409    20.3748     0           0           
1 1 1 9  8  65 o 7  185.92  2.91429 599.24      27.8631  631.403     26.3686  142.897    246.682     51.2215     246.682     
1 1 1 9  8  66 o 12 166.104 2.74123 495.707     23.9826  486.442     21.6126  131.519    263.699     55.6183     263.699     
1 1 1 9  8  67 o 16 76.1841 2.97158 103.793     12.0398  103.699     10.5079  39.1159    317.686     10.589      137.686     
1 1 1 9  8  68 o 16 60.4267 3.18269 67.9514     9.71683  63.1441     9.41921  37.4531    168.769     12.1194     168.769     
1 1 1 9  8  69 o 3  14.6815 4.36792 -3.03578    6.13972  2.53953     5.21029  5.23468    68.9039     13.5595     68.9039     
1 1 1 9  8  70 o 13 96.5279 2.88638 176.649     13.7283  156.907     14.072   62.8206    349.672     6.99676     349.672     
1 1 1 9  8  71 o 13 92.7724 2.77941 142.131     12.3544  166.284     13.4335  71.1228    38.8945     29.7613     38.8945     
1 1 1 9  8  72 o 12 55.2074 2.93639 56.8196     8.47922  52.8806     7.64997  21.3552    283.894     22.6338     103.894     
1 1 1 9  8  73 f 0  119.045 2.92849 248.356     16.7779  259.942     18.1084  81.9087    308.771     0           0           
1 1 1 9  8  74 o 5  125.07  2.95586 279.216     19.4263  282.264     17.5108  102.037    152.358     51.4055     152.358     
1 1 1 9  8  75 o 10 91.5671 2.87422 152.54      13.9157  148.707     12.3671  59.9616    215.071     9.24333     215.071     
1 1 1 9  8  76 o 14 83.8243 3.05092 107.077     12.5492  147.66      12.7699  40.9566    335.977     19.3044     155.977     
1 1 1 9  8  77 o 15 48.775  4.00645 47.0622     9.59898  40.6164     9.57255  31.981     68.8844     9.90818     68.8844     
1 1 1 9  8  78 o 14 26.4713 5.65503 15.4266     8.14294  11.0774     8.26666  5.99218    107.385     13.8595     287.385     
1 1 1 9  8  79 o 14 76.4732 3.50797 108.75      12.7867  104.424     13.8988  38.2946    74.8464     14.7849     254.846     
1 1 1 9  8  80 o 13 42.0976 4.75588 43.7554     9.52761  24.7853     9.38388  22.0769    175.818     3.07447     355.818     
1 1 1 9  8  81 o 16 64.53   3.74731 73.3904     11.6982  80.3052     12.3266  54.6917    355.785     36.2481     355.785     
1 1 1 9  8  82 o 5  24.078  5.69077 15.4601     8.35699  4.9719      8.72718  5.03327    87.4758     0.49352     87.4758     
1 1 1 9  8  83 o 19 19.8132 5.76942 2.96586     8.04207  4.73409     10.3792  1.24375    167.46      13.0458     347.46      
1 1 1 9  8  84 o 1  52.6402 5.72744 49.9522     15.4191  59.6467     13.4031  30.2988    169.754     1.6036      169.754     
1 1 1 9  8  85 o 9  34.5255 6.76837 36.0724     13.5945  14.4538     11.8182  8.61143    133.629     19.3465     313.629     
1 1 1 9  8  86 o 5  25.293  6.80286 15.7245     12.8885  5.8118      11.3087  7.64807    259.008     2.32662     79.0075     
1 1 1 9  8  87 o 17 27.9295 7.07277 17.231      13.3991  13.1426     11.7152  1.89602    8.73064     25.61       188.731     
1 1 1 9  8  88 o 4  26.1545 7.60108 13.7318     16.4763  5.3585      15.7382  8.61602    24.7543     6.18938     204.754     
1 1 1 9  8  89 o 13 27.1874 7.84754 6.606       17.0594  16.8819     17.1687  9.50137    62.402      5.45563     242.402     
1 1 1 9  8  90 o 11 31.0963 8.0384  35.4968     18.0531  2.07046     18.6958  13.3844    293.134     2.13167     293.134     
1 1 1 9  8  91 f 0  24.9426 7.64167 12.4861     17.7403  1.54808     17.9281  4.82147    350.622     0           0           
1 1 1 9  8  92 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 9  9  0  o 17 2282.75 32.6267 92811.9     3728.99  92811.9     3728.99  1867.1     4.93437e-06 427.328     4.93437e-06 
1 1 1 9  9  1  o 2  700.16  6.7051  8693.53     235.171  8693.53     235.171  552.526    210         90.8007     210         
1 1 1 9  9  2  o 8  766.043 7.24386 10407       277.977  10407       277.977  576.349    240         43.1011     240         
1 1 1 9  9  3  o 19 801.095 8.02665 11383       322.094  11383       322.094  581.142    270         2.07556     270         
1 1 1 9  9  4  o 6  79.5853 2.58868 112.939     10.2746  112.939     10.2746  24.1208    120         75.2293     120         
1 1 1 9  9  5  o 2  329.07  3.52462 1920.13     58.0946  1920.13     58.0946  202.105    330         72.1405     150         
1 1 1 9  9  6  o 15 267.855 3.04892 1272.28     40.9027  1272.28     40.9027  86.1819    6.27754e-07 215.223     180         
1 1 1 9  9  7  o 3  348.276 3.83881 2150.94     66.9642  2150.94     66.9642  217.144    30          69.5495     210         
1 1 1 9  9  8  o 18 181.416 2.7142  583.95      24.6513  583.95      24.6513  107.246    240         12.3759     60          
1 1 1 9  9  9  o 17 1132.9  10.0378 22768.9     569.69   22768.9     569.69   996.626    90          355.757     90          
1 1 1 9  9  10 o 14 987.821 8.81215 17307.8     436.079  17307.8     436.079  947.431    120         467.815     120         
1 1 1 9  9  11 f 0  35.1742 3.11464 22.9333     5.25751  22.9333     5.25751  104.398    150         0           0           
1 1 1 9  9  12 o 11 1302.39 11.9566 30103       780.089  30103       780.089  1112.63    4.26947e-07 346.073     4.26947e-07 
1 1 1 9  9  13 o 10 74.5133 2.24205 98.9121     8.33762  98.9121     8.33762  197.405    30          490.169     30          
1 1 1 9  9  14 o 8  437.703 4.31361 3397        94.5781  3397        94.5781  338.131    60          45.6142     60          
1 1 1 9  9  15 o 16 92.9137 2.31612 153.536     10.7541  153.536     10.7541  9.52331    270         58.0582     270         
1 1 1 9  9  16 o 4  827.537 7.77155 12146.3     322.168  12146.3     322.168  676.122    120         161.894     120         
1 1 1 9  9  17 o 12 196.819 2.81647 687.247     27.7543  687.247     27.7543  124.674    330         17.9679     150         
1 1 1 9  9  18 o 4  435.867 4.51293 3368.84     98.5287  3368.84     98.5287  399.164    360         172.549     360         
1 1 1 9  9  19 o 10 658.732 6.37312 7695.49     210.299  7695.49     210.299  632.361    30          319.931     30          
1 1 1 9  9  20 o 5  621.195 5.74265 6842.73     178.704  6842.73     178.704  324.059    240         241.878     60          
1 1 1 9  9  21 o 4  202.022 2.81738 724.023     28.4986  724.023     28.4986  97.6626    90          85.7071     270         
1 1 1 9  9  22 o 15 108.131 2.36867 207.772     12.8077  207.772     12.8077  14.295     300         107.786     300         
1 1 1 9  9  23 o 7  703.17  6.46883 8769.02     227.867  8769.02     227.867  518.4      330         32.9446     330         
1 1 1 9  9  24 o 11 1512.8  13.3544 40649.2     1012.08  40649.2     1012.08  1069.93    360         17.0396     180         
1 1 1 9  9  25 o 3  644.649 6.3077  7370.82     203.689  7370.82     203.689  533.868    210         149.864     210         
1 1 1 9  9  26 o 17 330.685 3.54127 1939.15     58.6556  1939.15     58.6556  279.265    240         88.7402     240         
1 1 1 9  9  27 o 15 880.9   7.96727 13767.6     351.59   13767.6     351.59   597.765    90          55.1239     270         
1 1 1 9  9  28 o 18 552.662 5.01528 5416.41     138.853  5416.41     138.853  296.517    120         190.414     300         
1 1 1 9  9  29 o 4  24.6491 4.90215 13.0243     5.24149  13.0243     5.24149  148.653    330         307.982     330         
1 1 1 9  9  30 o 19 501.789 4.84804 4465.62     121.861  4465.62     121.861  260.275    360         188.504     180         
1 1 1 9  9  31 o 9  294.418 3.31072 1537.32     48.8203  1537.32     48.8203  281.594    30          148.277     30          
1 1 1 9  9  32 o 1  24.8061 4.84658 13.1189     5.21023  13.1189     5.21023  55.1514    240         115.669     240         
1 1 1 9  9  33 o 15 754.242 6.86025 10095.2     259.208  10095.2     259.208  458.209    90          143.812     270         
1 1 1 9  9  34 o 1  108.426 2.40238 208.94      13.0248  208.94      13.0248  17.6463    300         1.23164     120         
1 1 1 9  9  35 o 2  61.5751 2.49518 67.8485     7.64125  67.8485     7.64125  6.88429    330         28.6949     330         
1 1 1 9  9  36 o 13 367.997 3.68608 2401.82     67.9475  2401.82     67.9475  364.135    360         213.932     360         
1 1 1 9  9  37 o 4  852.702 7.68644 12913.6     328.34   12913.6     328.34   529.213    30          130.968     210         
1 1 1 9  9  38 o 14 111.129 2.31971 219.424     12.8933  219.424     12.8933  27.4046    240         92.764      60          
1 1 1 9  9  39 o 3  33.7941 3.58413 21.5628     5.66748  21.5628     5.66748  36.8064    90.0001     84.0968     90.0001     
1 1 1 9  9  40 o 1  13.8239 5.10588 4.9199      4.63112  4.9199      4.63112  30.0517    300         61.2928     300         
1 1 1 9  9  41 o 16 164.087 2.23396 477.677     18.3546  477.677     18.3546  130.831    330         95.3194     330         
1 1 1 9  9  42 o 17 13.2996 4.93075 4.54473     4.33101  4.54473     4.33101  40.609     180         83.0961     180         
1 1 1 9  9  43 o 3  483.456 4.52765 4147.33     109.653  4147.33     109.653  430.042    210         194.62      210         
1 1 1 9  9  44 o 10 51.9506 2.34239 48.412      6.04075  48.412      6.04075  14.619     240         77.4071     240         
1 1 1 9  9  45 o 3  23.6439 4.46962 11.8049     4.57582  11.8049     4.57582  4.5638     89.9996     10.2448     89.9996     
1 1 1 9  9  46 f 0  132.37  2.11619 311.003     14.0217  311.003     14.0217  10.7556    120         0           0           
1 1 1 9  9  47 o 10 140.644 2.3436  351.173     16.4976  351.173     16.4976  122.767    330         57.3527     330         
1 1 1 9  9  48 o 8  297.275 3.12572 1567.75     46.5429  1567.75     46.5429  179.519    180         45.0397     8.64391e-06 
1 1 1 9  9  49 o 2  54.2749 2.67218 52.9716     7.18581  52.9716     7.18581  25.8089    210         113.454     210         
1 1 1 9  9  50 o 12 170.933 2.58038 518.621     22.0812  518.621     22.0812  175.109    60          123.942     60          
1 1 1 9  9  51 o 16 189.881 2.70404 639.921     25.7073  639.921     25.7073  170.525    90          85.1586     90          
1 1 1 9  9  52 o 2  42.02   4.0327  33.0023     8.05076  33.0023     8.05076  0.830852   120         3.18151     120         
1 1 1 9  9  53 f 0  50.4021 3.52187 46.3547     8.68199  46.3547     8.68199  25.9715    150         0           0           
1 1 1 9  9  54 f 0  14.9377 5.94293 5.27023     6.7528   5.27023     6.7528   67.2834    180         0           0           
1 1 1 9  9  55 o 13 321.796 3.6833  1838.39     59.3637  1838.39     59.3637  245.232    30          61.6876     30          
1 1 1 9  9  56 o 15 52.7216 3.65877 50.7185     9.4381   50.7185     9.4381   5.77451    60          34.601      240         
1 1 1 9  9  57 o 12 93.4711 2.83351 155.788     13.2172  155.788     13.2172  70.1448    270         21.0709     270         
1 1 1 9  9  58 o 5  67.1165 2.89907 80.784      9.66674  80.784      9.66674  34.8366    120         11.0374     300         
1 1 1 9  9  59 o 13 42.4337 4.03638 33.6586     8.1473   33.6586     8.1473   3.23115    330         20.8913     150         
1 1 1 9  9  60 o 8  66.0529 3.10006 78.4357     10.1565  78.4357     10.1565  12.5236    1.91004e-05 6.63903     1.91004e-05 
1 1 1 9  9  61 o 1  63.9276 3.11008 73.5541     9.85357  73.5541     9.85357  18.6113    30.0001     9.50322     30.0001     
1 1 1 9  9  62 o 17 118.049 2.68967 248.037     15.8744  248.037     15.8744  68.7357    240         16.3017     60          
1 1 1 9  9  63 o 9  47.9522 3.68069 42.281      8.58106  42.281      8.58106  13.1563    270         28.7437     90          
1 1 1 9  9  64 o 4  186.474 2.87035 618.302     26.7946  618.302     26.7946  110.493    120         20.2338     300         
1 1 1 9  9  65 o 11 89.4228 2.96845 142.983     13.2356  142.983     13.2356  49.4339    150         16.3633     330         
1 1 1 9  9  66 o 10 104.503 3.06923 195.09      16.0106  195.09      16.0106  65.0015    180         4.2093      360         
1 1 1 9  9  67 o 5  17.5357 6.2712  8.11405     6.84404  8.11405     6.84404  19.5323    210         49.2624     210         
1 1 1 9  9  68 o 11 10.0207 4.69064 -1.47457    6.16553  -1.47457    6.16553  20.5524    240         44.9975     240         
1 1 1 9  9  69 o 14 36.4018 4.83795 26.0146     7.91461  26.0146     7.91461  15.7313    90          11.605      270         
1 1 1 9  9  70 o 13 115.492 2.70626 237.975     15.6243  237.975     15.6243  88.1127    120         30.1087     120         
1 1 1 9  9  71 o 6  7.11489 3.57457 -7.37489    5.44705  -7.37489    5.44705  23.0028    330         48.999      330         
1 1 1 9  9  72 o 14 91.6113 2.66946 150.111     12.2082  150.111     12.2082  75.1388    180         35.2806     180         
1 1 1 9  9  73 o 16 13.4088 5.80704 2.85794     7.4636   2.85794     7.4636   16.8316    30          44.3646     30          
1 1 1 9  9  74 o 3  41.418  4.06623 32.4264     7.97577  32.4264     7.97577  30.3086    240         14.0372     240         
1 1 1 9  9  75 o 15 91.8538 2.69726 151.071     12.3672  151.071     12.3672  39.0728    90          35.759      270         
1 1 1 9  9  76 o 5  8.77048 4.26944 -4.39637    6.18351  -4.39637    6.18351  24.8336    300         56.0679     300         
1 1 1 9  9  77 o 2  11.9185 5.17868 2.17675     5.98071  2.17675     5.98071  5.02012    150         14.4746     150         
1 1 1 9  9  78 o 3  39.8386 5.61048 31.9201     9.94598  31.9201     9.94598  23.8441    360         0.904438    180         
1 1 1 9  9  79 o 19 121.582 3.20653 265.908     19.4755  265.908     19.4755  79.687     210         11.1498     210         
1 1 1 9  9  80 o 16 48.7324 4.87951 45.614      11.2285  45.614      11.2285  37.0519    60          15.0092     60          
1 1 1 9  9  81 o 9  8.136   4.09504 -9.85524    7.26824  -9.85524    7.26824  7.8983     270         18.8266     270         
1 1 1 9  9  82 o 17 66.4508 4.12496 81.857      13.4824  81.857      13.4824  54.4071    300         28.8774     300         
1 1 1 9  9  83 o 8  102.58  4.16662 193.012     21.2564  193.012     21.2564  64.9236    330         7.00831     330         
1 1 1 9  9  84 o 19 44.9789 7.82787 44.284      15.2769  44.284      15.2769  24.8122    3.26919e-06 3.91254     180         
1 1 1 9  9  85 o 12 26.143  8.97221 19.908      13.7569  19.908      13.7569  9.40451    210         7.69038     30          
1 1 1 9  9  86 f 0  77.6407 5.08704 113.677     19.3809  113.677     19.3809  41.5323    60          0           0           
1 1 1 9  9  87 o 14 15.3236 6.84054 3.10986     11.1781  3.10986     11.1781  4.98623    90          24.5489     90          
1 1 1 9  9  88 o 16 73.1786 5.55197 103.153     19.7695  103.153     19.7695  55.0115    300         24.4386     300         
1 1 1 9  9  89 o 3  32.2463 9.65365 29.7009     15.7815  29.7009     15.7815  18.0216    330         8.78664     330         
1 1 1 9  9  90 o 4  30.8209 9.63669 28.2268     15.6563  28.2268     15.6563  3.60696    360         1.76791     360         
1 1 1 9  9  91 o 15 19.1712 8.62927 7.40035     18.2178  7.40035     18.2178  0.558094   30          12.2757     30          
1 1 1 9  9  92 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 0  0  o 6  180.476 3.03625 578.121     27.4259  578.121     27.4259  42.5045    360         195.868     360         
1 1 1 10 0  1  o 6  438.26  3.71593 3405.3      81.5868  3405.3      81.5868  440.211    240         254.621     240         
1 1 1 10 0  2  f 0  662.422 5.42499 7781.27     180.038  7781.27     180.038  492.861    300         0           0           
1 1 1 10 0  3  o 10 1083.6  8.10456 20831.7     439.996  20831.7     439.996  1135.73    180         709.807     180         
1 1 1 10 0  4  o 9  99.7523 1.84923 176.676     9.22994  176.676     9.22994  26.7902    60.0001     77.7846     60.0001     
1 1 1 10 0  5  o 13 302.317 2.8771  1620.43     43.5712  1620.43     43.5712  105.189    120         224.063     300         
1 1 1 10 0  6  o 19 796.802 6.42457 11260.6     256.465  11260.6     256.465  586.682    8.89472e-07 25.8943     8.89474e-07 
1 1 1 10 0  7  o 11 178.122 2.36417 562.791     21.0868  562.791     21.0868  14.6196    60          262.479     60          
1 1 1 10 0  8  f 0  738.756 5.84344 9678.72     216.276  9678.72     216.276  515.933    120         0           0           
1 1 1 10 0  9  o 11 838.224 6.5592  12462.3     275.456  12462.3     275.456  715.774    180         225.927     180         
1 1 1 10 0  10 o 8  204.19  2.32497 739.364     23.777   739.364     23.777   0.22928    60.0002     285.631     60          
1 1 1 10 0  11 o 4  183.07  2.20133 594.371     20.1827  594.371     20.1827  22.546     300         190.352     120         
1 1 1 10 0  12 o 3  1049.56 8.7316  19548.9     459.119  19548.9     459.119  815.135    1.73211e-06 123.311     1.73211e-06 
1 1 1 10 0  13 o 18 151.306 2.24108 406.19      16.9763  406.19      16.9763  0.296942   239.999     160.964     240         
1 1 1 10 0  14 o 16 50.4937 2.10823 45.6478     5.2918   45.6478     5.2918   89.2715    300         193.601     300         
1 1 1 10 0  15 o 7  566.5   5.16772 5690.98     146.655  5690.98     146.655  303.166    5.10519e-07 205.23      180         
1 1 1 10 0  16 o 14 471.896 4.43078 3948.6      104.74   3948.6      104.74   549.937    60          460.502     60          
1 1 1 10 0  17 o 13 279.913 3.16007 1389.45     44.3028  1389.45     44.3028  155.188    300         110.862     300         
1 1 1 10 0  18 o 17 147.786 2.35528 387.584     17.4235  387.584     17.4235  16.8727    5.15477e-05 26.5676     180         
1 1 1 10 0  19 o 8  1689.24 14.2384 50677       1204.97  50677       1204.97  1442.34    240         473.775     240         
1 1 1 10 0  20 o 9  639.19  5.49943 7244.07     176.102  7244.07     176.102  433.129    300         45.0213     120         
1 1 1 10 0  21 o 5  69.0238 1.94765 84.819      6.71264  84.819      6.71264  2.48724    0.000501521 6.33081     0.000501521 
1 1 1 10 0  22 o 11 791.304 6.65906 11102.8     263.984  11102.8     263.984  636.385    240         147.242     240         
1 1 1 10 0  23 f 0  789.99  6.54272 11065.6     258.944  11065.6     258.944  383.471    300         0           0           
1 1 1 10 0  24 o 1  1013.65 8.38723 18221.9     425.926  18221.9     425.926  699.48     360         39.1691     180         
1 1 1 10 0  25 o 3  839.893 6.93036 12508.1     291.613  12508.1     291.613  596.777    240         3.55869     240         
1 1 1 10 0  26 o 1  665.706 5.63667 7857.23     187.986  7857.23     187.986  415.196    120         111.479     300         
1 1 1 10 0  27 o 5  205.507 2.73615 749.127     28.1566  749.127     28.1566  39.4516    9.1464e-06  369.118     9.1464e-06  
1 1 1 10 0  28 o 8  704.255 6.1981  8794.5      218.674  8794.5      218.674  559.034    60          124.626     60          
1 1 1 10 0  29 o 17 600.2   5.39572 6387.37     162.236  6387.37     162.236  403.866    120         37.5947     300         
1 1 1 10 0  30 o 16 243.421 2.97927 1050.88     36.3191  1050.88     36.3191  203.849    6.41518e-06 123.432     6.41518e-06 
1 1 1 10 0  31 o 9  921.035 8.35024 15047       385.279  15047       385.279  638.119    240         16.6586     59.9998     
1 1 1 10 0  32 o 17 546.401 5.43098 5294.4      148.647  5294.4      148.647  447.15     300         128.627     300         
1 1 1 10 0  33 o 17 421.204 4.21852 3145.85     89.0055  3145.85     89.0055  199.963    180         189.249     8.99453e-06 
1 1 1 10 0  34 o 15 72.4009 2.32113 93.4529     8.38224  93.4529     8.38224  16.3585    60          43.0472     60          
1 1 1 10 0  35 o 6  674.158 5.98496 8059.82     202.129  8059.82     202.129  503.599    300         67.7319     300         
1 1 1 10 0  36 o 7  332.407 3.33713 1959.2      55.5656  1959.2      55.5656  297.367    180         133.233     180         
1 1 1 10 0  37 o 14 287.78  3.15324 1468.63     45.451   1468.63     45.451   196.805    240         5.65772     59.9998     
1 1 1 10 0  38 f 0  508.46  4.6392  4584.55     118.167  4584.55     118.167  251.195    300         0           0           
1 1 1 10 0  39 o 14 513.042 4.92743 4668.21     126.635  4668.21     126.635  331.463    180         46.193      8.66123e-06 
1 1 1 10 0  40 o 16 1140.4  10.1616 23101.2     580.529  23101.2     580.529  935.795    240         298.779     240         
1 1 1 10 0  41 o 17 905.046 8.11902 14541.2     368.11   14541.2     368.11   794.218    300         343.013     300         
1 1 1 10 0  42 o 18 30.4197 3.7499  17.8201     5.19675  17.8201     5.19675  5.1401     7.60459e-05 11.2176     7.60459e-05 
1 1 1 10 0  43 o 17 242.73  2.79704 1044.97     34.0035  1044.97     34.0035  141.942    60          48.5834     240         
1 1 1 10 0  44 o 11 411.762 3.98348 3007.19     82.1648  3007.19     82.1648  308.269    300         53.8969     300         
1 1 1 10 0  45 o 17 620.508 5.82775 6833.36     181.149  6833.36     181.149  420.362    2.03736e-06 5.06903     180         
1 1 1 10 0  46 f 0  395.867 4.22862 2780.31     83.8465  2780.31     83.8465  220.369    240         0           0           
1 1 1 10 0  47 o 13 261.628 3.05783 1214.22     40.0673  1214.22     40.0673  188.451    300         22.0962     300         
1 1 1 10 0  48 o 3  50.6376 2.85544 46.3077     7.13694  46.3077     7.13694  2.54829    360         8.65154     360         
1 1 1 10 0  49 o 3  217.806 3.09805 841.906     33.7849  841.906     33.7849  187.445    60          81.1389     60          
1 1 1 10 0  50 o 9  151.29  2.61053 406.397     19.7659  406.397     19.7659  65.6497    300         72.2111     120         
1 1 1 10 0  51 o 10 192.938 2.81988 660.659     27.2389  660.659     27.2389  188.816    360         119.401     360         
1 1 1 10 0  52 o 4  185.849 3.05296 613.268     28.3996  613.268     28.3996  112.134    60          24.3455     240         
1 1 1 10 0  53 o 6  114.377 2.65045 232.627     15.1551  232.627     15.1551  57.4032    120         36.3005     300         
1 1 1 10 0  54 o 19 92.9948 2.37961 153.878     11.0569  153.878     11.0569  29.6354    180         12.5036     180         
1 1 1 10 0  55 o 4  204.2   3.47375 740.637     35.5016  740.637     35.5016  145.435    60          20.1207     60          
1 1 1 10 0  56 o 9  423.731 4.387   3187.27     93.1127  3187.27     93.1127  337.462    120         114.815     120         
1 1 1 10 0  57 o 6  324.261 4.09391 1866.86     66.4784  1866.86     66.4784  232.91     1.15872e-06 38.5325     1.15872e-06 
1 1 1 10 0  58 o 7  115.439 2.937   237.173     16.941   237.173     16.941   63.9522    60          22.5476     240         
1 1 1 10 0  59 o 5  33.7274 4.12222 21.8946     6.34386  21.8946     6.34386  0.541827   120         1.50352     120         
1 1 1 10 0  60 o 8  303.834 3.64075 1638.88     55.3996  1638.88     55.3996  229.879    360         63.2517     360         
1 1 1 10 0  61 o 12 562.743 6.71957 5639.93     189.379  5639.93     189.379  435.963    240         139.995     240         
1 1 1 10 0  62 f 0  205.638 3.51427 751.542     36.168   751.542     36.168   71.5587    300         0           0           
1 1 1 10 0  63 o 7  92.4044 3.18904 152.549     14.6872  152.549     14.6872  71.6783    360         28.5965     360         
1 1 1 10 0  64 o 19 108.416 3.21022 209.651     17.372   209.651     17.372   80.5025    240         21.8066     240         
1 1 1 10 0  65 o 4  165.853 3.28615 489.354     27.2647  489.354     27.2647  117.3      120         21.8678     120         
1 1 1 10 0  66 o 1  385.466 5.0301  2647.33     97.0932  2647.33     97.0932  256.159    1.08762e-07 19.6851     1.08762e-07 
1 1 1 10 0  67 o 16 42.6352 4.84234 34.7319     9.54665  34.7319     9.54665  0.481458   59.9998     48.0229     60          
1 1 1 10 0  68 o 6  28.1274 6.68797 18.1824     8.41838  18.1824     8.41838  26.7001    120         81.7357     120         
1 1 1 10 0  69 o 19 105.039 3.19239 197.11      16.7337  197.11      16.7337  44.2798    1.17229e-06 44.188      180         
1 1 1 10 0  70 o 10 14.7264 6.10435 4.57208     7.56916  4.57208     7.56916  17.3999    240         39.0979     240         
1 1 1 10 0  71 o 6  130.459 3.14056 303.601     20.4785  303.601     20.4785  96.3045    300         29.0058     300         
1 1 1 10 0  72 o 6  168.876 3.38332 508.689     28.5813  508.689     28.5813  96.3534    180         18.2374     360         
1 1 1 10 0  73 o 3  14.4721 6.08121 4.16189     7.69467  4.16189     7.69467  4.06604    60.0002     11.0495     60.0002     
1 1 1 10 0  74 o 18 12.864  5.70859 1.65048     7.65922  1.65048     7.65922  21.0021    300         51.2826     300         
1 1 1 10 0  75 o 12 137.701 3.27956 339.044     22.5733  339.044     22.5733  92.0067    360         14.0931     360         
1 1 1 10 0  76 o 15 39.3052 5.45073 30.713      9.55783  30.713      9.55783  22.2262    60          1.01068     240         
1 1 1 10 0  77 o 14 65.5716 3.74576 78.335      12.1182  78.335      12.1182  51.1585    120         22.1394     120         
1 1 1 10 0  78 f 0  68.9369 3.66898 86.3915     12.5062  86.3915     12.5062  20.7996    2.36321e-06 0           0           
1 1 1 10 0  79 o 6  68.9489 3.80483 86.6237     12.9576  86.6237     12.9576  55.2087    240         26.7913     240         
1 1 1 10 0  80 o 17 88.7015 3.40685 141.89      15.0413  141.89      15.0413  58.4428    120         9.74961     120         
1 1 1 10 0  81 o 13 14.5953 6.41438 2.94383     9.43041  2.94383     9.43041  0.450968   180         2.01981     180         
1 1 1 10 0  82 o 4  43.1467 5.44809 36.753      10.6621  36.753      10.6621  1.06001    60.0001     49.5291     240         
1 1 1 10 0  83 o 6  54.8662 4.48108 56.5318     11.8941  56.5318     11.8941  32.8769    300         0.37504     300         
1 1 1 10 0  84 o 9  51.5982 4.24827 50.0206     10.5969  50.0206     10.5969  34.1612    180         7.12646     180         
1 1 1 10 0  85 o 12 139.983 2.98664 352.232     20.9084  352.232     20.9084  94.0229    60          22.7825     60          
1 1 1 10 0  86 o 6  23.1807 8.06345 15.2373     11.1672  15.2373     11.1672  1.79959    120         21.7264     300         
1 1 1 10 0  87 o 11 48.9469 6.20562 48.2833     13.767   48.2833     13.767   27.6555    3.89222e-06 1.90593     180         
1 1 1 10 0  88 o 19 17.7046 7.89835 4.61897     14.8758  4.61897     14.8758  0.200646   240         7.03483     240         
1 1 1 10 0  89 o 4  40.9533 9.37586 40.8001     17.0058  40.8001     17.0058  27.6286    120         8.65597     120         
1 1 1 10 0  90 o 1  22.4193 9.79022 11.5256     21.6283  11.5256     21.6283  6.53673    7.54728e-08 4.94497     180         
1 1 1 10 0  91 o 17 35.3968 13.3735 44.4073     32.3559  44.4073     32.3559  14.7595    60          10.6032     240         
1 1 1 10 0  92 x 3  ?       ?       ?           ?        ?           ?        21.1796    120         0           0           
1 1 1 10 0  93 x 14 ?       ?       ?           ?        ?           ?        10.2923    180         0           0           
1 1 1 10 0  94 x 12 ?       ?       ?           ?        ?           ?        36.4267    240         0           0           
1 1 1 10 0  95 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 1  0  o 2  223.781 2.43519 887.993     27.295   887.993     27.295   71.2718    360         18.8851     360         
1 1 1 10 1  1  o 15 169.015 2.20814 500.331     19.0202  512.133     18.3709  22.5853    247.326     53.6329     67.3264     
1 1 1 10 1  2  o 5  210.968 2.41931 785.88      26.8649  791.581     24.2125  60.814     226.56      111.579     46.5601     
1 1 1 10 1  3  o 2  372.762 3.35621 2446.96     63.7577  2478.74     61.6001  279.519    13.8603     75.6234     13.8603     
1 1 1 10 1  4  o 13 370.142 3.28897 2433.15     63.0129  2423.47     58.9438  157.703    331.015     187.327     151.015     
1 1 1 10 1  5  o 13 237.77  2.55526 1005.55     31.9898  998.238     28.8346  78.6568    231.39      131.355     51.3904     
1 1 1 10 1  6  o 7  547.776 4.63395 5345.1      127.206  5295.33     127.209  312.894    146.717     140.772     326.717     
1 1 1 10 1  7  o 12 455.807 4.21313 3689.75     98.1465  3676.69     94.2972  234.928    77.6717     160.872     257.672     
1 1 1 10 1  8  o 8  337.237 3.32307 1973.56     58.2212  2058.41     53.9086  223.845    254.966     11.1607     254.966     
1 1 1 10 1  9  o 16 653.338 5.63473 7484.6      191.356  7656.97     177.17   386.969    299.802     147.908     119.802     
1 1 1 10 1  10 o 9  201.534 2.64362 714.27      27.2679  725.338     26.1091  47.2023    210.666     350.858     210.666     
1 1 1 10 1  11 o 6  386.762 3.79166 2638.36     76.4731  2664.68     70.3492  320.595    268.541     139.277     268.541     
1 1 1 10 1  12 o 18 483.202 4.52939 4134.34     114.151  4144.33     105.008  364.335    225.58      65.5593     225.58      
1 1 1 10 1  13 o 4  680.063 6.07878 8178.89     215.595  8226.45     198.331  382.275    50.2681     196.246     230.268     
1 1 1 10 1  14 o 3  300.571 3.32152 1561.74     52.1785  1641.06     47.6467  231.085    183.605     117.086     183.605     
1 1 1 10 1  15 o 12 299.253 3.31511 1580.15     49.7126  1594.08     49.7188  139.908    187.826     115.091     7.82603     
1 1 1 10 1  16 o 1  611.214 5.29094 6605.85     162.055  6640.63     162.073  398.637    338.525     60.2708     158.525     
1 1 1 10 1  17 o 5  537.673 4.64098 5057.91     127.296  5191.29     122.689  271.812    328.407     209.324     148.407     
1 1 1 10 1  18 o 6  715.089 5.86807 9014.36     210.272  9117.69     210.3    592.604    121.569     181.471     121.569     
1 1 1 10 1  19 o 16 799.295 6.73389 11328.6     269.721  11328.2     269.745  585.896    57.6989     43.8617     57.699      
1 1 1 10 1  20 o 7  416.659 3.84734 3074.14     80.3281  3079.2      80.341   250.681    341.38      71.2827     161.38      
1 1 1 10 1  21 o 16 1227.38 10.1014 26724.2     621.295  26741.7     621.354  971.233    102.598     202.639     102.598     
1 1 1 10 1  22 o 8  134.498 2.18944 328.02      14.7483  313.143     14.7604  13.8187    188.711     170.053     188.711     
1 1 1 10 1  23 o 11 262.636 2.83933 1208.82     37.3615  1235.84     37.3765  197.751    76.171      124.449     76.171      
1 1 1 10 1  24 o 9  409.93  3.95931 3022.09     77.8197  2934.37     84.6003  306.905    250.963     56.823      250.963     
1 1 1 10 1  25 o 16 1113.54 9.72816 21857       530.975  22145.5     554.65   766.855    303.397     37.2264     123.397     
1 1 1 10 1  26 o 3  200.037 2.63311 705.687     26.9543  712.436     25.8199  96.8043    307.953     45.0888     127.953     
1 1 1 10 1  27 o 8  592.491 5.42668 6271.44     164.616  6174.29     157.615  417.784    41.0428     11.8315     41.0428     
1 1 1 10 1  28 o 2  467.391 4.58059 3865.82     107.284  3878.02     107.297  261.534    85.6293     121.952     265.629     
1 1 1 10 1  29 o 4  947.388 8.67489 15875.2     401.942  15970.6     421.603  652.098    351.915     22.0428     171.915     
1 1 1 10 1  30 o 5  661.559 6.13437 7836.62     203.392  7682.93     203.345  381.802    319.069     155.804     139.069     
1 1 1 10 1  31 f 0  552.342 4.97186 5466.98     137.617  5349.22     137.614  419.33     46.6981     0           0           
1 1 1 10 1  32 o 6  633.934 5.5264  7086.41     172.032  7163.06     179.069  467.62     271.995     62.5683     271.995     
1 1 1 10 1  33 o 19 629.753 5.41578 7035.47     164.207  7026.79     177.369  481.752    296.596     99.8777     296.596     
1 1 1 10 1  34 o 6  1070.25 9.2913  20196.4     487.449  20473.5     509.117  888.333    88.83       292.316     88.83       
1 1 1 10 1  35 o 17 821.289 7.01413 11918.6     270.864  12013       305.598  606.013    156.297     77.8103     156.297     
1 1 1 10 1  36 o 18 275.842 2.89467 1339.97     38.4437  1356.96     41.544   127.52     96.3276     106.587     276.328     
1 1 1 10 1  37 o 11 155.279 2.48552 436.657     18.901   418.031     19.7476  61.4352    31.3678     42.911      211.368     
1 1 1 10 1  38 o 3  54.031  2.43256 53.2234     6.69083  50.6825     6.41504  56.7422    47.3987     142.266     47.3987     
1 1 1 10 1  39 o 10 629.514 5.75252 7157.62     189.745  6904.22     173.083  448.061    10.6087     34.3268     10.6087     
1 1 1 10 1  40 o 9  398.592 3.9547  2834.72     81.5652  2799.01     76.3709  355.438    122.201     179.836     122.201     
1 1 1 10 1  41 o 4  546.722 5.27853 5226.49     147.727  5379.99     141.335  423.241    149.831     103.21      149.831     
1 1 1 10 1  42 o 12 237.342 2.94506 996.428     36.4779  1000.63     33.5108  123.502    126.361     64.4161     306.361     
1 1 1 10 1  43 o 17 155.45  2.79689 434.2       22.3547  423.086     21.1836  101.462    0.0362689   31.7754     0.0362689   
1 1 1 10 1  44 o 17 610.162 5.90824 6540.47     180.612  6682.24     180.695  471.629    84.2569     116.31      84.2569     
1 1 1 10 1  45 o 4  350.549 4.14155 2174.28     76.683   2185.53     68.5822  228.404    204.901     10.7844     24.9009     
1 1 1 10 1  46 o 6  93.646  2.63872 144.473     11.6279  167.363     13.1038  15.7953    302.971     53.3419     122.971     
1 1 1 10 1  47 o 19 355.935 3.92872 2264.14     66.4407  2230.88     73.4827  283.514    209.702     95.888      209.702     
1 1 1 10 1  48 o 5  355.087 3.92591 2225.34     66.2874  2248.55     73.2932  276.214    109.391     81.7134     109.391     
1 1 1 10 1  49 o 14 303.025 3.63493 1603.47     50.7051  1654.51     59.4714  214.63     68.3751     28.9179     68.3751     
1 1 1 10 1  50 o 19 50.0422 2.87595 40.9171     6.53075  48.6447     7.7833   13.1715    52.1618     61.2354     52.1618     
1 1 1 10 1  51 o 2  337.922 3.77695 2022.4      63.9729  2030.04     63.9499  232.655    242.663     18.0738     242.663     
1 1 1 10 1  52 o 13 112.714 2.47638 229.05      13.6146  221.905     14.3049  4.84642    174.36      130.92      354.36      
1 1 1 10 1  53 o 5  137.169 2.49754 347.696     16.5973  320.057     17.6393  58.7421    279.645     53.0946     99.6454     
1 1 1 10 1  54 o 7  166.461 2.69846 488.567     22.3185  494.219     22.7029  94.3489    9.00454     20.9462     189.005     
1 1 1 10 1  55 o 9  234.981 3.31515 974.138     36.8858  985.245     41.1004  181.092    309.815     61.6161     309.815     
1 1 1 10 1  56 o 7  247.343 3.45501 1111.77     46.6362  1059.93     38.8262  183.326    273.537     49.283      273.537     
1 1 1 10 1  57 o 4  109.273 2.95806 225.236     17.372   199.414     14.9775  31.3429    238.297     68.4063     58.2968     
1 1 1 10 1  58 o 10 218.82  2.969   872.069     34.2666  827.193     30.8323  141.031    190.794     3.05279     190.794     
1 1 1 10 1  59 o 1  191.385 3.03049 646.741     32.2284  653.128     25.4734  123.078    354.658     4.89764     354.658     
1 1 1 10 1  60 o 5  79.6113 2.8188  115.366     12.3391  110.133     10.0062  35.0576    101.71      2.21177     281.71      
1 1 1 10 1  61 o 5  251.129 3.20886 1131.19     42.4633  1108.31     38.2331  184.781    49.3806     49.0249     49.3806     
1 1 1 10 1  62 o 10 155.777 2.71656 442.353     22.3752  419.415     20.0054  126.092    119.069     61.2293     119.069     
1 1 1 10 1  63 o 12 25.2796 5.05859 12.2911     7.28134  11.1019     6.11643  18.5626    343.541     48.6945     343.541     
1 1 1 10 1  64 o 1  16.1607 4.62556 -1.34144    6.65892  3.818       5.38972  26.1381    223.703     57.695      223.703     
1 1 1 10 1  65 o 8  35.138  5.03873 24.2959     8.87509  21.4351     8.26899  3.65756    348.984     24.3934     348.984     
1 1 1 10 1  66 o 1  372.046 4.67453 2511.12     92.213   2434.88     81.9306  248.86     163.375     24.3935     163.375     
1 1 1 10 1  67 o 5  143.089 3.09399 369.701     22.8817  359.567     21.4316  58.771     60.8941     60.7257     240.894     
1 1 1 10 1  68 o 8  24.9686 5.53774 11.458      8.00291  10.7783     7.41937  22.684     0.591256    63.7564     0.591256    
1 1 1 10 1  69 o 8  93.6911 3.16378 153.917     15.3108  159.649     14.2697  34.9302    234.916     42.9047     54.9156     
1 1 1 10 1  70 o 14 131.047 3.12239 300.487     21.1444  312.573     19.7491  72.7777    357.079     14.6449     177.079     
1 1 1 10 1  71 o 12 80.1135 3.32819 112.072     13.2506  117.936     13.3515  12.0017    111.177     72.5905     291.177     
1 1 1 10 1  72 o 7  16.4308 4.81874 -6.38668    7.27763  4.97542     6.84022  3.89904    289.01      10.8965     289.01      
1 1 1 10 1  73 f 0  148.042 3.06539 418.033     23.1479  366.551     22.2628  91.9364    103.157     0           0           
1 1 1 10 1  74 o 1  154.298 2.91981 434.813     22.189   416.712     22.8963  123.612    169.912     58.6852     169.912     
1 1 1 10 1  75 o 9  71.5442 3.27776 100.03      11.5157  84.5866     11.7692  51.2744    203.099     19.6624     203.099     
1 1 1 10 1  76 o 5  49.6743 3.87214 41.8862     9.35512  48.3012     9.57465  21.8524    318.793     12.5782     138.793     
1 1 1 10 1  77 o 6  51.1385 3.88842 51.1936     9.69862  44.4693     9.85634  27.4724    279.865     2.49824     99.8646     
1 1 1 10 1  78 o 8  43.926  4.36047 31.2919     9.15533  40.4466     9.4076   27.3379    80.351      10.7331     80.351      
1 1 1 10 1  79 o 3  52.5183 3.92519 53.6163     10.053   47.4877     10.2437  36.7972    143.485     16.9633     143.485     
1 1 1 10 1  80 o 15 45.9487 4.2769  34.7171     9.48398  43.742      9.62717  26.1303    238.964     1.9165      238.964     
1 1 1 10 1  81 o 18 55.5259 3.88713 53.9909     10.4868  59.2738     10.8577  34.7419    99.6657     6.38089     99.6657     
1 1 1 10 1  82 o 2  37.7683 5.10984 23.7276     9.12853  31.2013     9.49571  18.1353    33.7369     4.42476     213.737     
1 1 1 10 1  83 o 7  30.77   5.70111 18.5837     8.77749  18.7202     9.01364  15.1774    195.296     1.93503     195.296     
1 1 1 10 1  84 o 16 127.639 3.16839 303.761     20.9214  288.763     19.5502  83.5993    247.301     17.0167     247.301     
1 1 1 10 1  85 o 7  87.5523 3.92216 139.475     16.2056  144.496     18.009   55.5195    247.752     9.57313     247.752     
1 1 1 10 1  86 o 6  63.7641 5.28685 79.5937     14.9892  77.3987     17.887   33.3535    84.124      5.71941     264.124     
1 1 1 10 1  87 o 7  13.7957 4.72285 -25.7529    11.8044  -9.05731    9.0843   3.52831    302.843     12.3696     302.843     
1 1 1 10 1  88 o 19 26.7104 6.74817 -11.7857    14.2391  26.5284     13.9843  2.6959     25.4114     20.5861     205.411     
1 1 1 10 1  89 o 6  22.7034 6.86274 5.18673     13.9466  1.36526     13.8159  4.56271    287.518     2.05071     107.518     
1 1 1 10 1  90 o 12 24.2002 7.44435 17.025      20.2165  -13.8436    14.4295  6.13592    206.508     8.33331     26.5082     
1 1 1 10 1  91 o 19 25.3956 8.31791 -8.7612     25.4351  -3.76269    24.8606  1.39311    237.565     21.9202     57.5646     
1 1 1 10 1  92 x 14 ?       ?       ?           ?        ?           ?        11.8335    71.2202     0           0           
1 1 1 10 1  93 x 3  ?       ?       ?           ?        ?           ?        2.07777    327.728     0           0           
1 1 1 10 1  94 x 5  ?       ?       ?           ?        ?           ?        16.0858    52.6312     0           0           
1 1 1 10 1  95 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 2  0  o 11 1098.4  9.10702 21414.2     501.146  21414.2     501.146  839.608    5.8599e-06  94.5276     5.8599e-06  
1 1 1 10 2  1  o 6  611.989 5.19045 6675.47     162.122  6608.07     156.224  429.831    103.915     0.163302    103.917     
1 1 1 10 2  2  o 5  670.979 5.52953 7938.75     185.928  8030.91     185.934  452.397    48.4005     42.9511     228.401     
1 1 1 10 2  3  o 12 125.713 2.15274 274.251     13.5597  285.919     13.5605  49.9424    326.582     204.624     326.582     
1 1 1 10 2  4  o 14 575.297 4.92001 5825.74     139.209  5911.67     144.468  357.008    190.134     93.6402     10.1339     
1 1 1 10 2  5  o 2  219.345 2.52296 852.969     28.2426  852.278     27.2145  89.3622    274.686     15.081      274.686     
1 1 1 10 2  6  o 12 809.712 7.59114 11539.5     300.66   11736.3     315.339  613.969    273.024     78.9648     273.024     
1 1 1 10 2  7  o 17 455.837 4.70954 3693.35     107.586  3674.92     107.582  428.878    159.902     259.746     159.902     
1 1 1 10 2  8  o 16 238.284 3.05675 1044.16     38.3357  969.145     34.6745  131.139    231.481     15.5473     231.481     
1 1 1 10 2  9  o 17 803.961 7.54087 11450.8     296.505  11492       310.988  617.127    92.2794     94.5954     92.2794     
1 1 1 10 2  10 o 9  656.375 6.11318 7564.1      201.071  7719.37     201.083  595.204    329.271     274.413     329.271     
1 1 1 10 2  11 o 12 360.574 3.85719 2283.65     71.3191  2325.48     68.0048  238.003    58.5147     4.98036     238.515     
1 1 1 10 2  12 o 2  494.933 4.76814 4295.83     118.253  4389.94     118.267  308.759    140.687     70.8093     320.687     
1 1 1 10 2  13 o 11 645.815 5.65952 7440.5      186.809  7350.67     179.492  429.62     298.079     50.6486     118.079     
1 1 1 10 2  14 o 19 205.41  2.56033 744.177     26.8725  751.216     25.8235  88.911     217.957     17.3861     217.957     
1 1 1 10 2  15 o 11 569.362 5.06421 5759.98     141.563  5733.64     147.361  402.778    152.827     9.38666     152.827     
1 1 1 10 2  16 o 11 160.582 2.25974 461.028     18.18    452.852     18.189   4.65527    151.775     170.544     331.775     
1 1 1 10 2  17 o 19 647.024 5.52613 7441.26     179.175  7401.88     179.195  527.995    357.809     149.441     357.809     
1 1 1 10 2  18 f 0  761.728 6.42862 10197.2     245.372  10378.6     245.419  373.104    329.709     0           0           
1 1 1 10 2  19 o 10 581.603 5.04818 5991        147.125  6000.52     147.149  342.726    265.086     130.933     85.0859     
1 1 1 10 2  20 o 7  516.837 4.55081 4741.75     117.857  4726.92     117.882  425.747    162.67      137.221     162.67      
1 1 1 10 2  21 o 16 519.392 4.91419 4762.37     119.29   4800.57     136.047  387.163    237.303     53.5424     237.303     
1 1 1 10 2  22 o 19 1124.92 10.2912 22502.6     566.08   22409.3     593.845  918.274    143.815     244.507     143.815     
1 1 1 10 2  23 o 2  343.521 3.69163 2044.28     62.0251  2138.78     65.0875  136.209    207.454     197.509     27.4542     
1 1 1 10 2  24 o 5  187.771 2.68612 640.116     24.6368  609.607     25.8599  83.6296    229.176     31.2755     229.176     
1 1 1 10 2  25 o 4  408.818 4.33471 2970.48     84.2221  2953.76     93.1431  318.624    132.781     82.0871     132.781     
1 1 1 10 2  26 o 5  502.602 5.10745 4525.05     121.954  4430.39     134.861  338.665    325.146     18.8306     145.145     
1 1 1 10 2  27 o 6  445.994 4.54682 3589.94     96.2957  3461.66     106.486  265.975    284.77      82.6621     104.77      
1 1 1 10 2  28 f 0  447.222 4.33725 3539.4      92.6607  3550.33     101.563  315.64     85.9319     0           0           
1 1 1 10 2  29 o 14 1342.18 11.2429 32260.9     708.902  31717.7     799.955  1024.38    148.285     163.828     148.285     
1 1 1 10 2  30 o 1  460.288 4.26507 3808.5      92.1844  3702.08     104.039  401.724    50.8976     184.745     50.8976     
1 1 1 10 2  31 o 12 729.247 6.40233 9422.1      223.977  9437.99     243.582  520.1      262.832     28.764      262.832     
1 1 1 10 2  32 o 3  459.372 4.41951 3737.49     94.8585  3743.39     108.197  379.462    16.0669     143.3       16.0669     
1 1 1 10 2  33 o 8  1098.82 9.50649 21461.3     511.939  21411.5     534.764  956.093    243.464     385.075     243.464     
1 1 1 10 2  34 o 11 613.375 5.47332 6684.77     161.044  6657.05     175.117  593.024    296.217     353.353     296.217     
1 1 1 10 2  35 o 14 901.68  7.7503  14467.1     335.236  14390       364.493  717.334    116.266     186.954     116.266     
1 1 1 10 2  36 o 5  414.094 4.07319 3042.6      78.7935  3036.79     89.8846  320.485    56.6167     84.4322     56.6167     
1 1 1 10 2  37 o 10 123.175 2.28354 274.521     13.7655  263.639     14.3784  25.626     191.351     67.9587     11.3512     
1 1 1 10 2  38 o 9  205.755 2.64054 738.95      27.2069  761.72      27.2435  72.5081    292.359     120.671     112.359     
1 1 1 10 2  39 o 13 147.406 2.3609  403.039     17.3756  367.518     17.4724  73.0066    150.342     11.5475     330.342     
1 1 1 10 2  40 o 14 363.517 3.53779 2352.58     63.1599  2332.82     65.7019  229.95     359.581     29.9145     179.581     
1 1 1 10 2  41 o 7  247.891 2.93484 1077.51     37.2341  1101.04     35.6464  182.211    272.119     43.7656     272.119     
1 1 1 10 2  42 o 2  679.402 6.11287 8089.43     212.503  8302.54     203.513  471.706    248.025     15.5306     248.025     
1 1 1 10 2  43 o 17 504.31  4.72657 4459.88     116.83   4565.33     122.071  397.34     146.365     112.269     146.365     
1 1 1 10 2  44 o 4  653.763 6.28874 7615.58     210.924  7570.87     201.058  494.645    238.025     101.593     238.025     
1 1 1 10 2  45 o 17 574.311 5.29808 5744.93     155.666  5968.31     149.063  443.339    63.8319     110.579     63.8319     
1 1 1 10 2  46 o 12 275.936 3.21252 1344.71     43.1087  1355.62     45.7104  212.695    56.9749     65.9582     56.9749     
1 1 1 10 2  47 o 4  526.853 5.05407 4839.18     133.714  5018.61     133.124  420.248    335.696     132.45      335.696     
1 1 1 10 2  48 o 1  324.71  3.67427 1829.29     56.7654  1911.85     62.7735  176.441    303.907     79.9426     123.907     
1 1 1 10 2  49 o 13 307.288 3.52929 1680.09     51.4768  1669.92     57.0602  223.792    163.954     40.524      163.954     
1 1 1 10 2  50 o 6  204.432 2.86534 749.239     30.1227  732.986     28.5816  119.473    90.1416     27.0515     270.142     
1 1 1 10 2  51 o 19 245.14  3.13894 1106.77     37.7443  1025.69     39.2645  171.469    331.839     22.9312     331.839     
1 1 1 10 2  52 o 19 363.443 3.97901 2396        68.7278  2293.71     75.858   271.995    239.101     63.9002     239.101     
1 1 1 10 2  53 o 15 112.81  2.88604 237.601     15.1633  214.686     17.2109  47.1961    95.3278     39.8056     275.328     
1 1 1 10 2  54 o 13 153.151 2.81604 410.405     21.6211  422.175     21.5644  80.326     250.88      31.005      70.8796     
1 1 1 10 2  55 f 0  443.716 4.92557 3491.4      109.542  3507.5      109.511  263.683    113.817     0           0           
1 1 1 10 2  56 f 0  109.091 2.61144 233.976     14.3639  189.774     14.0598  122.401    121.003     0           0           
1 1 1 10 2  57 o 19 252.442 3.43935 1197.53     49.9288  1066.43     36.7403  177.82     168.91      30.971      168.91      
1 1 1 10 2  58 o 17 63.7226 2.97292 74.3879     10.0027  70.3492     8.86999  7.76325    337.594     81.6119     337.594     
1 1 1 10 2  59 o 11 505.21  5.16644 4530.81     137.204  4554.14     124.033  402.158    146.889     146.45      146.889     
1 1 1 10 2  60 o 3  213.49  2.89828 830.202     32.6439  787.725     29.3553  175.728    54.8578     82.6189     54.8578     
1 1 1 10 2  61 o 19 125.626 2.69946 293.461     17.9921  267.465     15.9641  87.5104    163.317     24.3079     163.317     
1 1 1 10 2  62 o 5  181.915 2.76581 622.286     25.9276  553.532     24.5001  127.855    278.744     26.3509     278.744     
1 1 1 10 2  63 o 6  113.743 2.69052 239.858     16.4775  220.222     14.1408  44.4894    241.469     51.3872     61.469      
1 1 1 10 2  64 o 12 27.3798 4.65068 6.97292     7.34293  20.2829     6.04313  13.5541    234.377     40.0178     234.377     
1 1 1 10 2  65 o 10 199.18  3.01243 729.224     32.3422  681.514     27.7491  148.348    326.422     46.4155     326.422     
1 1 1 10 2  66 o 5  155.045 2.75297 456.988     22.9671  398.733     19.8188  113.052    16.2952     34.235      16.2952     
1 1 1 10 2  67 f 0  92.8306 2.77265 166.935     14.2251  140.629     11.5326  17.261     116.545     0           0           
1 1 1 10 2  68 o 8  130.798 2.80823 321.008     18.8801  288.752     17.8924  85.8789    353.534     11.7185     353.534     
1 1 1 10 2  69 o 15 76.3275 2.82683 115.185     11.4427  93.3847     10.1167  25.1373    305.795     39.4074     125.795     
1 1 1 10 2  70 o 4  148.609 3.04356 409.095     24.5054  379.21      20.7392  109.761    284.208     37.6516     284.208     
1 1 1 10 2  71 f 0  135.954 2.75196 344.868     20.2284  314.635     17.2186  110.924    298.889     0           0           
1 1 1 10 2  72 o 16 109.591 2.83906 219.08      16.4687  209.926     14.6418  80.2309    217.595     27.193      217.595     
1 1 1 10 2  73 o 18 127.483 3.09131 297.108     19.9896  284.636     19.4521  66.2837    197.024     24.1401     17.0238     
1 1 1 10 2  74 o 17 40.1345 4.77703 33.229      9.66078  26.85       8.86992  19.7393    291.203     0.208144    291.203     
1 1 1 10 2  75 o 19 80.1041 3.25189 116.733     13.1367  114.187     12.8624  50.4975    27.6393     5.77066     27.6392     
1 1 1 10 2  76 o 6  48.0603 4.36482 40.7171     10.4173  44.4199     10.0804  24.319     82.9291     4.82255     262.929     
1 1 1 10 2  77 o 12 67.2526 3.58387 76.1645     11.8654  88.0029     12.0768  49.0613    143.294     21.0915     143.294     
1 1 1 10 2  78 o 10 79.92   3.54541 123.539     13.3247  107.985     14.7341  48.2847    327.316     2.10311     327.316     
1 1 1 10 2  79 o 15 19.7897 4.91122 13.3196     7.3805   -13.1985    8.81805  0.0186625  35.9136     9.69588     215.913     
1 1 1 10 2  80 o 4  16.4898 5.00918 -2.3418     7.35584  1.86956     7.66162  2.83208    162.294     14.7052     162.294     
1 1 1 10 2  81 o 14 78.4843 3.4935  107.747     13.9557  116.404     13.3337  53.0731    198.092     14.1799     198.092     
1 1 1 10 2  82 o 12 25.2492 5.73255 7.17223     8.54233  16.1316     8.5124   6.77358    85.8023     9.88243     265.802     
1 1 1 10 2  83 o 1  79.1146 3.53053 115.48      14.5071  113.641     13.3258  49.1196    46.0375     5.87354     46.0375     
1 1 1 10 2  84 o 3  18.3687 5.2564  7.55607     7.90913  -3.90887    8.1755   1.38159    200.095     17.8823     200.095     
1 1 1 10 2  85 o 2  25.325  6.38289 17.0178     10.6491  4.68601     10.8208  5.85743    333.136     11.7899     153.136     
1 1 1 10 2  86 o 11 22.5397 6.48695 8.5454      10.469   1.9491      13.0877  3.54196    292.655     10.1933     112.655     
1 1 1 10 2  87 o 4  57.8402 6.67095 57.3841     19.2467  79.5139     17.2852  34.0303    82.0922     4.24623     82.0922     
1 1 1 10 2  88 o 3  38.9988 7.96315 27.3135     17.9534  38.7738     15.6889  20.7551    266.978     2.68239     266.978     
1 1 1 10 2  89 o 7  33.1141 8.54388 21.9241     15.398   23.6662     21.799   16.1262    79.7602     7.41021     79.7602     
1 1 1 10 2  90 o 1  24.4402 7.86935 3.57312     19.0831  -16.1337    24.8361  5.47425    295.22      0.0786836   295.22      
1 1 1 10 2  91 o 19 32.3809 9.57673 12.6284     24.4264  28.0258     27.738   10.6181    255.711     10.7677     75.7107     
1 1 1 10 2  92 x 19 ?       ?       ?           ?        ?           ?        16.2681    131.625     0           0           
1 1 1 10 2  93 x 5  ?       ?       ?           ?        ?           ?        12.448     108.093     0           0           
1 1 1 10 2  94 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 3  0  o 17 242.822 2.94968 1045.76     35.8703  1045.76     35.8703  108.361    180         55.5146     180         
1 1 1 10 3  1  o 18 159.033 2.53159 437.945     20.6325  458.583     19.6789  6.82619    219.335     137.358     39.3351     
1 1 1 10 3  2  o 7  897.114 8.51171 14279.6     401.316  14303.5     363.025  698.195    186.609     117.722     186.609     
1 1 1 10 3  3  o 2  327.311 3.84143 1816.72     66.2014  1983.15     59.2305  225.024    157.565     27.4846     157.565     
1 1 1 10 3  4  o 4  371.894 4.25685 2449.33     79.3335  2454.32     79.3375  331.538    133.348     210.901     133.348     
1 1 1 10 3  5  o 13 289.068 3.4397  1473.84     48.5051  1488.27     51.13    164.83     223.68      39.7251     43.6802     
1 1 1 10 3  6  o 1  275.781 3.50493 1327.38     45.7025  1368.83     51.1013  113.683    44.0038     131.57      224.004     
1 1 1 10 3  7  f 0  447.9   4.91008 3527.85     103.951  3586.05     116.225  256.764    322.739     0           0           
1 1 1 10 3  8  o 19 1065.25 10.9194 20156.8     599.82   20185.1     565.482  944.66     39.2347     369.718     39.2347     
1 1 1 10 3  9  o 1  574.706 5.61458 5892.66     149.64   5821.23     172.792  562.889    232.951     336.953     232.951     
1 1 1 10 3  10 o 9  214.114 2.66331 820.987     27.3443  803.901     29.7335  92.2453    24.4371     60.3708     204.437     
1 1 1 10 3  11 o 13 914.96  7.77464 14827.6     349.27   14879.8     363.582  664.76     44.4867     26.165      44.4865     
1 1 1 10 3  12 o 15 535.551 4.81429 5097.34     126.584  5071.48     131.768  367.553    234.16      13.5589     54.1602     
1 1 1 10 3  13 o 17 520.193 4.67497 4901.67     119.336  4692.84     124.209  352.551    188.472     21.1178     8.47194     
1 1 1 10 3  14 o 16 933.907 7.92494 15536       363.353  15408.5     378.236  701.606    47.243      74.5882     47.243      
1 1 1 10 3  15 o 4  555.931 4.94595 5478.86     134.999  5477.86     140.533  319.673    330.787     142.117     150.787     
1 1 1 10 3  16 o 8  217.886 2.63338 868.022     28.1435  814.894     29.2956  88.3852    218.358     93.0042     38.3578     
1 1 1 10 3  17 o 2  264.023 2.97164 1223.29     37.6532  1247.3      40.9443  140.363    236.558     61.7933     56.5576     
1 1 1 10 3  18 o 9  889.365 8.24599 14049.1     358.625  14009.2     376.182  701.787    137.295     143.25      137.295     
1 1 1 10 3  19 o 15 462.018 4.63485 3813.12     104.698  3753.63     109.823  116.527    332         414.903     152         
1 1 1 10 3  20 o 7  372.973 3.87163 2495.77     70.5899  2434.98     74.0489  303.766    304.112     108.62      304.112     
1 1 1 10 3  21 o 3  638.821 6.20733 7210.64     188.528  7258.78     208.478  343.239    324.847     213.313     144.847     
1 1 1 10 3  22 o 7  112.525 2.45252 228.485     13.0949  220.7       14.4699  14.8516    14.4712     123.391     14.4712     
1 1 1 10 3  23 o 14 204.134 2.79577 726.347     27.9128  750.569     29.2888  88.2674    328.115     75.1518     148.115     
1 1 1 10 3  24 o 16 463.793 4.52269 3815.4      105.109  3809.48     105.129  348.608    102.694     58.0139     102.694     
1 1 1 10 3  25 o 13 656.985 5.71363 7720.85     184.258  7582.85     191.821  474.388    10.2878     29.0198     10.2878     
1 1 1 10 3  26 o 11 572.205 5.1436  5809.01     141.185  5798.52     153.536  460.108    122.654     126.315     122.654     
1 1 1 10 3  27 f 0  481.305 4.48997 4143.47     103.627  4068.44     112.691  381.373    78.3151     0           0           
1 1 1 10 3  28 o 11 619.375 5.51019 6842.73     163.681  6758.84     177.991  407.792    271.105     46.0761     91.1049     
1 1 1 10 3  29 o 10 1102.64 9.45125 21915.6     499.595  21242       543.217  822.695    352.867     98.924      352.867     
1 1 1 10 3  30 o 8  517.537 4.6619  4842.06     118.389  4654.29     123.252  382.213    270.81      55.5305     270.81      
1 1 1 10 3  31 f 0  683.018 5.88366 8273.66     197.293  8269.74     205.406  358.164    93.9507     0           0           
1 1 1 10 3  32 o 16 447.322 4.07972 3495.26     89.598   3598.4      93.3153  365.693    132.29      131.535     132.29      
1 1 1 10 3  33 o 1  805.125 6.72835 11576.7     260.723  11419.4     281.67   490.414    166.491     137.569     346.491     
1 1 1 10 3  34 o 8  177.95  2.45438 565.758     20.4992  556.564     23.1715  87.8968    326.693     7.05186     146.693     
1 1 1 10 3  35 o 3  804.127 6.74505 11620.5     260.978  11325       281.937  617.31     290.411     122.069     290.411     
1 1 1 10 3  36 o 13 309.484 3.11409 1701.09     46.3679  1694.08     50.1463  139.943    353.326     135.923     173.326     
1 1 1 10 3  37 o 1  422.493 3.95284 3182.97     78.4645  3146.04     88.5551  338.21     315.254     105.295     315.254     
1 1 1 10 3  38 o 3  416.778 3.96849 3038.65     79.3798  3120.95     86.3317  316.377    307.973     68.646      307.973     
1 1 1 10 3  39 o 3  538.224 4.93282 5124.11     130.107  5152.41     135.947  376.469    318.963     16.7956     318.963     
1 1 1 10 3  40 o 13 361.137 3.59178 2308.61     64.9901  2315.91     65.0185  264.502    118.35      43.3391     118.351     
1 1 1 10 3  41 o 5  56.404  2.58054 56.1787     7.20702  57.0725     7.30329  11.7563    1.06776     39.3764     1.06776     
1 1 1 10 3  42 o 5  547.099 5.14963 5251.12     147.353  5372.94     134.573  446.333    56.7984     149.122     56.7984     
1 1 1 10 3  43 o 12 218.21  2.9706  854.093     30.767   834.266     34.0757  131.969    284.404     18.2564     104.404     
1 1 1 10 3  44 o 3  261.338 3.14474 1213.32     42.1587  1208.62     40.1932  192.981    348.535     45.3892     348.535     
1 1 1 10 3  45 o 11 304.841 3.42948 1632.27     53.5966  1663.81     51.1303  259.735    282.514     121.107     282.514     
1 1 1 10 3  46 f 0  357.866 4.01837 2290.38     73.9593  2253.91     70.1494  204.168    211.118     0           0           
1 1 1 10 3  47 o 6  300.851 3.33938 1592.11     49.1357  1618.4      51.5475  171.018    142.326     58.503      322.326     
1 1 1 10 3  48 o 2  541.654 5.05724 5190.39     137.276  5230.66     137.275  421.434    25.2246     114.254     25.2246     
1 1 1 10 3  49 o 9  351.114 3.57263 2159.77     62.8657  2214.48     62.853   246.479    17.0413     24.7254     17.0414     
1 1 1 10 3  50 o 17 462.751 5.03573 3826.19     116.803  3782.19     116.756  325.626    91.6354     32.4756     91.6354     
1 1 1 10 3  51 o 18 68.0596 2.55431 82.2788     8.97846  82.445      8.37161  20.8052    70.7403     117.517     70.7403     
1 1 1 10 3  52 o 19 394.453 4.18355 2816.59     84.9107  2708.78     80.4905  258.285    91.574      6.70211     271.574     
1 1 1 10 3  53 o 12 353.881 4.25302 2229.03     78.9556  2218.56     71.7368  282.72     197.71      100.109     197.71      
1 1 1 10 3  54 o 15 176.235 3.01915 574.827     26.6801  527.906     26.5941  123.793    108.987     26.743      108.986     
1 1 1 10 3  55 o 19 384.139 4.54863 2602.84     84.9773  2640.8      90.1098  258.109    283.453     11.4342     283.453     
1 1 1 10 3  56 o 4  378.029 4.39646 2527.87     78.5499  2549.86     87.8072  271.409    157.646     47.9908     157.646     
1 1 1 10 3  57 o 11 301.079 4.06602 1598.55     69.7368  1621.58     51.4437  184.55     325.875     22.5141     145.875     
1 1 1 10 3  58 o 4  99.1549 2.75253 172.012     13.5147  177.362     13.7875  44.1035    28.8155     25.0155     208.816     
1 1 1 10 3  59 o 10 241.235 3.09878 1021.11     38.3844  1044.65     36.4903  199.01     315.213     90.9687     315.213     
1 1 1 10 3  60 o 4  239.362 3.14072 1006.04     38.5956  1028.34     36.705   166.009    357.149     25.2933     357.149     
1 1 1 10 3  61 o 4  59.4921 3.22852 59.9058     10.1504  66.6328     8.79916  3.70374    334.315     56.9947     154.315     
1 1 1 10 3  62 o 12 22.0657 5.011   9.06702     6.87163  7.87671     5.69536  21.2602    195.547     51.5445     195.547     
1 1 1 10 3  63 f 0  182.525 2.80931 595.015     26.2547  588.297     25.1326  96.025     340.814     0           0           
1 1 1 10 3  64 o 12 140.438 2.65602 350.266     19.0747  350.757     18.2681  85.9254    167.917     2.62647     347.917     
1 1 1 10 3  65 o 19 177.108 2.76302 565.494     25.0533  549.284     23.9937  137.715    92.7531     54.3298     92.7531     
1 1 1 10 3  66 o 12 112.082 2.71329 232.087     15.8473  215.169     14.5936  72.8799    253.868     10.1871     253.868     
1 1 1 10 3  67 o 18 129.037 2.67833 299.419     18.0261  293.219     16.5579  79.576     145.127     0.348446    145.127     
1 1 1 10 3  68 o 11 53.8844 3.22699 49.6886     8.95148  54.5917     8.24184  8.99649    260.778     40.9561     80.7775     
1 1 1 10 3  69 o 12 142.53  2.57024 360.847     18.8726  362.272     17.8095  100.642    63.7072     26.6796     63.7072     
1 1 1 10 3  70 o 1  112.598 2.7253  228.63      15.1644  223.485     15.5385  70.4148    146.767     4.13017     146.767     
1 1 1 10 3  71 o 12 63.4246 3.16419 79.644      9.71358  65.0663     10.1357  42.4027    344.667     15.0029     344.667     
1 1 1 10 3  72 o 7  95.916  2.71355 169.605     13.0925  159.077     12.9358  54.7754    27.3852     7.36823     207.385     
1 1 1 10 3  73 o 6  60.5016 3.18002 70.3107     10.1075  61.5331     9.04756  35.9498    285.18      1.99257     285.18      
1 1 1 10 3  74 o 15 152.935 2.8141  446.64      22.7608  390.867     20.3594  104.059    163.605     20.378      163.605     
1 1 1 10 3  75 o 8  85.0253 2.94219 138.265     12.5964  121.489     12.3732  51.9159    175.04      1.97994     175.04      
1 1 1 10 3  76 o 8  96.333  3.1787  152.758     14.8145  181.785     15.7721  55.3278    43.7267     5.41416     223.727     
1 1 1 10 3  77 o 18 31.7746 5.19097 11.7215     8.81237  26.928      7.93544  11.9259    140.588     0.752021    140.588     
1 1 1 10 3  78 o 5  49.095  4.44299 45.6304     10.0283  43.5598     11.2425  30.439     40.0362     7.17788     40.0362     
1 1 1 10 3  79 o 16 100.898 3.36626 176.493     16.4402  191.69      17.512   56.649     266.199     7.36983     86.1987     
1 1 1 10 3  80 o 13 55.2648 4.19136 46.806      10.7357  66.7397     12.0056  26.6546    194.24      10.5824     14.2401     
1 1 1 10 3  81 f 0  27.703  5.99921 18.2314     8.96043  10.699      9.74307  15.1717    83.8981     0           0           
1 1 1 10 3  82 o 4  23.6959 5.92468 8.24504     8.07505  11.46       9.5012   6.10379    228.65      7.93752     48.6499     
1 1 1 10 3  83 o 2  22.6547 5.88456 11.6161     8.57042  4.0228      9.59561  5.65       180.19      6.34011     0.189919    
1 1 1 10 3  84 f 0  18.4687 5.65092 -1.67606    8.96695  2.34354     10.2613  7.00706    206.973     0           0           
1 1 1 10 3  85 o 5  80.5303 4.21168 116.93      16.6077  125.554     17.1442  44.0272    289.577     5.28105     109.577     
1 1 1 10 3  86 o 5  35.3173 6.95683 34.8662     13.8236  17.7824     12.4312  18.6702    351.321     5.43963     351.321     
1 1 1 10 3  87 o 18 31.1004 6.7833  35.0015     14.4232  3.34953     11.9872  10.2162    200.239     3.95197     200.239     
1 1 1 10 3  88 o 2  18.3514 5.89788 1.28903     13.012   -11.1159    10.7775  0.640084   286.658     8.99677     106.658     
1 1 1 10 3  89 o 15 25.2268 7.47332 6.46926     14.2076  7.99005     17.5225  6.58003    74.0487     9.80042     254.049     
1 1 1 10 3  90 o 4  20.7621 6.84486 -9.54307    17.938   -9.20479    16.9386  3.63858    237.299     6.19374     57.2987     
1 1 1 10 3  91 o 11 49.3203 11.0285 81.0336     24.281   42.3741     69.7981  24.659     7.02787     3.00848     187.028     
1 1 1 10 3  92 x 3  ?       ?       ?           ?        ?           ?        6.70064    296.721     0           0           
1 1 1 10 3  93 x 15 ?       ?       ?           ?        ?           ?        6.57997    122.932     0           0           
1 1 1 10 3  94 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 4  0  o 2  574.051 7.28526 5848.54     209.431  5848.54     209.431  380.662    2.15973e-06 67.7825     180         
1 1 1 10 4  1  o 18 77.6454 3.12372 104.245     13.0447  110.183     11.0082  63.3821    242.965     160.332     242.965     
1 1 1 10 4  2  o 2  198.43  3.44001 705.072     35.5001  691.129     32.8587  75.0492    332.455     60.3811     152.455     
1 1 1 10 4  3  o 3  381.948 4.73356 2549.39     93.5197  2623.55     87.4893  230.703    119.98      59.6048     299.98      
1 1 1 10 4  4  o 9  541.509 5.93676 5230.32     174.83   5170.31     146.273  454.572    164.752     156.606     164.752     
1 1 1 10 4  5  o 9  689.598 6.70294 8416.97     219.778  8453.77     242.977  488.527    47.417      0.802637    227.413     
1 1 1 10 4  6  o 17 396.782 4.03141 2798.66     80.1601  2782.49     80.1636  274.961    202.486     9.89585     202.486     
1 1 1 10 4  7  o 15 440.616 4.45348 3414.45     95.9782  3468.54     100.673  296.71     182.635     15.0917     2.63549     
1 1 1 10 4  8  o 17 126.104 2.53322 291.166     16.4196  273.026     15.5694  57.2287    254.623     244.15      254.623     
1 1 1 10 4  9  o 1  216.171 2.77278 839.34      30.0337  816.938     30.0384  113.898    308.225     1.88457     128.225     
1 1 1 10 4  10 o 16 528.558 4.96087 4917.84     122.58   4987.26     139.781  269.988    257.213     204.708     77.2128     
1 1 1 10 4  11 o 7  721.343 6.30697 9072.45     218.395  9382.03     237.465  563.263    114.857     104.942     114.857     
1 1 1 10 4  12 o 8  468.387 4.35833 3895.03     97.9357  3881.93     106.476  329.816    87.6429     9.42784     87.6429     
1 1 1 10 4  13 o 13 111.926 2.30982 233.055     12.3013  211.546     13.4753  86.5213    71.2939     292.212     71.2939     
1 1 1 10 4  14 o 10 1613.53 14.5746 45956.4     1150.17  46633.8     1206.54  1217.76    239.142     124.175     239.142     
1 1 1 10 4  15 o 13 523.904 5.09892 4749.34     130.678  4982.45     137.086  368.801    310.331     4.46185     310.331     
1 1 1 10 4  16 o 18 265.824 3.10851 1257.44     39.478   1246.94     43.2405  120.23     82.3855     110.723     262.386     
1 1 1 10 4  17 o 5  83.9585 2.39392 131.67      9.5218   118.716     10.4863  39.0808    11.2822     120.633     11.2822     
1 1 1 10 4  18 o 11 483.201 4.92621 4102.73     113.206  4174.13     125.169  401.282    12.1519     135.238     12.1519     
1 1 1 10 4  19 o 4  803.246 7.634   11396.2     307.284  11487.1     307.311  598.464    52.6429     59.9275     52.6429     
1 1 1 10 4  20 o 4  764.703 6.9912  10352.7     255.453  10384.3     279.865  559.705    310.077     38.7904     310.077     
1 1 1 10 4  21 o 2  108.196 2.20205 205.436     11.427   209.777     12.4166  1.45224    181.023     47.9384     181.023     
1 1 1 10 4  22 o 6  614.301 5.48965 6720.56     161.762  6658.09     175.874  502.782    310.854     146.337     310.854     
1 1 1 10 4  23 o 15 489.087 4.50917 4290.04     105.752  4189.55     114.976  319.648    322.434     41.2804     142.434     
1 1 1 10 4  24 o 2  852.72  7.39676 12802.2     302.683  12988.1     329.117  471.917    64.9666     260.876     244.967     
1 1 1 10 4  25 o 16 510.587 4.57023 4605.37     114.564  4636.05     119.285  535.658    166.411     384.685     166.411     
1 1 1 10 4  26 o 5  433.406 3.94338 3306.36     85.6325  3351.82     85.6634  415.06     293.894     252.611     293.894     
1 1 1 10 4  27 o 3  946.123 7.67625 15778.9     357.149  15975.5     370.724  639.21     203.09      52.0818     23.09       
1 1 1 10 4  28 o 15 311.738 3.08579 1721.78     47.2926  1722.55     49.1064  272.894    311.084     182.981     311.084     
1 1 1 10 4  29 o 3  992.299 8.14791 17371.4     405.139  17567.6     405.214  741.712    160.504     93.1225     160.504     
1 1 1 10 4  30 o 13 610.522 5.35723 6652.83     160.547  6563.71     167.154  403.583    315.215     37.8048     135.215     
1 1 1 10 4  31 o 2  538.988 4.90317 5179.88     126.754  5120.27     137.825  430.64     258.712     124.13      258.712     
1 1 1 10 4  32 o 15 298.285 3.04953 1539.11     44.6407  1614.95     46.5359  216.216    47.8849     50.2309     47.8849     
1 1 1 10 4  33 o 3  393.439 3.86303 2816.31     72.7999  2672.14     79.1921  366.341    321.989     217.88      321.989     
1 1 1 10 4  34 o 19 297.188 3.0996  1561.2      45.1982  1569.45     47.1137  125.711    226.024     146.712     46.0243     
1 1 1 10 4  35 o 7  222.405 2.71152 877.056     28.909   876.181     31.4784  96.1054    329.904     95.9027     149.904     
1 1 1 10 4  36 o 9  514.449 4.63379 4771.34     116.976  4615.12     121.799  426.154    354.374     148.951     354.374     
1 1 1 10 4  37 o 7  213.571 2.62863 828.289     27.5038  788.728     28.7092  123.828    32.3158     25.2219     212.316     
1 1 1 10 4  38 o 9  205.383 2.634   750.451     25.9208  744.793     28.2418  57.5652    132.811     154.558     312.811     
1 1 1 10 4  39 o 1  366.911 3.48613 2395.89     64.0685  2377.51     64.1322  343.183    132.76      198.665     132.76      
1 1 1 10 4  40 o 3  587.699 5.07847 6029.8      146.534  6227.45     152.616  423.101    328.254     40.9784     328.254     
1 1 1 10 4  41 o 11 198.463 2.53579 691.86      25.7023  704.445     24.7185  137.379    28.1414     24.8327     28.1414     
1 1 1 10 4  42 o 10 308.72  3.42329 1695.27     50.6291  1684.69     55.1831  152.325    197.965     110.397     17.9645     
1 1 1 10 4  43 o 4  158     2.57436 447.545     19.8658  437.53      20.8761  91.0862    222.737     7.86037     42.7366     
1 1 1 10 4  44 o 5  349.112 3.59775 2174.8      61.5415  2148.46     64.2982  231.21     188.271     5.20779     8.27099     
1 1 1 10 4  45 o 8  83.0799 2.38674 126.132     9.86777  119.026     9.95587  8.9622     328.576     52.2435     148.576     
1 1 1 10 4  46 o 2  68.2815 2.74539 84.6034     8.47425  81.2701     10.1229  36.4256    227.483     145.749     227.483     
1 1 1 10 4  47 o 8  332.493 3.52797 1966.87     56.0269  1955.08     61.4033  254.527    232.058     65.8835     232.058     
1 1 1 10 4  48 o 4  451.504 4.51371 3708.85     97.2431  3530.37     106.528  349.847    176.837     93.033      176.837     
1 1 1 10 4  49 o 1  296.03  3.28752 1550.88     47.2135  1558        50.2875  170.497    42.0598     53.1004     222.06      
1 1 1 10 4  50 o 18 199.045 2.94764 719.694     28.6077  685.771     30.1282  97.3463    290.303     65.2368     110.303     
1 1 1 10 4  51 o 1  358.942 4.05571 2290.69     71.0032  2283.57     74.8484  289.425    80.3966     103.683     80.3966     
1 1 1 10 4  52 o 17 391.772 4.11251 2711.62     78.8079  2738.46     82.6479  272.498    294.595     25.33       294.595     
1 1 1 10 4  53 o 6  223.679 3.0399  869.4       34.0742  905.804     34.0662  153.835    193.491     18.5905     193.491     
1 1 1 10 4  54 o 12 53.9131 3.17461 58.9359     8.2392   45.3661     8.58214  0.59782    76.4784     19.5056     76.4784     
1 1 1 10 4  55 o 18 194.131 2.84922 659.896     26.4723  677.139     28.9395  105.397    51.9287     38.2312     231.929     
1 1 1 10 4  56 o 14 490.167 4.79887 4259.86     118.334  4282.59     117.424  372.459    272.056     100.133     272.056     
1 1 1 10 4  57 f 0  114.457 2.64245 234.612     16.321   230.626     13.8715  59.6884    52.8199     0           0           
1 1 1 10 4  58 o 3  485.034 4.90998 4296.73     121.796  4075.64     116.915  334.916    300.105     34.976      300.105     
1 1 1 10 4  59 o 16 470.897 4.93404 3919        116.49   3975.49     116.378  376.012    125.824     138.117     125.824     
1 1 1 10 4  60 f 0  325.877 3.59852 1875.75     60.1902  1897.93     57.2903  163.447    316.988     0           0           
1 1 1 10 4  61 o 13 95.4889 2.69714 168.824     13.3266  155.503     12.4399  58.7       174.874     6.51476     174.874     
1 1 1 10 4  62 o 14 70.5376 2.87209 90.25       10.519   87.0643     9.69572  22.5827    148.208     34.582      328.208     
1 1 1 10 4  63 o 2  238.219 3.0694  998.248     37.4385  1018.68     35.8096  160.192    296.505     16.1721     296.505     
1 1 1 10 4  64 o 5  72.7293 2.73389 93.4704     10.0766  94.9977     9.77503  36.4995    95.4844     7.01682     275.484     
1 1 1 10 4  65 o 6  28.7577 4.64063 19.278      6.78977  11.688      6.40549  17.7581    308.61      56.8844     308.61      
1 1 1 10 4  66 o 6  241.197 3.21392 1013.66     40.6416  1058.01     36.8655  148.527    14.1177     8.88216     194.118     
1 1 1 10 4  67 o 19 75.5555 2.80644 107.374     10.6585  96.4651     10.5037  46.5817    185.358     9.78113     185.358     
1 1 1 10 4  68 o 9  96.6648 2.66024 170.473     12.8734  162.599     12.8464  40.4336    193.547     36.3073     13.5469     
1 1 1 10 4  69 o 18 36.8756 4.26715 24.384      8.0948   25.5992     7.07177  2.53738    356.66      23.0018     176.66      
1 1 1 10 4  70 o 1  26.3463 5.05525 11.3578     7.3988   14.3508     6.40613  4.49245    347.102     25.547      347.102     
1 1 1 10 4  71 o 15 148.129 2.86543 381.082     22.2606  402.384     20.1134  79.9922    119.896     24.1641     299.896     
1 1 1 10 4  72 o 6  51.8012 3.62698 49.1369     9.5448   48.0128     9.03666  33.8276    292.28      12.225      292.28      
1 1 1 10 4  73 o 2  20.9608 5.18226 8.53537     7.19213  5.90573     6.24357  0.679204   355.089     8.42497     355.089     
1 1 1 10 4  74 o 10 41.3235 4.21855 37.235      8.94217  26.1926     7.96102  9.95924    170.792     26.5656     350.792     
1 1 1 10 4  75 o 17 45.3403 3.77616 37.1726     8.57847  37.963      8.2431   10.4376    277.841     31.3181     97.8409     
1 1 1 10 4  76 o 16 106.862 2.81372 206.402     15.1533  203.185     14.931   66.9228    226.293     4.59557     226.293     
1 1 1 10 4  77 f 0  58.3151 3.3723  60.8685     9.84382  62.3914     9.69044  40.2945    62.89       0           0           
1 1 1 10 4  78 o 18 48.9449 4.15329 38.2982     10.3394  50.3522     9.19566  32.3519    149.72      11.8034     149.72      
1 1 1 10 4  79 o 12 82.2782 2.86944 131.773     12.216   112.332     11.3695  49.9551    7.39467     2.29832     7.39471     
1 1 1 10 4  80 o 4  24.5979 5.56285 15.3153     7.66936  5.72028     8.773    1.94321    11.8051     20.6028     191.805     
1 1 1 10 4  81 o 13 50.6491 4.86631 41.2404     12.1774  56.0361     11.4462  37.5795    277.873     19.7672     277.873     
1 1 1 10 4  82 f 0  27.0251 6.08904 15.1377     8.93128  12.8504     9.73531  18.7398    51.5894     0           0           
1 1 1 10 4  83 o 12 96.6122 3.65129 171.887     18.5181  170.96      16.6572  67.8431    13.4203     22.2353     13.4203     
1 1 1 10 4  84 o 4  30.8557 6.28005 4.13522     12.0808  31.5757     11.6201  11.6883    172.998     7.80832     352.998     
1 1 1 10 4  85 o 15 62.5695 4.83646 79.3071     15.0215  70.2527     14.7762  46.6272    147.047     23.5315     147.047     
1 1 1 10 4  86 f 0  30.1982 7.09446 22.5431     13.5826  14.8501     11.6023  13.8279    156.075     0           0           
1 1 1 10 4  87 o 18 40.0972 7.72191 23.1389     19.1575  45.2606     15.0023  20.101     123.347     1.14483     303.347     
1 1 1 10 4  88 o 19 36.7908 8.58609 43.1965     22.4139  19.0573     14.6361  19.5381    346.946     2.98604     346.946     
1 1 1 10 4  89 o 7  32.7897 8.58329 -1.02288    23.6548  35.569      19.339   13.1112    283.298     6.53522     103.298     
1 1 1 10 4  90 o 19 43.0151 10.1281 44.0313     26.5095  50.457      24.8982  22.5723    168.349     0.522185    168.349     
1 1 1 10 4  91 o 18 37.4814 9.38772 -69.1359    61.8527  51.1348     20.218   16.1434    250.419     5.32528     70.4194     
1 1 1 10 4  92 o 10 41.8207 16.0264 0           0        55.9554     33.2405  17.8869    142.767     6.04539     142.767     
1 1 1 10 4  93 x 14 ?       ?       ?           ?        ?           ?        3.07877    70.8882     0           0           
1 1 1 10 4  94 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 5  0  o 3  92.1387 2.38354 151.031     10.9724  151.031     10.9724  17.3964    180         56.0974     180         
1 1 1 10 5  1  o 6  401.547 4.26575 2855.53     81.4367  2860.49     90.036   292.703    327.961     37.2957     327.961     
1 1 1 10 5  2  o 14 637.313 6.21251 7185.33     198.414  7219.95     198.42   471.618    151.853     40.9553     151.853     
1 1 1 10 5  3  o 3  379.551 3.98738 2577.78     73.9993  2528.99     77.6053  193.512    301.798     136.858     121.798     
1 1 1 10 5  4  f 0  263.738 3.22837 1231.98     42.6703  1233.43     42.6687  109.267    225.071     0           0           
1 1 1 10 5  5  o 3  319.526 3.70685 1830.88     57.7577  1788.2      60.8724  211.992    246.126     1.20013     246.126     
1 1 1 10 5  6  o 8  1164.22 10.947  24198.9     605.781  23949       669.648  855.349    357.874     39.283      357.874     
1 1 1 10 5  7  o 13 141.597 2.46676 361.075     17.922   349.544     17.0866  17.128     349.299     50.6928     169.299     
1 1 1 10 5  8  o 17 355.315 3.98249 2217.44     69.0313  2257.76     72.7756  292.231    176.307     116.38      176.307     
1 1 1 10 5  9  o 14 419.15  5.0796  3050.46     103.124  3178.79     110.267  237.806    104.973     107.208     284.973     
1 1 1 10 5  10 o 5  538.025 6.24289 5067.68     150.726  5197.48     184.618  424.417    315.198     95.5158     315.198     
1 1 1 10 5  11 o 2  755.983 7.85108 10025       288.609  10248.8     306.181  408.055    253.573     262.32      73.5729     
1 1 1 10 5  12 o 8  389.154 4.51093 2660.92     85.3579  2707.44     90.5512  301.6      49.1977     73.7872     49.1977     
1 1 1 10 5  13 f 0  1357.22 13.6754 32356.6     902.513  33112.6     957.499  1034.01    104.287     0           0           
1 1 1 10 5  14 o 12 688.284 7.19035 8339.16     240.632  8461.72     255.279  414.248    89.6562     149.113     269.656     
1 1 1 10 5  15 o 2  394.757 4.37239 2688.55     86.462   2836.13     86.4899  261.097    206.114     21.471      26.1137     
1 1 1 10 5  16 o 9  928.622 8.972   15086.6     406.459  15509.2     428.556  856.084    319.332     393.333     319.332     
1 1 1 10 5  17 o 16 445.048 4.40216 3500.15     93.6158  3520.61     102.57   318.569    169.528     20.1375     169.528     
1 1 1 10 5  18 o 1  941.89  8.65322 15688.5     398.593  15784       418.127  718.035    131.51      96.7495     131.51      
1 1 1 10 5  19 o 7  663.438 6.26597 7796.89     203.292  7809.59     213.254  530.053    202.851     125.517     202.851     
1 1 1 10 5  20 o 16 581.309 5.47985 5936.92     152.246  6043.47     166.817  459.84     151.779     105.171     151.779     
1 1 1 10 5  21 o 7  539.343 5.00259 5131.98     132.239  5180.23     138.15   280.597    275.961     197.039     95.9608     
1 1 1 10 5  22 f 0  272.493 3.07136 1352.1      40.9795  1280.01     42.8102  176.507    61.7658     0           0           
1 1 1 10 5  23 o 8  418.99  4.19164 3106.59     83.9042  3116.16     91.9504  204.948    135.841     172.012     315.841     
1 1 1 10 5  24 o 1  905.566 7.94289 14492.8     352.523  14598       368.281  630.877    239.292     17.4769     59.2923     
1 1 1 10 5  25 f 0  714.221 6.40785 9026.06     224.299  9063.38     234.319  486.648    86.6488     0           0           
1 1 1 10 5  26 o 13 973.659 8.52237 16679.1     406.716  16960.4     424.898  684.015    201.928     4.19355     21.9289     
1 1 1 10 5  27 o 18 181.765 2.57174 601.97      22.8903  569.159     23.908   32.6053    68.9488     155.678     248.949     
1 1 1 10 5  28 o 3  366.421 3.7221  2404.11     66.8266  2355.18     69.8021  313.352    131.612     149.982     131.612     
1 1 1 10 5  29 o 8  688.137 6.0828  8298.8      200.902  8495.41     218.449  474.32     348.849     9.09548     168.849     
1 1 1 10 5  30 o 8  526.155 5.05705 4872.12     120.675  4943.93     145.065  266.066    156.212     196.107     336.212     
1 1 1 10 5  31 o 17 139.843 2.43429 349.01      15.8547  344.329     18.1533  27.6656    290.898     73.107      110.898     
1 1 1 10 5  32 o 10 942.421 7.98006 15627.4     353.687  15901.2     399.085  698.461    276.915     81.2861     276.915     
1 1 1 10 5  33 o 15 133.73  2.43315 322.795     15.904   311.325     16.666   0.350309   77.2864     152.746     257.287     
1 1 1 10 5  34 o 5  588.373 5.33877 6134.91     143.671  6144.24     170.072  318.88     85.7155     177.585     265.716     
1 1 1 10 5  35 o 3  77.4922 2.36441 104.323     8.2374   108.937     10.0297  32.9826    62.7776     127.339     62.7776     
1 1 1 10 5  36 o 7  298.82  3.22022 1579.71     43.9734  1585.84     52.1415  196.868    151.642     5.66754     331.642     
1 1 1 10 5  37 o 15 313.215 3.24428 1746.38     47.7141  1731.69     53.9172  248.398    334.37      80.1341     334.37      
1 1 1 10 5  38 o 6  305.354 3.12605 1622.38     44.8669  1683.59     50.7228  171.854    294.595     68.1222     114.595     
1 1 1 10 5  39 o 13 91.0579 2.25553 147.907     9.48666  146.357     11.0015  1.55222    128.737     96.4952     128.737     
1 1 1 10 5  40 o 3  631.365 5.39357 6941.78     160.184  7209.79     180.842  472.285    166.363     78.0541     166.363     
1 1 1 10 5  41 o 7  418.064 4.02486 3058.89     82.4412  3141.4      86.2047  323.621    297.635     80.8751     297.635     
1 1 1 10 5  42 o 8  175.499 2.62581 536.849     22.1465  555.194     24.0297  78.4587    42.1488     67.0579     222.149     
1 1 1 10 5  43 f 0  71.3138 2.40971 87.2685     7.78545  93.4911     9.36166  54.7529    9.36839     0           0           
1 1 1 10 5  44 o 18 46.7594 2.71798 35.4034     6.21439  42.824      6.37898  48.0837    320.57      128.117     320.57      
1 1 1 10 5  45 o 4  191.844 2.75052 662.169     26.994   642.944     25.8942  132.215    122.195     20.2359     122.195     
1 1 1 10 5  46 o 4  188.234 2.82548 621.518     23.7888  634.993     29.2893  72.6311    166.095     101.635     346.095     
1 1 1 10 5  47 o 19 67.6807 2.42658 71.1914     7.81102  92.3271     8.57178  2.0427     3.21914     73.3525     3.21914     
1 1 1 10 5  48 o 4  110.753 2.48401 204.186     13.43    231.625     14.102   67.6687    271.494     12.479      271.494     
1 1 1 10 5  49 o 1  160.367 2.55032 453.864     20.559   458.115     20.4321  69.5508    238.177     67.8275     58.1769     
1 1 1 10 5  50 o 8  341.74  3.73453 2088.58     62.4009  2056.56     65.4511  199.193    92.8331     57.2754     272.833     
1 1 1 10 5  51 f 0  165.226 2.73817 497.098     22.0346  471.341     23.2497  95.3259    296.463     0           0           
1 1 1 10 5  52 o 7  500.275 4.96552 4447.21     121.487  4449.14     127.422  364.921    120.652     63.2791     120.652     
1 1 1 10 5  53 o 9  431.384 4.32479 3306.88     93.4936  3303.78     93.4967  327.706    236.552     83.8709     236.552     
1 1 1 10 5  54 o 17 119.501 2.6986  244.046     16.0093  263.203     16.2626  74.79      225.668     12.6388     225.668     
1 1 1 10 5  55 f 0  483.354 4.78319 4152.92     113.08   4153.16     118.579  229.471    230.14      0           0           
1 1 1 10 5  56 o 16 258.812 3.07405 1178.32     39.8713  1198.8      39.8682  196.393    101.201     58.1524     101.201     
1 1 1 10 5  57 o 10 87.9367 2.85161 140.185     13.317   134.807     11.7255  41.8609    277.305     6.51013     97.3052     
1 1 1 10 5  58 o 16 124.246 2.74259 261.011     17.4638  287.626     16.5602  24.409     142.523     107.444     322.523     
1 1 1 10 5  59 o 11 261.849 3.40407 1209.6      43.82    1225.97     45.5127  162.419    342.007     14.2405     162.007     
1 1 1 10 5  60 o 5  217.508 3.02819 810.394     32.7323  870.171     33.2691  127.003    73.9458     26.099      253.946     
1 1 1 10 5  61 o 6  245.24  2.85939 1064.27     36.6313  1071.57     33.5746  187.865    114.671     61.0118     114.671     
1 1 1 10 5  62 o 8  71.2479 2.84057 92.057      10.072   88.8475     10.1269  17.64      97.2497     47.4707     277.25      
1 1 1 10 5  63 o 13 16.2344 4.5423  -2.30831    5.96005  5.30886     5.69509  8.42386    54.663      18.872      54.663      
1 1 1 10 5  64 o 16 152.413 2.70905 407.326     20.7068  418.479     20.656   90.2608    268.474     10.9912     88.4745     
1 1 1 10 5  65 o 5  164.282 2.86852 464.681     24.2206  495.741     22.9088  122.598    236.574     39.7365     236.574     
1 1 1 10 5  66 o 8  97.2544 2.73376 168.084     13.6847  168.877     12.8958  79.6018    320.059     58.0044     320.059     
1 1 1 10 5  67 o 5  207.161 3.15259 777.556     32.7444  752.029     32.7077  180.311    79.1693     101.721     79.1693     
1 1 1 10 5  68 o 11 132.28  2.85192 309.667     18.9425  314.199     18.8227  91.2226    123.405     20.2197     123.405     
1 1 1 10 5  69 o 17 168.126 2.83611 498.541     24.3971  508.794     23.3703  111.69     336.542     13.8279     336.542     
1 1 1 10 5  70 o 9  80.7692 2.8821  110.747     11.6959  122.658     11.5265  43.9205    250.123     9.3733      70.1229     
1 1 1 10 5  71 o 6  62.9353 3.1943  75.5359     10.0004  66.9131     9.98516  35.2277    2.82596     3.66499     182.826     
1 1 1 10 5  72 o 2  49.9315 3.57503 39.463      8.8008   51.2637     8.68418  12.9545    215.843     32.5369     35.843      
1 1 1 10 5  73 o 7  105.203 2.78113 195.698     15.2231  200.409     14.0071  74.3908    290.065     20.7171     290.065     
1 1 1 10 5  74 o 19 71.5857 2.97188 96.4585     11.0078  87.8222     10.2261  26.9561    47.2956     32.3077     227.296     
1 1 1 10 5  75 o 19 95.5133 2.88775 167.401     14.6613  160.071     12.8952  54.0449    209.075     7.65225     29.0749     
1 1 1 10 5  76 o 11 139.507 2.73202 367.75      19.2603  330.237     18.8799  101.883    356.288     33.9538     356.288     
1 1 1 10 5  77 f 0  87.0042 2.82685 138.025     12.4396  133.968     12.146   55.0891    100.533     0           0           
1 1 1 10 5  78 o 7  82.2028 3.08438 125.835     12.8004  117.968     12.5184  54.7301    102.244     11.9187     102.244     
1 1 1 10 5  79 o 15 50.4159 4.04643 44.6411     9.99481  49.116      10.0723  24.4739    117.112     9.04805     297.112     
1 1 1 10 5  80 o 4  43.5081 4.21773 39.1596     9.33217  31.6018     8.5597   28.282     107.564     9.1866      107.564     
1 1 1 10 5  81 o 4  72.7726 3.54806 97.0032     12.708   96.7016     13.01    42.8319    193.776     0.0299365   193.774     
1 1 1 10 5  82 f 0  70.8733 3.41571 122.691     13.1747  65.5358     10.677   42.9292    268.363     0           0           
1 1 1 10 5  83 o 9  52.2578 5.68205 52.3235     15.0647  54.5237     13.6533  24.7689    95.8238     10.1568     275.824     
1 1 1 10 5  84 o 3  52.2789 6.30372 49.0377     17.1335  60.7205     14.121   30.3243    7.65978     2.05353     7.65981     
1 1 1 10 5  85 f 0  83.2069 4.54018 134.259     21.0898  127.327     16.1958  38.2861    265.446     0           0           
1 1 1 10 5  86 o 11 81.3937 4.73711 122.9       21.3294  129.245     16.3358  61.7227    324.367     31.0849     324.367     
1 1 1 10 5  87 o 16 32.1738 7.585   16.5907     16.6903  25.349      13.0493  15.1689    144.716     4.7666      144.716     
1 1 1 10 5  88 o 3  24.6795 7.14229 4.81704     15.7361  9.96046     12.738   7.89234    6.87588     0.475813    186.876     
1 1 1 10 5  89 o 9  21.7513 6.75916 14.7766     17.6542  -17.1734    11.6412  3.83076    71.1575     10.2724     251.157     
1 1 1 10 5  90 f 0  33.1563 8.95829 1.50857     30.2388  33.6999     18.6475  20.2179    343.471     0           0           
1 1 1 10 5  91 o 9  27.4666 8.72055 0.590702    34.6328  9.90882     17.5538  8.41058    224.696     1.98015     44.6959     
1 1 1 10 5  92 o 14 28.0202 10.1812 3.38255     100.849  -30.9433    27.8403  4.69078    298.222     0.815983    118.221     
1 1 1 10 5  93 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 6  0  o 6  658.572 6.08026 7691.14     200.595  7691.14     200.595  602.089    180         251.686     180         
1 1 1 10 6  1  o 15 783.206 7.49912 10951.8     279.145  10807.6     308.586  554.69     67.6913     10.3574     247.692     
1 1 1 10 6  2  o 3  328.891 3.69102 1922.42     60.8385  1911.63     60.8325  222.777    158.177     4.49627     158.177     
1 1 1 10 6  3  o 5  151.103 2.57916 404.713     19.53    404.464     19.5309  5.44697    20.1113     181.986     20.1112     
1 1 1 10 6  4  o 3  571.273 5.79357 5774.27     170.162  5797.29     161.432  369.162    163.594     71.1163     343.594     
1 1 1 10 6  5  o 9  1175.38 12.1817 24658.8     717.518  24423.5     717.551  794.615    129.544     101.553     309.544     
1 1 1 10 6  6  o 16 419.169 5.04889 3133.79     102.442  3095.18     109.51   172.396    196.403     243.798     16.4029     
1 1 1 10 6  7  o 15 201.534 3.15768 718.301     31.8879  721.205     31.8951  32.877     266.588     192.658     86.5881     
1 1 1 10 6  8  f 0  815.455 8.94327 11967.9     352.9    11627.9     377.233  623.423    98.9536     0           0           
1 1 1 10 6  9  o 19 406.537 5.30408 2918.19     103.837  2941.04     112.157  203.359    221.157     161.248     41.1567     
1 1 1 10 6  10 o 12 585.309 6.81395 6088.68     199.882  6060.04     199.855  362.227    102.985     105.437     282.985     
1 1 1 10 6  11 o 3  601.838 6.37896 6464.8      186.625  6378.62     197.913  385.458    345.273     82.524      165.273     
1 1 1 10 6  12 o 7  952.017 8.92375 16236.3     425.759  15920       425.707  707.383    233.81      53.251      233.81      
1 1 1 10 6  13 o 3  727.845 6.81258 9485.74     242.452  9300.24     254.255  444.303    264.052     148.412     84.052      
1 1 1 10 6  14 o 18 503.998 4.82791 4543.1      121.943  4461.48     121.931  449.793    174.972     199.952     174.972     
1 1 1 10 6  15 o 15 786.545 6.99102 10947.3     269.528  10991.4     281.496  433.717    148.239     254.165     328.239     
1 1 1 10 6  16 o 8  679.159 6.25793 8261.41     202.986  8093.85     222.341  550.449    118.323     140.272     118.323     
1 1 1 10 6  17 o 17 949.042 8.48352 16124.9     403.47   15827.7     403.464  816.113    322.72      281.588     322.72      
1 1 1 10 6  18 o 5  931.655 8.33529 15287.7     389.114  15504       389.207  471.827    144.582     385.067     324.582     
1 1 1 10 6  19 o 8  499.656 4.80003 4400.74     125.49   4449.45     114.583  303.662    253.04      93.9814     73.0402     
1 1 1 10 6  20 o 17 1090.55 9.72396 21233.1     531.41   20977.4     531.442  723.144    11.0209     107.027     191.021     
1 1 1 10 6  21 o 4  1019.44 8.91458 18539.1     445.353  18337.7     465.173  698.935    18.0055     51.2694     198.005     
1 1 1 10 6  22 o 4  726.619 6.48427 9465.41     230.862  9258.01     241.125  586.414    36.4171     148.987     36.417      
1 1 1 10 6  23 f 0  1472.44 12.7332 39026.1     918.61   38024.3     959.451  1069.34    355.751     0           0           
1 1 1 10 6  24 o 9  736.817 6.55254 9619.04     236.639  9634.31     247.159  572.625    149.511     109.56      149.511     
1 1 1 10 6  25 o 16 681.095 6.01831 8246.33     196.653  8203.58     213.784  419.123    232.721     118.303     52.7213     
1 1 1 10 6  26 o 6  876.348 7.57968 13676.8     318.652  13569.2     346.413  714.061    305.005     196.586     305.005     
1 1 1 10 6  27 o 17 519.846 4.78135 4810.47     119.24   4770.46     129.622  386.839    153.376     57.0949     153.376     
1 1 1 10 6  28 o 14 561.971 5.09183 5567.84     137.324  5629.9      149.288  316.791    124.199     147.759     304.199     
1 1 1 10 6  29 o 17 286.562 3.11956 1481.48     42.8565  1429.37     46.5869  185.944    58.1149     0.672261    58.1162     
1 1 1 10 6  30 o 17 909.989 7.87396 14759.7     343.721  14631.9     373.672  644.704    26.0053     14.3613     26.0053     
1 1 1 10 6  31 o 8  288.518 3.12939 1474.24     43.3267  1476.38     47.0921  217.682    134.798     62.5177     134.798     
1 1 1 10 6  32 o 7  391.679 3.90231 2730.94     74.9047  2708.02     78.2378  242.537    48.8091     50.1675     228.809     
1 1 1 10 6  33 o 4  538.369 5.05563 5093.5      127.258  5186.66     145.109  360.708    242.152     23.8191     62.1522     
1 1 1 10 6  34 o 8  179.8   2.48021 590.582     21.37    555.534     23.2158  4.07889    110.146     244.426     110.146     
1 1 1 10 6  35 o 3  65.0341 2.41728 82.2188     7.47661  68.4263     8.10035  25.7796    233.067     85.5174     233.067     
1 1 1 10 6  36 o 9  471.948 4.30344 3995.43     99.703   3904.38     103.763  384.544    7.41397     122.541     7.41397     
1 1 1 10 6  37 o 6  208.702 2.6525  787.536     26.5218  756.637     28.8584  89.0749    160.698     96.6753     340.698     
1 1 1 10 6  38 o 15 62.6611 2.45295 71.6822     7.32264  67.9526     7.98499  9.0181     232.313     39.9636     232.313     
1 1 1 10 6  39 o 1  194.642 2.62152 670.462     23.8167  672.612     27.2176  137.261    242.264     29.4254     242.264     
1 1 1 10 6  40 o 3  310.132 3.26039 1701.06     51.7217  1709.65     49.5964  186.051    16.4357     46.1302     196.436     
1 1 1 10 6  41 o 16 219.939 2.68414 851.401     28.2723  863.666     30.8578  179.621    101.027     82.0767     101.027     
1 1 1 10 6  42 o 3  677.139 5.9292  7925.41     183.951  8369.81     217.829  502.509    25.4655     78.0167     25.4655     
1 1 1 10 6  43 o 3  441.751 4.33322 3412.31     94.6697  3513.76     97.1926  341.415    66.9004     84.5023     66.9004     
1 1 1 10 6  44 o 11 203.259 2.68398 696.595     26.1311  769.226     28.5638  141.157    354.069     20.3415     354.069     
1 1 1 10 6  45 o 17 477.894 4.57323 4062.24     102.048  4046.06     116.494  322.989    55.6174     2.39212     235.618     
1 1 1 10 6  46 o 5  361.119 3.60597 2278.49     63.7694  2348.67     66.7459  218.912    316.879     49.5519     136.879     
1 1 1 10 6  47 o 12 512.125 4.77224 4638.89     122.398  4676.81     122.557  360.926    210.948     29.0782     210.948     
1 1 1 10 6  48 o 15 363.989 3.7669  2350.3      69.8293  2351.75     67.5759  296.476    0.692862    106.073     0.692862    
1 1 1 10 6  49 o 12 370.735 3.76091 2440.94     72.5255  2437.44     67.1214  285.811    116.565     76.3033     116.565     
1 1 1 10 6  50 o 1  299.996 3.40162 1594.6      49.8771  1598.99     52.3758  223.814    206.79      50.5286     206.79      
1 1 1 10 6  51 o 16 110.87  2.58934 224.426     13.5167  212.09      15.1172  34.0931    51.4294     67.3381     231.429     
1 1 1 10 6  52 o 10 194.653 2.90169 667.783     27.517   676.389     29.0818  88.3671    282.623     76.5248     102.623     
1 1 1 10 6  53 o 7  190.825 2.81785 636.499     26.8923  655.357     26.9993  129.295    128.105     14.6092     128.105     
1 1 1 10 6  54 o 2  375.127 4.08499 2467.1      72.8698  2531.56     80.6127  253.194    69.4332     10.9306     69.4332     
1 1 1 10 6  55 o 5  509.179 5.44024 4612.38     130.818  4616.09     146.382  368.668    134.46      63.8105     134.46      
1 1 1 10 6  56 o 2  142.746 2.62956 355.61      18.3188  367.808     19.2709  91.1641    311.177     6.40566     311.177     
1 1 1 10 6  57 o 8  144.959 2.73248 358.377     20.2753  387.826     19.3301  90.5375    61.3081     0.723303    61.3079     
1 1 1 10 6  58 o 16 188.981 2.89724 634.067     26.6923  633.656     28.1648  134.021    211.589     27.0774     211.589     
1 1 1 10 6  59 o 7  86.1091 3.04143 137.324     12.339   126.734     13.7154  48.1199    34.1818     0.73539     214.182     
1 1 1 10 6  60 o 12 157.149 2.803   447.191     21.6632  430.056     22.4372  86.4041    247.95      27.1425     67.9498     
1 1 1 10 6  61 o 14 151.107 2.67298 409.587     19.332   401.533     21.0742  123.623    320.418     59.9367     320.418     
1 1 1 10 6  62 o 17 154.693 2.85594 447.933     21.0103  403.23      23.0415  105.033    227.251     15.417      227.251     
1 1 1 10 6  63 o 15 54.558  3.19514 60.7938     8.43043  46.3012     8.70386  17.694     323.214     17.035      143.214     
1 1 1 10 6  64 o 13 94.6322 2.75043 152.158     12.4193  166.905     13.6194  72.4925    184.694     38.2087     184.694     
1 1 1 10 6  65 o 15 89.8263 2.59444 143.592     11.476   143.739     11.8303  50.6552    49.935      6.06235     229.935     
1 1 1 10 6  66 o 5  67.276  3.09566 83.3319     10.0444  78.6122     10.6785  39.8948    230.002     19.7024     230.002     
1 1 1 10 6  67 o 14 25.0958 5.18885 9.79785     6.76234  13.3263     7.17613  10.9044    80.6284     34.7922     80.6284     
1 1 1 10 6  68 o 19 116.616 2.69478 246.434     15.7095  238.394     15.7414  73.0576    108.894     3.09759     108.894     
1 1 1 10 6  69 o 12 203.615 2.94242 757.594     30.9004  721.375     29.1522  124.848    170.229     6.32773     350.229     
1 1 1 10 6  70 o 5  97.3351 2.71071 170.378     13.4805  167.936     12.91    61.5538    309.567     3.49702     309.567     
1 1 1 10 6  71 o 18 47.5381 3.51239 42.3237     8.39511  39.5663     8.09368  26.9912    44.9936     2.23595     44.9936     
1 1 1 10 6  72 o 5  71.8468 2.95512 89.77       10.8002  95.4987     10.3603  51.9856    21.5355     19.3794     21.5355     
1 1 1 10 6  73 o 14 69.4896 2.91862 88.139      10.2278  85.3061     10.0087  42.4295    281.039     2.25858     281.039     
1 1 1 10 6  74 o 4  19.9137 4.83625 11.3725     6.5111   -0.680584   6.55662  0.141565   166.76      3.69929     166.76      
1 1 1 10 6  75 o 3  85.7774 2.89912 128.929     12.2898  135.461     12.5621  54.5648    118.205     5.91357     118.205     
1 1 1 10 6  76 o 5  135.362 2.86251 336.95      19.7658  320.796     19.029   102.648    230.454     40.6006     230.454     
1 1 1 10 6  77 o 7  120.855 3.0377  265.586     18.7837  260.079     17.951   82.6488    303.123     18.9465     303.123     
1 1 1 10 6  78 o 11 20.5719 5.08614 -2.18448    7.81025  12.1848     7.02392  4.72046    290.331     28.8012     290.331     
1 1 1 10 6  79 o 5  111.07  3.05982 233.804     17.4128  211.912     16.5847  79.2886    307.302     25.1984     307.302     
1 1 1 10 6  80 o 9  43.1668 4.70808 34.9224     9.8339   35.5231     9.88132  28.76      345.936     10.8403     345.936     
1 1 1 10 6  81 o 9  37.3905 4.96007 22.8323     9.4422   31.162      8.28024  17.0157    41.5615     7.13358     221.562     
1 1 1 10 6  82 o 8  23.1821 5.8877  7.77107     9.96938  10.3496     7.70367  3.33602    35.6467     30.8117     35.6467     
1 1 1 10 6  83 o 19 31.337  6.35244 25.801      10.5533  13.6137     11.2398  15.5001    257.67      1.83187     257.67      
1 1 1 10 6  84 o 19 23.9411 6.37801 9.20222     10.1118  9.89992     10.7269  0.539127   84.8573     22.4051     264.857     
1 1 1 10 6  85 o 11 44.0802 6.40234 38.5993     14.4678  40.8055     12.8419  23.7693    106.682     0.210632    106.682     
1 1 1 10 6  86 o 10 35.4212 6.933   24.234      13.8321  28.4228     11.8459  18.9758    179.567     5.99127     179.567     
1 1 1 10 6  87 o 3  33.4744 8.01433 27.3441     18.7325  20.8752     13.3178  15.188     316.874     2.73588     136.874     
1 1 1 10 6  88 o 7  22.4022 6.92477 -1.8979     17.6941  3.91535     12.1765  5.55629    156.714     5.62125     336.714     
1 1 1 10 6  89 o 9  36.0233 9.26236 54.9526     29.2361  13.0314     14.1377  18.9029    66.2256     10.6872     66.2256     
1 1 1 10 6  90 o 3  22.9024 7.53549 -25.8833    28.7907  1.35393     16.0214  3.20697    140.384     12.8993     320.384     
1 1 1 10 6  91 o 9  26.9912 8.0441  -36.2425    30.3196  23.8633     17.8262  5.63777    321.761     0.0328026   321.761     
1 1 1 10 6  92 o 11 28.9154 9.53993 23.0283     35.7627  -11.2001    32.3978  6.64407    220.022     1.25119     40.0215     
1 1 1 10 6  93 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 7  0  o 5  927.015 11.3224 15255.2     525.647  15255.2     525.647  601.298    180         139.206     1.1103e-05  
1 1 1 10 7  1  o 9  446.45  5.48753 3540.6      122.774  3525.81     122.775  281.486    223.259     63.6511     43.2592     
1 1 1 10 7  2  o 5  467.365 5.95865 3837.01     134.122  3907.78     144.882  245.714    76.5936     168.763     256.594     
1 1 1 10 7  3  o 15 606.625 7.07055 6517.41     214.946  6533.08     214.95   546.219    288.83      236.249     288.83      
1 1 1 10 7  4  o 17 1572.68 17.3547 43979.7     1367.77  44077.4     1367.81  1081.47    330.142     106.761     150.142     
1 1 1 10 7  5  o 1  498.436 5.88644 4351.73     131.651  4457        161.262  420.548    278.503     144.26      278.503     
1 1 1 10 7  6  o 15 321.772 3.84042 1832.96     61.9242  1836.81     61.9317  71.4387    26.0808     304.802     206.081     
1 1 1 10 7  7  f 0  791.254 7.35183 11150.8     284.475  11053.5     298.339  580.509    255.208     0           0           
1 1 1 10 7  8  o 17 938.406 8.5976  15579.5     394.598  15660.4     413.866  709.281    317.423     72.7755     317.423     
1 1 1 10 7  9  o 3  935.408 8.76834 15489.5     411.012  15552.5     411.057  574.066    37.4832     194.518     217.483     
1 1 1 10 7  10 o 19 345.091 3.97032 2128.15     68.662   2092.93     68.6596  222.168    344.211     28.2088     164.211     
1 1 1 10 7  11 o 1  421.888 4.62976 3102.73     97.8673  3206.99     97.8829  228.16     79.8886     135.129     259.889     
1 1 1 10 7  12 o 11 1077.79 10.0315 20596.6     541.819  20629.8     541.84   934.513    349.091     325.214     349.091     
1 1 1 10 7  13 o 3  508.906 5.09982 4633.55     130.059  4547.71     130.057  453.83     142.975     198.191     142.975     
1 1 1 10 7  14 o 5  590.398 5.75628 6184.85     170.307  6173.43     170.319  496.873    0.373287    161.448     0.373287    
1 1 1 10 7  15 o 1  617.203 5.85933 6787.92     185.521  6718.44     176.882  354.989    345.439     166.765     165.439     
1 1 1 10 7  16 o 2  655.873 6.36549 7755.84     209.237  7498.69     209.168  476.918    79.435      23.7042     79.435      
1 1 1 10 7  17 o 5  136.936 2.42342 327.151     15.8638  337.653     17.3686  24.3143    185.386     212.637     185.386     
1 1 1 10 7  18 o 9  621.655 5.80258 6946.29     172.266  6756.58     188.652  301.974    336.68      278.44      156.68      
1 1 1 10 7  19 o 10 555.305 5.16203 5535.46     133.864  5397.15     152.576  486.207    84.1693     196.062     84.1693     
1 1 1 10 7  20 o 10 599.304 5.63808 6506.83     161.296  6229.11     176.626  299.909    195.546     247.585     15.5461     
1 1 1 10 7  21 f 0  398.493 3.95385 2854.27     73.573   2774.69     83.8523  131.44     341.376     0           0           
1 1 1 10 7  22 o 13 1011.61 9.28097 18440.8     459.04   17882.6     481.284  669.81     187.703     97.2359     7.70277     
1 1 1 10 7  23 o 17 608.77  5.59211 6672.59     158.942  6468.73     181.164  394.808    230.345     65.1478     50.3453     
1 1 1 10 7  24 f 0  376.287 3.82266 2558.21     67.1419  2461.2      76.5211  200.016    356.784     0           0           
1 1 1 10 7  25 o 9  518.103 4.88197 4833.98     118.095  4683.54     134.595  352.119    75.6386     14.7591     255.639     
1 1 1 10 7  26 o 3  474.135 4.57574 4052.23     101.283  3918.21     115.441  385.619    255.648     123.241     255.648     
1 1 1 10 7  27 o 15 415.733 4.08057 3056.47     83.1526  3070.51     86.8456  316.692    57.818      68.9152     57.818      
1 1 1 10 7  28 o 7  841.06  7.62344 12571.7     306.336  12532.3     335.588  735.359    203.053     292.315     203.053     
1 1 1 10 7  29 o 10 153.938 2.44248 425.077     18.0414  414.815     19.5906  0.758592   55.6927     185.782     235.692     
1 1 1 10 7  30 o 7  404.482 4.00884 2895.18     79.4821  2905.19     83.0062  357.554    230.043     169.665     230.043     
1 1 1 10 7  31 o 4  778.033 6.79675 10801.3     253.666  10682.5     275.759  560.795    25.1081     32.9891     25.1081     
1 1 1 10 7  32 o 8  416.505 4.20521 3070.14     83.7074  3081.15     91.6742  319.18     233.977     67.5237     233.977     
1 1 1 10 7  33 o 2  278.867 3.13177 1419.7      42.7706  1337.73     44.6577  131.049    297.985     114.943     117.985     
1 1 1 10 7  34 o 10 332.53  3.35344 1970.92     54.7556  1949.42     56.9754  47.719     156.752     362.67      336.752     
1 1 1 10 7  35 o 4  124.58  2.24917 286.599     13.7654  263.94      14.2617  48.547     289.859     5.04239     289.859     
1 1 1 10 7  36 o 12 237.326 2.80725 1014.71     33.3977  982.123     33.3716  201.461    223.991     100.459     223.991     
1 1 1 10 7  37 o 15 319.914 3.25875 1824.8      51.1862  1804.13     53.2695  279.212    26.6542     130.166     26.6542     
1 1 1 10 7  38 o 15 250.137 2.79196 1087.05     34.9871  1131.43     34.9993  191.709    280.818     54.5184     280.818     
1 1 1 10 7  39 o 13 88.1671 2.20728 136.342     9.73352  139.564     9.74012  8.09136    260.93      64.343      80.9297     
1 1 1 10 7  40 o 4  152.523 2.38393 406.188     17.8016  418.558     18.6416  87.848     228.35      7.56869     48.3503     
1 1 1 10 7  41 o 3  101.41  2.29101 180.766     11.6095  184.19      11.6464  30.7489    322.952     31.4887     142.952     
1 1 1 10 7  42 f 0  248.207 2.8711  1064.87     34.1972  1120.06     37.2234  107.777    127.828     0           0           
1 1 1 10 7  43 o 9  137.46  2.32331 321.196     15.9546  348.982     16.0372  88.9047    21.9039     20.2468     21.9039     
1 1 1 10 7  44 o 6  553.955 4.96056 5302.08     131.916  5598.47     143.499  413.245    153.87      71.3495     153.87      
1 1 1 10 7  45 o 6  110.513 2.23243 196.68      12.4195  237.64      12.1743  16.4947    148.739     11.1234     148.739     
1 1 1 10 7  46 o 3  282.215 2.93449 1361.87     40.7857  1463.89     42.2181  172.209    127.799     34.3642     307.799     
1 1 1 10 7  47 o 9  210.332 2.62236 767.848     29.1767  801.173     25.932   144.701    23.954      13.3472     23.954      
1 1 1 10 7  48 o 5  122.618 2.35653 273.233     15.6367  260.361     13.2496  42.2412    211.455     69.5674     31.455      
1 1 1 10 7  49 o 18 58.1161 2.14376 60.9439     6.34601  59.1391     6.09815  28.3054    50.7823     117.915     50.7823     
1 1 1 10 7  50 o 2  389.384 3.85107 2663.97     76.6858  2719.05     73.5397  325.566    52.8352     132.031     52.8352     
1 1 1 10 7  51 o 13 184.876 2.66334 598.488     24.5578  613.868     24.7928  148.449    65.6376     63.7435     65.6376     
1 1 1 10 7  52 f 0  249.351 3.03779 1102        39.5556  1104.07     36.2913  120.156    245.526     0           0           
1 1 1 10 7  53 o 7  330.425 3.48976 1924.67     60.2548  1951.06     55.1694  226.085    294.006     15.5065     294.006     
1 1 1 10 7  54 o 16 161.954 2.59828 465.308     20.5479  465.101     21.6147  118.848    325.354     36.0289     325.354     
1 1 1 10 7  55 o 12 80.1942 2.80796 113.22      10.9497  115.527     11.5468  19.7031    187.373     49.54       7.37305     
1 1 1 10 7  56 o 11 89.5915 2.73506 148.04      12.1504  137.4       12.3308  49.2981    118.521     14.0862     118.521     
1 1 1 10 7  57 o 13 270.868 3.64694 1296.44     51.0331  1310.42     47.9086  182.207    279.906     11.1915     279.906     
1 1 1 10 7  58 o 9  214.583 3.17806 825.806     34.3644  809.587     33.9873  157.963    342.85      39.263      342.85      
1 1 1 10 7  59 o 19 305.913 3.92731 1656.25     58.5392  1672.7      61.8457  229.559    339.241     60.8811     339.241     
1 1 1 10 7  60 o 5  267.557 3.40699 1266.18     44.609   1279.02     46.7403  188.416    352.14      30.1961     352.14      
1 1 1 10 7  61 o 13 110.882 2.71092 224.967     15.0907  212.354     14.9853  75.4548    33.7888     16.3909     33.7888     
1 1 1 10 7  62 o 18 103.655 2.65006 194.198     13.4317  188.027     14.0352  80.5745    296.979     40.8446     296.979     
1 1 1 10 7  63 o 10 67.4036 2.92564 84.4919     9.98143  77.7431     9.68519  21.4007    238.669     35.1723     58.6692     
1 1 1 10 7  64 f 0  142.334 2.60901 372.689     18.0958  347.985     19.0427  84.5634    338.589     0           0           
1 1 1 10 7  65 o 14 125.138 2.48161 286.016     15.9113  271.261     15.1857  76.5038    101.426     2.49533     281.426     
1 1 1 10 7  66 o 1  64.2006 2.88229 68.3825     9.60018  79.1909     8.71843  37.0887    30.0767     14.5856     30.0767     
1 1 1 10 7  67 f 0  81.4119 2.70277 115.657     10.8853  120.893     11.1068  46.8641    86.216      0           0           
1 1 1 10 7  68 o 3  23.7583 4.45797 16.2412     5.94839  4.40816     5.7264   10.5517    289.577     37.4557     289.577     
1 1 1 10 7  69 o 4  107.483 2.76167 205.021     14.1956  207.446     15.4842  69.7801    37.9433     6.71182     37.9433     
1 1 1 10 7  70 o 16 105.19  2.52334 202.934     13.504   191.984     13.0621  66.113     164.367     2.16439     164.367     
1 1 1 10 7  71 o 9  136.604 2.81169 340.903     18.8182  326.378     19.6043  108.095    228.572     47.0715     228.572     
1 1 1 10 7  72 o 19 63.1325 3.38091 68.0631     9.92377  75.9251     11.3165  30.9921    73.1416     13.3383     253.142     
1 1 1 10 7  73 o 2  102.099 2.94766 186.061     14.248   188.018     15.8173  59.5185    191.472     6.10807     11.4716     
1 1 1 10 7  74 o 12 62.5664 3.63661 72.2876     11.2234  69.8335     11.3738  47.6845    293.451     24.1191     293.451     
1 1 1 10 7  75 o 1  103.204 2.93251 191.765     14.8103  190.968     15.4529  64.9432    80.8093     4.31523     80.8093     
1 1 1 10 7  76 o 5  70.581  3.15341 90.0796     10.7897  89.8017     11.3938  33.1649    119.479     18.162      299.479     
1 1 1 10 7  77 f 0  50.1162 3.70739 47.8176     8.96333  44.1362     9.34507  28.3018    251.37      0           0           
1 1 1 10 7  78 o 2  21.4731 5.25745 1.33258     7.64335  12.3803     7.31274  4.62819    206.976     30.7295     206.976     
1 1 1 10 7  79 o 11 58.1762 3.94167 70.8512     12.1896  54.3927     10.5199  32.3265    184.92      3.53398     4.92021     
1 1 1 10 7  80 o 9  15.4872 4.95601 1.31324     9.87646  -6.99499    6.15154  1.26154    195.638     10.4097     195.638     
1 1 1 10 7  81 o 12 35.0091 5.54182 29.2814     11.7098  19.5882     7.31678  6.56486    132.422     26.2507     312.422     
1 1 1 10 7  82 o 4  33.194  6.12763 23.2915     11.9998  21.2203     8.67906  17.2759    209.54      1.41731     209.54      
1 1 1 10 7  83 o 18 21.2524 6.01145 13.0858     11.1876  -6.93818    10.1046  3.84792    355.836     5.11099     175.836     
1 1 1 10 7  84 o 13 38.3224 6.75729 26.0069     14.0898  35.0443     12.1094  11.0993    348.214     19.7998     168.214     
1 1 1 10 7  85 o 1  82.6037 5.06708 117.041     22.6894  145.694     17.2959  51.8009    312.054     8.1663      312.054     
1 1 1 10 7  86 o 7  42.0988 6.97042 24.5161     17.3634  49.6698     12.8821  20.3874    48.7209     4.67021     228.721     
1 1 1 10 7  87 o 3  23.6946 6.97911 6.11078     14.9046  6.11225     12.5713  4.81009    198.362     12.353      18.362      
1 1 1 10 7  88 o 10 23.2994 6.78864 1.40636     13.3523  10.5155     12.7656  6.74573    304.723     2.69864     124.722     
1 1 1 10 7  89 o 13 24.5303 7.22883 11.9512     13.6613  0.8799      16.8714  7.70788    137.179     2.66648     317.179     
1 1 1 10 7  90 o 16 39.2411 9.21307 45.6041     21.7229  33.3972     20.918   21.9723    56.7788     7.33361     56.7788     
1 1 1 10 7  91 o 8  31.7429 8.95362 -1.10708    31.8037  33.809      19.502   9.8861     9.08878     2.72943     9.08877     
1 1 1 10 7  92 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 8  0  o 11 971.024 8.92569 16724.6     434.177  16724.6     434.177  821.264    180         235.817     180         
1 1 1 10 8  1  o 11 776.927 7.39594 10690.6     287.962  10716.9     287.961  574.419    86.9928     34.9743     86.9928     
1 1 1 10 8  2  o 14 1265.7  11.758  28378.7     745.809  28508.9     745.805  1037.73    104.135     250.034     104.135     
1 1 1 10 8  3  o 1  180.779 2.81131 584.719     26.1373  573.537     24.7948  18.9241    151.325     192.445     331.325     
1 1 1 10 8  4  o 9  205.219 2.94133 773.159     31.065   719.893     29.4418  124.862    106.68      39.36       106.68      
1 1 1 10 8  5  o 19 431.293 4.50535 3272.22     92.4114  3321.48     102.169  370.639    158.112     144.664     158.112     
1 1 1 10 8  6  o 12 493.219 4.72287 4307.86     116.733  4315.42     116.74   386.854    146.719     80.0204     146.719     
1 1 1 10 8  7  o 2  235.294 2.96825 985.672     35.8267  976.463     34.1614  97.6326    81.0241     115.4       261.024     
1 1 1 10 8  8  o 5  1318.27 12.2468 30597.5     767.843  31127.9     848.912  1025.78    156.384     152.1       156.384     
1 1 1 10 8  9  o 5  164.059 2.59133 482.822     21.8073  471.087     20.801   6.28315    146.225     219.794     146.225     
1 1 1 10 8  10 o 15 1317.51 11.6088 30728.6     766.469  30912.2     766.494  1026.1     258.868     155.58      258.868     
1 1 1 10 8  11 o 4  555.014 5.47466 5401.25     152.251  5520.01     152.281  486.869    125.576     192.164     125.576     
1 1 1 10 8  12 o 8  946.02  8.8481  15694.8     419.414  16059.8     419.504  722.541    222.884     89.055      222.884     
1 1 1 10 8  13 o 1  305.141 3.35287 1635.76     51.2628  1664.41     51.2779  264.171    302.412     133.71      302.412     
1 1 1 10 8  14 o 10 992.655 9.02955 17229.3     438.41   17737.6     459.943  809.831    163.737     198.408     163.737     
1 1 1 10 8  15 o 13 431.979 4.36107 3330.86     96.6424  3283.94     92.1515  322.14     159.771     42.0606     159.771     
1 1 1 10 8  16 o 16 1185.51 10.6801 24765.2     649.259  25136.3     619.159  789.461    273.814     120.24      93.8138     
1 1 1 10 8  17 o 2  185.084 2.68868 597.404     25.5034  616.728     24.3365  53.1508    175.415     125.145     355.415     
1 1 1 10 8  18 o 14 575.845 5.52547 5792.09     163.116  5965.38     155.565  354.103    107.17      105.825     287.17      
1 1 1 10 8  19 o 9  781.713 7.19406 10771.6     288.385  10903.1     275.02   622.023    163.929     135.161     163.929     
1 1 1 10 8  20 o 4  973.391 8.69684 16640.1     442.847  16984.1     404.32   710.93     53.4292     36.335      53.4292     
1 1 1 10 8  21 o 16 150.831 2.43514 404.454     18.7857  401.815     18.0221  36.1573    164.078     76.2473     344.078     
1 1 1 10 8  22 o 10 579.581 5.31732 5865.29     157.675  6045.76     151.011  448.885    326.867     87.2164     326.867     
1 1 1 10 8  23 o 3  692.108 6.06247 8488.87     210.257  8498.87     210.29   481.06     125.324     12.5627     305.324     
1 1 1 10 8  24 o 14 643.192 5.68084 7394.25     183.096  7276.42     183.117  545.268    181.558     192.298     181.558     
1 1 1 10 8  25 o 15 245.831 2.84238 1046.84     34.9925  1095.35     35.0287  128.453    117.226     58.2141     297.226     
1 1 1 10 8  26 o 15 535.405 4.99872 5092.53     131.165  5072        137.005  441.103    158.543     140.19      158.543     
1 1 1 10 8  27 o 17 695.732 6.26615 8514.65     213.69   8656.73     223.225  462.021    242.451     53.4418     62.4507     
1 1 1 10 8  28 o 10 378.167 3.8157  2540.79     70.7162  2529.14     73.8683  214.965    289.527     90.1109     109.527     
1 1 1 10 8  29 o 15 824.1   7.33243 12065       296.146  12043.2     309.341  631.103    175.364     104.12      175.364     
1 1 1 10 8  30 o 6  483.586 4.5938  4128.15     108.879  4165.04     113.745  284.446    85.9435     104.357     265.943     
1 1 1 10 8  31 f 0  683.434 6.19375 8290.22     207.458  8285.87     216.707  371.863    242.188     0           0           
1 1 1 10 8  32 o 5  209.217 2.69137 769.538     27.584   782.064     28.8473  163.916    70.9901     75.217      70.9901     
1 1 1 10 8  33 o 17 776.359 6.66356 10563.2     254.048  10839.7     264.463  583.882    123.236     82.7672     123.236     
1 1 1 10 8  34 o 1  478.398 4.37665 3990.76     102.818  4127.65     107.045  293.782    272.156     75.7289     92.1555     
1 1 1 10 8  35 o 18 428.262 4.00199 3246.47     84.1471  3258.46     87.6054  294.321    186.937     2.00405     6.93736     
1 1 1 10 8  36 o 13 186.899 2.57274 591.89      24.0668  647.04      24.0926  105.864    141.472     29.8855     321.472     
1 1 1 10 8  37 o 2  316.447 3.37433 1752.49     52.3222  1798.8      54.699   289.718    252.433     157.531     252.433     
1 1 1 10 8  38 o 11 405.489 3.83329 2876.19     79.3884  2956.53     76.3182  257.93     217.882     40.1935     37.8824     
1 1 1 10 8  39 o 15 229.812 3.05402 941.166     37.6015  931.659     32.5893  180.065    139.754     62.4663     139.754     
1 1 1 10 8  40 o 13 122.472 2.31937 262.068     14.7825  270.095     13.6183  37.5585    106.322     70.1375     286.322     
1 1 1 10 8  41 o 9  302.6   3.14416 1603.23     48.5954  1644.36     46.7159  238.295    228.047     71.1585     228.047     
1 1 1 10 8  42 o 19 255.97  3.00072 1155.23     39.2935  1168.42     37.6636  188.132    321.968     35.6757     321.968     
1 1 1 10 8  43 o 8  115.001 2.27084 233.574     13.2938  235.664     12.849   67.8731    350.367     9.04021     350.367     
1 1 1 10 8  44 o 4  621.057 5.52699 6664.11     171.915  7047.94     172.028  426.665    293.973     3.72255     293.973     
1 1 1 10 8  45 o 10 335.756 3.33619 1932.96     57.1501  2067.61     54.978   261.485    187.764     70.0603     187.764     
1 1 1 10 8  46 o 4  515.878 5.01228 4560.36     132.381  4899.27     126.369  319.275    340.311     62.8192     160.311     
1 1 1 10 8  47 o 9  109.461 2.29946 202.284     12.7794  223.19      12.3734  68.2409    230.022     18.0916     230.022     
1 1 1 10 8  48 o 7  106.447 2.30277 198.741     12.9804  203.435     11.4944  11.157     11.3724     110.912     191.372     
1 1 1 10 8  49 o 6  125.691 2.27998 280.143     14.9024  280.251     13.784   78.9431    61.5424     7.23396     61.5425     
1 1 1 10 8  50 f 0  436.149 4.33483 3317.43     104.215  3440.79     83.7624  254.314    256.038     0           0           
1 1 1 10 8  51 o 10 90.9904 2.34612 156.611     11.57    137.691     9.79755  14.8926    31.6309     78.0698     211.631     
1 1 1 10 8  52 o 1  132.81  2.94288 313.141     21.1483  313.285     17.8326  98.1593    299.804     41.3567     299.804     
1 1 1 10 8  53 o 17 45.0346 3.74723 33.5327     8.66675  39.6112     7.74057  15.0137    96.5425     60.3959     96.5425     
1 1 1 10 8  54 o 9  67.4471 3.11438 81.4993     10.4887  80.6426     10.4496  3.13851    165.956     80.1401     165.956     
1 1 1 10 8  55 o 19 344.871 4.02517 2078.05     69.5028  2149.02     69.618   239.739    105.399     24.7121     105.399     
1 1 1 10 8  56 o 16 311.643 3.88826 1681.81     62.1596  1770.7      59.1457  227.814    116.757     46.5927     116.757     
1 1 1 10 8  57 o 6  120.695 2.95882 246.219     19.2116  271.922     16.2125  77.4613    80.5727     6.19179     80.5727     
1 1 1 10 8  58 o 18 108.264 2.64498 214.509     14.6482  202.142     14.012   59.4932    205.198     14.672      25.1976     
1 1 1 10 8  59 o 12 57.2187 3.46655 64.4198     10.3766  53.1106     9.31602  16.5692    281.01      23.7089     101.01      
1 1 1 10 8  60 f 0  101.148 2.83646 187.976     14.4867  176.158     14.2082  46.5839    132.584     0           0           
1 1 1 10 8  61 o 7  73.4121 3.03549 96.18       11.8698  96.0736     10.3105  1.35102    281.093     92.3689     281.093     
1 1 1 10 8  62 o 3  123.335 2.73716 266.789     17.157   274.435     16.6222  78.9288    117.672     4.15673     117.671     
1 1 1 10 8  63 o 10 56.2256 3.37807 51.9191     9.52737  61.7074     9.23769  24.741     146.232     4.34192     326.232     
1 1 1 10 8  64 o 11 92.023  2.86475 153.834     13.5386  148.145     12.8192  52.3385    276.397     6.57414     96.397      
1 1 1 10 8  65 o 1  169.068 2.929   517.949     24.9468  500.221     24.6847  119.464    327.152     25.6355     327.152     
1 1 1 10 8  66 o 3  35.3048 4.53525 28.5226     7.38611  18.0398     7.86926  8.0666     243.031     49.1372     243.031     
1 1 1 10 8  67 o 17 90.0846 2.73216 148.264     12.3756  141.419     12.2336  49.0864    243.249     11.4687     63.2486     
1 1 1 10 8  68 o 11 91.0502 2.78291 156.606     12.7649  139.764     12.5511  54.8324    283.271     2.03568     103.271     
1 1 1 10 8  69 o 1  71.8113 3.00524 93.8431     10.6323  91.0088     10.8932  31.9508    233.977     23.8724     53.9769     
1 1 1 10 8  70 o 7  38.7664 3.96658 34.6371     7.96922  21.3249     6.87574  16.8703    288.486     7.44645     288.486     
1 1 1 10 8  71 o 5  23.8443 4.78668 13.6877     6.28219  7.46166     5.94623  1.83479    317.361     9.61602     137.361     
1 1 1 10 8  72 o 1  26.8666 4.78102 21.2733     6.97403  5.78732     6.97678  1.12404    267.476     29.2663     267.476     
1 1 1 10 8  73 o 2  66.9146 2.8327  85.6387     9.93987  75.4575     8.9793   31.4243    8.65362     17.7222     188.654     
1 1 1 10 8  74 o 7  110.609 2.67428 217.862     14.818   220.631     14.7853  81.2009    343.735     27.2954     343.735     
1 1 1 10 8  75 o 15 94.0528 2.79708 156.232     13.153   161.482     13.1526  65.6183    291.659     17.3922     291.659     
1 1 1 10 8  76 o 17 52.4443 3.61941 51.5184     9.69399  48.8921     9.09025  25.08      218.477     11.0194     38.4774     
1 1 1 10 8  77 o 8  56.7107 3.50054 55.0779     10.0827  62.2384     9.53287  32.8515    50.4038     0.665934    230.404     
1 1 1 10 8  78 o 18 90.1543 3.0832  151.984     14.4571  142.1       13.3229  44.6907    242.085     19.5405     62.0851     
1 1 1 10 8  79 o 15 67.7919 3.85665 74.6617     13.7516  94.9511     11.6636  37.222     337.9       6.07835     157.9       
1 1 1 10 8  80 o 4  33.7255 6.33334 18.8914     13.6021  25.8107     8.928    17.1148    88.4581     0.895103    268.458     
1 1 1 10 8  81 o 13 22.148  6.13656 2.34511     12.7666  8.91661     8.00191  4.30828    296.311     10.3047     116.311     
1 1 1 10 8  82 o 2  39.1558 6.92505 32.5819     16.1295  31.1127     11.1347  21.1066    98.8814     0.264841    98.8814     
1 1 1 10 8  83 o 15 54.7508 5.70111 62.1111     14.7755  56.0911     15.4728  23.2411    133.416     16.5078     313.416     
1 1 1 10 8  84 f 0  19.3373 6.00897 -12.6212    11.6061  6.30909     12.1392  22.5905    281.158     0           0           
1 1 1 10 8  85 o 13 27.393  7.20632 13.9447     13.098   13.9148     13.3348  8.19599    28.7691     8.53228     208.769     
1 1 1 10 8  86 o 18 68.6938 5.31934 82.5919     17.8949  101.341     17.926   41.5966    219.11      4.40947     219.11      
1 1 1 10 8  87 o 5  34.0618 7.76755 30.2158     14.2866  19.0868     16.9935  13.1289    129.975     9.47809     309.975     
1 1 1 10 8  88 o 3  67.1304 6.15212 88.3697     19.1896  95.1823     21.2239  37.8952    156.599     0.518676    336.599     
1 1 1 10 8  89 o 4  27.757  7.77787 7.37279     14.7341  21.8577     17.7677  8.06054    153.163     2.17878     153.163     
1 1 1 10 8  90 o 12 33.3419 8.29082 26.0701     15.5792  27.6309     18.9213  14.1234    157.739     5.2313      157.739     
1 1 1 10 8  91 o 7  21.7491 6.99983 -10.0446    16.6657  5.91042     17.3348  1.58082    68.0071     5.65039     248.007     
1 1 1 10 8  92 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 9  0  o 15 441.446 4.13428 3455.08     91.4253  3455.08     91.4253  441.059    180         242.026     180         
1 1 1 10 9  1  o 7  527.078 4.80453 4933.57     126.908  4914.58     126.905  380.575    352.772     12.8167     352.772     
1 1 1 10 9  2  o 8  386.699 3.73373 2655.87     72.357   2644.28     72.3554  330.12     63.7195     129.16      63.7195     
1 1 1 10 9  3  o 14 780.481 6.93788 10785.7     265.401  10816.7     277.211  564.772    39.8963     8.53491     39.8964     
1 1 1 10 9  4  o 12 435.562 4.52807 3399.34     103.717  3325.81     93.8103  311.938    315.275     12.009      315.275     
1 1 1 10 9  5  o 2  477.254 4.72117 4032.25     110.201  4041.98     115.576  295.64     60.3738     85.1311     240.374     
1 1 1 10 9  6  o 7  263.777 3.0809  1233.65     40.7284  1232.32     40.7242  178.107    254.323     9.50075     254.323     
1 1 1 10 9  7  o 2  699.487 6.39775 8639.94     224.264  8709.97     224.27   501.91     280.091     2.22527     280.09      
1 1 1 10 9  8  o 10 1014.26 9.44736 18190.5     480.19   18317.1     480.198  827.079    343.014     194.918     343.014     
1 1 1 10 9  9  o 9  910.876 8.53452 14684.7     389.578  14752.4     389.585  657.844    205.731     6.33547     205.731     
1 1 1 10 9  10 o 5  998.585 8.67678 17846.6     443.636  17535.2     424.728  646        58.5126     145.083     238.513     
1 1 1 10 9  11 o 6  232.777 2.97535 962.681     33.8701  957.725     35.5233  54.5079    329.677     205.723     149.677     
1 1 1 10 9  12 o 14 757.29  7.42562 10116.7     289.088  10225.1     274.25   484.138    111.526     116.162     291.526     
1 1 1 10 9  13 o 11 430.031 4.4579  3417.43     96.0265  3140.83     95.9879  296.01     316.974     9.91757     136.973     
1 1 1 10 9  14 o 16 1158.38 10.4952 23911.4     594.524  23730.8     623.529  856.026    318.127     48.6159     318.127     
1 1 1 10 9  15 o 15 256.228 3.0504  1173.1      39.167   1153.81     39.1691  156.278    233.96      22.0548     53.9599     
1 1 1 10 9  16 o 1  423.797 4.23003 3168.86     89.8332  3197.72     89.842   336.666    67.903      87.6214     67.903      
1 1 1 10 9  17 o 13 485.029 4.61086 4147.23     112.07   4192.65     112.078  347.946    253.336     16.8363     253.336     
1 1 1 10 9  18 o 16 114.101 2.40509 230.305     13.7375  231.504     13.7368  36.9718    117.082     188.255     117.082     
1 1 1 10 9  19 o 11 500.119 5.03593 4455.7      126.214  4412.15     126.215  450.355    280.996     209.665     280.996     
1 1 1 10 9  20 o 8  424.109 4.42765 3180.31     94.0995  3196.18     94.1094  289.023    211.574     7.86004     31.5745     
1 1 1 10 9  21 o 11 378.128 3.95579 2535.56     73.1447  2532.88     76.7317  158.812    357.936     205.479     177.936     
1 1 1 10 9  22 o 13 231.675 2.94573 945.071     33.3759  957.297     35.0148  153.795    90.2309     41.9555     90.2309     
1 1 1 10 9  23 o 11 426.297 4.44528 3215.51     90.0969  3227.38     99.6151  256.909    103.353     76.9851     283.353     
1 1 1 10 9  24 o 11 242.738 2.94196 1028.15     35.7822  1060.4      35.787   56.4866    216.33      211.691     36.3302     
1 1 1 10 9  25 o 6  269.954 2.98582 1291.2      40.4002  1291.85     40.3874  207.628    24.0756     71.4643     24.0756     
1 1 1 10 9  26 o 11 943.758 8.08951 16026.9     366.098  15598.9     397.946  649.601    321.497     36.8818     141.497     
1 1 1 10 9  27 o 18 279.335 2.99509 1382.72     41.073   1383.11     42.7648  166.573    314.395     42.1869     134.395     
1 1 1 10 9  28 o 3  306.396 3.32411 1652.31     49.92    1675.72     52.1512  196.562    23.6191     23.2655     203.619     
1 1 1 10 9  29 f 0  468.467 4.40249 3934.32     98.9099  3848.53     107.519  356.677    3.50504     0           0           
1 1 1 10 9  30 o 15 737.109 6.48314 9721.84     229.221  9565.57     249.156  575.078    116.788     115.147     116.788     
1 1 1 10 9  31 o 19 753.905 6.27755 10020.3     237.158  10156.6     237.182  582.777    107.466     107.871     107.466     
1 1 1 10 9  32 o 18 625.625 5.34611 6961.29     167.614  6927.99     167.615  568.867    309.099     265.866     309.099     
1 1 1 10 9  33 o 9  538.092 4.71486 5093.52     127.13   5179.04     127.146  303.617    276.422     143.648     96.422      
1 1 1 10 9  34 o 2  232.758 2.66557 971.202     31.0919  949.44      31.09    88.9455    107.017     137.44      287.017     
1 1 1 10 9  35 o 19 168.651 2.33866 506.184     19.7568  502.085     19.7748  67.4914    353.959     83.9991     173.959     
1 1 1 10 9  36 o 13 457.201 4.10522 3696.34     94.0545  3719.45     94.0646  383.278    123.281     137.178     123.281     
1 1 1 10 9  37 o 5  319.876 3.20655 1803.32     49.3974  1825.28     53.3528  264.125    270.53      96.6089     270.53      
1 1 1 10 9  38 o 11 131.331 2.34263 305.259     15.4226  306.592     15.389   29.0175    203.214     228.383     203.214     
1 1 1 10 9  39 o 2  208.584 2.77947 749.777     27.7182  793.235     30.3859  138.094    287.061     3.9551      287.061     
1 1 1 10 9  40 f 0  227.361 2.69711 887.392     29.5422  946.013     31.9258  205.501    14.5128     0           0           
1 1 1 10 9  41 o 7  427.617 3.94966 3192.53     81.3563  3296.71     87.8852  284.071    63.6603     17.757      243.66      
1 1 1 10 9  42 o 16 364.618 3.64569 2356.25     66.6163  2360.81     66.6158  302.582    115.811     109.711     115.811     
1 1 1 10 9  43 f 0  243.456 2.81326 1044.71     33.6217  1057.32     35.0186  134.841    1.20787     0           0           
1 1 1 10 9  44 o 8  37.3868 3.07323 23.2062     5.61105  27.1215     5.66206  33.8605    294.08      93.1243     294.08      
1 1 1 10 9  45 o 6  117.218 2.23615 241.264     13.3467  246.268     12.8911  51.8012    117.164     36.5078     117.164     
1 1 1 10 9  46 o 11 322.737 3.46685 1856.91     56.0759  1839.38     56.0669  167.688    164.345     100.998     344.345     
1 1 1 10 9  47 o 15 93.0029 2.34256 149.827     10.8395  157.32      10.9595  8.25695    57.0498     96.7958     237.05      
1 1 1 10 9  48 f 0  50.2264 2.88199 39.4166     6.88327  51.0397     7.46923  19.3848    50.0355     0           0           
1 1 1 10 9  49 o 18 240.319 2.69899 983.145     31.7471  1066.26     33.2666  186.024    157.034     56.0969     157.034     
1 1 1 10 9  50 o 16 324.324 3.41983 1824.48     55.5514  1909.49     55.5944  228.761    142.339     24.9595     142.339     
1 1 1 10 9  51 o 13 144.453 2.47141 382.378     18.7229  357.911     17.0604  43.0019    229.273     100.153     49.2729     
1 1 1 10 9  52 f 0  267.902 3.53994 1342.96     50.0957  1207.04     44.9902  124.014    192.557     0           0           
1 1 1 10 9  53 o 2  204.542 3.12969 754.099     33.0356  730.924     31.1213  120.442    238.607     25.883      58.6069     
1 1 1 10 9  54 o 19 86.9086 2.66474 130.69      11.9836  137.852     11.1267  38.524     240.354     19.5836     60.3539     
1 1 1 10 9  55 o 9  350.199 3.73989 2131.75     67.0974  2226.77     64.0458  231.607    279.411     0.0188692   279.401     
1 1 1 10 9  56 o 11 271.502 3.37294 1311.68     45.6907  1307.05     46.0926  208.709    165.516     61.6689     165.516     
1 1 1 10 9  57 o 14 167.143 2.88503 489.883     24.7444  502.473     23.532   133.624    186.24      54.2501     186.24      
1 1 1 10 9  58 o 15 70.7392 3.02782 83.1651     10.7856  95.4775     10.5193  18.3656    15.0048     46.3148     195.005     
1 1 1 10 9  59 o 8  32.6488 4.90082 12.8813     7.85795  27.2653     7.84713  4.98928    81.1234     23.4844     81.1234     
1 1 1 10 9  60 o 2  100.406 2.91807 186.086     14.4853  172.962     14.79    53.8566    91.2163     15.8314     271.216     
1 1 1 10 9  61 f 0  193.393 3.14351 702.243     30.2722  629.357     30.5733  153.977    305.227     0           0           
1 1 1 10 9  62 o 17 115.28  2.79124 237.866     15.6059  235.296     16.5767  53.6157    146.699     37.828      326.699     
1 1 1 10 9  63 o 14 86.933  2.87866 138.216     12.5283  131.367     12.4792  35.1638    12.9209     36.2074     192.921     
1 1 1 10 9  64 o 9  139.054 2.74383 359.507     19.1018  329.587     19.0756  76.6821    261.963     22.2637     81.9631     
1 1 1 10 9  65 o 12 161.87  2.8064  457.382     22.7668  476.281     22.7381  138.036    74.4114     73.8837     74.4114     
1 1 1 10 9  66 o 4  91.9722 2.68848 149.863     12.3707  151.944     12.3583  65.1603    34.9589     20.1086     34.9589     
1 1 1 10 9  67 o 5  102.795 2.64962 185.809     13.6498  191.226     13.6006  74.207     103.912     21.8296     103.912     
1 1 1 10 9  68 o 4  129.672 2.60332 304.399     15.9869  295.498     17.7372  84.3       128.321     5.54451     128.321     
1 1 1 10 9  69 o 8  97.5337 2.60106 170.357     12.3591  169.474     13.0117  61.0978    161.36      1.24058     161.36      
1 1 1 10 9  70 o 8  106.027 2.58337 197.457     13.3478  204.339     14.0643  81.7359    239.478     32.7132     239.478     
1 1 1 10 9  71 o 15 38.28   4.17592 26.7202     7.68528  27.4689     7.82205  14.0228    87.8687     13.7947     267.869     
1 1 1 10 9  72 o 1  45.8148 3.75271 39.164      8.58474  37.5704     8.32972  28.5327    310.363     7.50393     310.363     
1 1 1 10 9  73 o 4  56.8876 3.31077 60.2344     9.30503  57.0009     9.39577  44.244     203.191     25.548      203.191     
1 1 1 10 9  74 o 18 16.8086 4.89709 1.48021     6.49729  2.25954     6.82446  3.96277    7.80594     17.0629     7.80594     
1 1 1 10 9  75 o 12 29.2484 5.41828 10.1797     7.08981  23.4619     9.40652  4.97015    44.6396     42.3738     44.6396     
1 1 1 10 9  76 o 11 24.0199 5.92351 12.085      7.8128   6.60263     10.2989  1.81207    352.5       0.537391    172.5       
1 1 1 10 9  77 o 5  41.315  4.96475 22.4832     9.40315  43.8972     10.0421  23.8822    92.8211     1.93613     92.8211     
1 1 1 10 9  78 o 13 39.371  5.45516 31.5033     10.0624  28.5664     10.6733  16.6601    76.3004     11.2727     256.3       
1 1 1 10 9  79 o 17 16.6273 4.9672  -3.5221     8.20643  3.62551     6.61052  1.02461    133.577     13.6173     133.577     
1 1 1 10 9  80 o 19 76.6415 4.06691 109.948     15.8536  108.195     15.1549  48.9236    260.958     6.81629     260.958     
1 1 1 10 9  81 o 9  24.2929 6.30677 12.6588     11.1526  8.11564     8.98021  6.70655    197.496     0.274945    17.4956     
1 1 1 10 9  82 o 10 33.3402 7.20452 25.4312     12.1259  20.7457     14.552   17.6258    90.4767     6.78129     90.4767     
1 1 1 10 9  83 o 3  31.1901 7.25788 22.3818     13.1147  17.8853     13.2741  11.6449    224.209     7.47611     44.2094     
1 1 1 10 9  84 o 18 71.6771 5.06159 108.628     17.7794  90.0066     17.9118  36.073     102.327     11.1463     282.327     
1 1 1 10 9  85 o 9  38.693  6.95425 37.3496     12.8655  25.7658     14.6557  21.1531    137.231     14.6808     137.231     
1 1 1 10 9  86 o 18 39.0302 6.91813 41.0142     13.1313  23.4573     14.7566  8.18891    325.331     27.2309     145.331     
1 1 1 10 9  87 o 3  26.4303 6.98952 17.5867     12.3584  7.04427     13.4241  6.98297    24.277      11.9751     204.277     
1 1 1 10 9  88 o 9  75.8989 5.55655 112.624     20.6837  117.992     20.9712  50.4847    42.1382     14.4924     42.1382     
1 1 1 10 9  89 o 5  18.9993 6.17271 -6.9438     13.7119  -2.42148    13.249   0.971972   245.849     7.33832     65.8489     
1 1 1 10 9  90 o 10 24.2437 7.10739 14.6319     14.3842  2.21549     14.6758  2.8817     40.6063     1.62285     220.606     
1 1 1 10 9  91 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 10 10 0  o 8  150.504 3.35882 402.555     25.2763  402.555     25.2763  3.82644    360         45.4726     180         
1 1 1 10 10 1  o 3  218.42  2.68363 846.098     29.3549  846.098     29.3549  99.3122    210         117.265     30          
1 1 1 10 10 2  o 12 358.529 3.55376 2279.13     63.8236  2279.13     63.8236  315.112    240         109.938     240         
1 1 1 10 10 3  o 1  95.7046 2.26028 162.836     10.8132  162.836     10.8132  46.341     270         195.209     270         
1 1 1 10 10 4  o 5  307.298 3.54364 1674.67     54.5393  1674.67     54.5393  332.003    300         235.613     300         
1 1 1 10 10 5  o 6  276.138 3.0146  1352.12     41.695   1352.12     41.695   220.027    150         40.7219     150         
1 1 1 10 10 6  o 8  621.654 5.52425 6852.28     172.039  6852.28     172.039  495.913    1.90886e-06 90.403      1.90886e-06 
1 1 1 10 10 7  o 15 187.479 2.63786 623.54      24.7615  623.54      24.7615  112.336    210         30.4024     30          
1 1 1 10 10 8  o 1  485.039 4.67056 4171.52     113.481  4171.52     113.481  346.795    240         9.19306     60          
1 1 1 10 10 9  o 19 422.492 4.40771 3165.27     93.2779  3165.27     93.2779  201.732    270         208.405     90          
1 1 1 10 10 10 o 4  188.489 2.66467 630.283     25.1477  630.283     25.1477  104.823    120         48.7123     300         
1 1 1 10 10 11 o 14 748.764 6.78884 9942.65     254.648  9942.65     254.648  594.648    150         106.105     150         
1 1 1 10 10 12 f 0  378.154 4.06524 2535.84     76.9998  2535.84     76.9998  394.633    1.69411e-06 0           0           
1 1 1 10 10 13 o 6  124.022 2.5366  273.23      15.7358  273.23      15.7358  11.1449    210         27.7608     30          
1 1 1 10 10 14 o 13 391.228 3.95738 2713.99     77.5527  2713.99     77.5527  245.099    60          74.5949     240         
1 1 1 10 10 15 o 11 539     4.83891 5151.17     130.659  5151.17     130.659  465.674    270         153.848     270         
1 1 1 10 10 16 o 17 60.9172 2.46501 66.3978     7.46839  66.3978     7.46839  6.1587     120.001     14.9748     120.001     
1 1 1 10 10 17 o 12 527.873 4.7926  4940.8      126.736  4940.8      126.736  530.597    150         301.092     150         
1 1 1 10 10 18 o 1  264.107 2.96577 1236.94     39.2311  1236.94     39.2311  178.725    180         19.9155     9.24388e-06 
1 1 1 10 10 19 o 2  861.623 8.13094 13170.9     350.949  13170.9     350.949  673.106    30          107.996     30          
1 1 1 10 10 20 o 8  1259.9  11.7444 28186.6     741.241  28186.6     741.241  975.11     60          141.596     60          
1 1 1 10 10 21 o 13 28.2294 4.59622 16.1724     5.66017  16.1724     5.66017  18.861     270         39.1579     270         
1 1 1 10 10 22 f 0  388.674 3.97461 2678.86     77.3812  2678.86     77.3812  276.786    120         0           0           
1 1 1 10 10 23 o 1  873.844 8.2718  13550.2     362.092  13550.2     362.092  625.978    330         1.99339     330         
1 1 1 10 10 24 o 15 484.058 4.92158 4155.69     119.333  4155.69     119.333  475.202    180         258.899     180         
1 1 1 10 10 25 o 4  160.02  2.70229 454.528     21.6425  454.528     21.6425  77.2931    30          32.6111     30          
1 1 1 10 10 26 o 19 113.926 2.58854 230.705     14.7442  230.705     14.7442  27.1469    240         20.2203     60          
1 1 1 10 10 27 o 2  620.035 6.04164 6820.29     187.649  6820.29     187.649  526.804    270         171.59      270         
1 1 1 10 10 28 o 6  192.174 2.8487  655.313     27.4075  655.313     27.4075  78.0693    300         116.575     120         
1 1 1 10 10 29 o 8  384.829 3.80299 2626.31     73.3097  2626.31     73.3097  230.323    150         85.0925     330         
1 1 1 10 10 30 o 18 413.808 3.96887 3036.82     82.2708  3036.82     82.2708  455.368    0           324.861     0           
1 1 1 10 10 31 o 2  246.035 2.89343 1073.66     35.6533  1073.66     35.6533  231.275    30          115.324     30          
1 1 1 10 10 32 o 18 537.017 5.14284 5116.33     138.348  5116.33     138.348  454.847    60          151.973     60          
1 1 1 10 10 33 o 5  302.442 3.08447 1622.18     46.7283  1622.18     46.7283  205.689    90          14.5969     270         
1 1 1 10 10 34 o 16 603.7   5.19652 6466.09     157.163  6466.09     157.163  444.972    300         41.2359     300         
1 1 1 10 10 35 o 4  205.557 2.52048 749.497     25.9467  749.497     25.9467  140.99     150         6.34273     330         
1 1 1 10 10 36 o 18 448.92  4.09458 3574.78     92.0824  3574.78     92.0824  457.344    180         286.014     180         
1 1 1 10 10 37 o 4  76.3167 2.26349 103.759     8.6221   103.759     8.6221   3.50231    210         18.2328     30.0001     
1 1 1 10 10 38 o 1  59.7619 2.71927 64.0819     8.06564  64.0819     8.06564  11.0278    60          55.6664     60          
1 1 1 10 10 39 o 10 11.2412 4.64854 2.62672     4.3718   2.62672     4.3718   7.38459    89.9998     15.0101     89.9998     
1 1 1 10 10 40 o 12 207.833 2.55786 766.25      26.6228  766.25      26.6228  177.838    300         67.1031     300         
1 1 1 10 10 41 o 5  60.7268 2.50233 66.0228     7.55556  66.0228     7.55556  49.3479    150         179.124     150         
1 1 1 10 10 42 o 14 78.5201 2.27883 109.819     8.93273  109.819     8.93273  5.97993    180         1.03871     180         
1 1 1 10 10 43 o 7  53.1149 2.72538 50.791      7.16483  50.791      7.16483  1.09773    30          28.9264     30          
1 1 1 10 10 44 o 2  117.664 2.30361 245.942     13.56    245.942     13.56    58.3841    60          41.8629     60          
1 1 1 10 10 45 o 1  174.462 2.49837 540.153     21.8231  540.153     21.8231  90.9882    270         57.4694     90          
1 1 1 10 10 46 o 5  307.514 3.42642 1677.99     52.7744  1677.99     52.7744  130.44     300         160.118     120         
1 1 1 10 10 47 o 13 83.7203 2.20902 124.745     9.23876  124.745     9.23876  38.3879    330         22.6215     150         
1 1 1 10 10 48 o 17 254.825 2.76202 1151.94     35.2532  1151.94     35.2532  232.134    1.0438e-06  117.213     1.0438e-06  
1 1 1 10 10 49 o 9  383.206 3.46537 2605.33     66.5245  2605.33     66.5245  284.046    30          47.586      30          
1 1 1 10 10 50 o 17 187.185 2.68854 621.908     25.1967  621.908     25.1967  176.308    60          99.2225     60          
1 1 1 10 10 51 o 19 333.852 3.47698 1977.94     58.1438  1977.94     58.1438  232.606    90          14.2433     90          
1 1 1 10 10 52 o 2  41.3325 4.15189 32.0871     8.0994   32.0871     8.0994   5.5652     300         23.6912     300         
1 1 1 10 10 53 o 8  49.4286 3.66666 44.7499     8.83239  44.7499     8.83239  1.81291    150         42.6178     150         
1 1 1 10 10 54 o 2  32.0289 5.8466  21.4802     8.10966  21.4802     8.10966  13.3112    180         40.0071     180         
1 1 1 10 10 55 o 13 224.448 3.19702 894.694     35.9272  894.694     35.9272  118.803    30          62.0475     210         
1 1 1 10 10 56 o 18 16.7445 6.49189 6.95372     7.81806  6.95372     7.81806  27.0308    240         60.0341     240         
1 1 1 10 10 57 o 16 178.259 3.64929 565.499     32.5384  565.499     32.5384  92.9563    90          50.6072     270         
1 1 1 10 10 58 o 18 88.4216 2.8638  139.577     12.6292  139.577     12.6292  56.0583    120         42.0509     120         
1 1 1 10 10 59 o 13 132.285 2.58186 311.131     17.0866  311.131     17.0866  109.524    150         44.6626     150         
1 1 1 10 10 60 o 1  101.336 2.90067 183.147     14.6757  183.147     14.6757  77.2898    3.61434e-08 21.6174     3.61434e-08 
1 1 1 10 10 61 o 12 26.1709 6.30251 15.8054     7.41112  15.8054     7.41112  4.45945    30          15.7525     30          
1 1 1 10 10 62 o 11 79.4696 2.79307 112.949     11.0606  112.949     11.0606  8.40569    240         6.73949     240         
1 1 1 10 10 63 o 9  101.099 2.64872 182.212     13.3778  182.212     13.3778  74.3055    90          17.1568     90          
1 1 1 10 10 64 o 1  17.4928 6.29976 8.05493     6.93387  8.05493     6.93387  3.54145    120         8.60703     120         
1 1 1 10 10 65 o 4  26.4584 6.10483 15.9282     7.16776  15.9282     7.16776  1.31669    330         7.89058     330         
1 1 1 10 10 66 o 15 33.98   5.15235 23.227      7.70361  23.227      7.70361  5.52345    2.89811e-10 26.2974     180         
1 1 1 10 10 67 o 8  22.0149 6.73819 12.4475     7.66543  12.4475     7.66543  9.52482    30          42.4009     30          
1 1 1 10 10 68 o 6  16.9002 6.4076  7.40267     7.45096  7.40267     7.45096  0.667453   60.0001     2.44474     60.0001     
1 1 1 10 10 69 f 0  29.5301 6.64288 19.7836     8.6528   19.7836     8.6528   8.16148    270         0           0           
1 1 1 10 10 70 o 6  9.36248 4.56215 -5.19152    7.10213  -5.19152    7.10213  16.7149    300         37.7523     300         
1 1 1 10 10 71 o 17 48.5287 3.80574 43.6216     8.9648   43.6216     8.9648   25.4943    330         10.1936     150         
1 1 1 10 10 72 o 7  62.8976 3.40076 71.8755     10.5716  71.8755     10.5716  43.763     360         8.42645     360         
1 1 1 10 10 73 o 7  77.9715 2.90558 109.286     11.2811  109.286     11.2811  52.9766    30          8.27778     30          
1 1 1 10 10 74 o 6  11.2268 5.0924  0.408231    6.49533  0.408231    6.49533  15.2678    240         38.1732     240         
1 1 1 10 10 75 o 17 13.03   5.5576  3.15032     6.61583  3.15032     6.61583  16.9331    270         46.1462     270         
1 1 1 10 10 76 o 7  45.7045 3.83196 39.0144     8.45242  39.0144     8.45242  40.255     120         26.0328     120         
1 1 1 10 10 77 o 7  34.7256 5.93652 25.3492     8.95499  25.3492     8.95499  25.3715    150         11.6038     150         
1 1 1 10 10 78 o 3  62.7595 4.02208 72.7567     12.399   72.7567     12.399   38.8247    360         0.653679    360         
1 1 1 10 10 79 o 16 50.0173 4.22783 47.1347     10.1976  47.1347     10.1976  30.0441    30          1.00786     210         
1 1 1 10 10 80 o 18 16.4426 6.56808 6.97393     8.29146  6.97393     8.29146  4.6232     240         25.7459     240         
1 1 1 10 10 81 o 4  49.1715 5.34089 47.3219     12.239   47.3219     12.239   38.0942    270         16.7517     270         
1 1 1 10 10 82 o 16 19.629  7.72555 10.6329     11.2608  10.6329     11.2608  2.18953    120         10.1203     300         
1 1 1 10 10 83 o 13 29.9197 8.44555 23.6313     12.2616  23.6313     12.2616  11.0949    150         12.05       330         
1 1 1 10 10 84 o 15 27.9237 8.5702  21.4909     12.397   21.4909     12.397   7.80992    1.03924e-05 3.21231     1.03924e-05 
1 1 1 10 10 85 o 10 38.0561 7.87041 33.3597     13.035   33.3597     13.035   7.13286    30          30.9711     210         
1 1 1 10 10 86 o 15 13.3048 6.26954 -2.12486    11.3247  -2.12486    11.3247  1.53366    60          8.27755     60          
1 1 1 10 10 87 o 17 37.2643 8.21603 33.2713     13.4499  33.2713     13.4499  15.8472    270         12.134      90          
1 1 1 10 10 88 o 2  54.2167 7.41799 62.5157     17.9833  62.5157     17.9833  45.7198    300         28.1981     300         
1 1 1 10 10 89 o 18 20.0494 8.42322 11.3593     14.7576  11.3593     14.7576  1.36498    150         4.35266     330         
1 1 1 10 10 90 o 18 55.3494 7.46133 66.0129     18.5137  66.0129     18.5137  42.4084    180         20.9429     180         
1 1 1 10 10 91 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 0  0  o 2  2335.06 40.2328 98054.3     4701.71  98054.3     4701.71  2004.68    1.70365e-06 640.877     1.70365e-06 
1 1 1 11 0  1  o 5  169.206 2.1763  507.82      18.4404  507.82      18.4404  9.73437    59.9999     10.6566     240         
1 1 1 11 0  2  o 19 172.08  2.11684 525.171     18.2424  525.171     18.2424  36.4039    120         88.5325     300         
1 1 1 11 0  3  o 19 806.695 6.11445 11541.1     247.124  11541.1     247.124  652.702    3.67747e-07 141.98      3.67747e-07 
1 1 1 11 0  4  o 4  160.08  2.34176 454.657     18.768   454.657     18.768   20.9044    240         61.958      60          
1 1 1 11 0  5  o 8  317.065 2.81809 1782.27     44.762   1782.27     44.762   254.374    120         61.73       120         
1 1 1 11 0  6  o 5  54.4772 1.91426 52.9745     5.19649  52.9745     5.19649  151.902    180         331.162     180         
1 1 1 11 0  7  o 5  1221.51 10.9797 26499.6     671.878  26499.6     671.878  1031.57    240         303.421     240         
1 1 1 11 0  8  o 18 891.539 8.12897 14104.5     363.056  14104.5     363.056  686.318    300         88.8019     300         
1 1 1 11 0  9  o 9  228.033 2.73752 922.219     31.2631  922.219     31.2631  127.001    180         44.4714     9.23918e-06 
1 1 1 11 0  10 o 16 617     5.78684 6751.91     178.861  6751.91     178.861  473.362    60          59.115      60          
1 1 1 11 0  11 o 17 448.469 4.42584 3566.58     99.4256  3566.58     99.4256  329.035    120         13.2949     120         
1 1 1 11 0  12 o 6  765.095 7.03085 10383.7     269.475  10383.7     269.475  467.61     180         164.099     1.02132e-05 
1 1 1 11 0  13 o 5  317.525 3.11231 1787.62     49.5032  1787.62     49.5032  175.762    240         103.926     60          
1 1 1 11 0  14 o 5  200.638 2.42932 713.924     24.4102  713.924     24.4102  39.3747    300         12.9287     300         
1 1 1 11 0  15 o 18 70.9995 1.93821 89.7177     6.87294  89.7177     6.87294  106.761    180         259.896     180         
1 1 1 11 0  16 o 6  397.672 3.41185 2803.54     67.9722  2803.54     67.9722  202.959    60          163.705     240         
1 1 1 11 0  17 o 15 1050.32 8.49999 19566.8     447.274  19566.8     447.274  673.922    120         155.265     300         
1 1 1 11 0  18 o 4  491.76  4.39046 4287.48     108.16   4287.48     108.16   237.811    360         227.452     180         
1 1 1 11 0  19 o 14 702.904 5.94783 8760.26     209.447  8760.26     209.447  420.817    60          162.286     240         
1 1 1 11 0  20 o 4  704.812 5.9854  8807.82     211.342  8807.82     211.342  367.573    120         270.415     300         
1 1 1 11 0  21 o 15 315.73  3.28641 1767.52     51.974   1767.52     51.974   201.655    360         46.478      180         
1 1 1 11 0  22 o 13 443.792 4.21822 3491.94     93.7762  3491.94     93.7762  290.914    60          49.8668     240         
1 1 1 11 0  23 o 3  160.13  2.37993 454.941     19.0794  454.941     19.0794  60.7653    300         69.3336     120         
1 1 1 11 0  24 o 4  583.11  5.26507 6028.63     153.8    6028.63     153.8    525.921    360         223.949     360         
1 1 1 11 0  25 o 9  1226.66 10.4359 26694.1     641.316  26694.1     641.316  862.021    60          15.1989     240         
1 1 1 11 0  26 f 0  48.3372 2.31632 41.9672     5.55092  41.9672     5.55092  12.0545    120         0           0           
1 1 1 11 0  27 o 9  634.487 5.65276 7138.09     179.675  7138.09     179.675  494.339    180         91.6429     180         
1 1 1 11 0  28 o 7  1066.58 8.74141 20176.8     467.092  20176.8     467.092  805.824    240         106.018     240         
1 1 1 11 0  29 o 11 171.794 2.36616 523.534     20.3535  523.534     20.3535  77.2603    120         11.0318     120         
1 1 1 11 0  30 o 7  1267.72 10.3448 28514.1     657.017  28514.1     657.017  863.488    180         56.8722     360         
1 1 1 11 0  31 o 19 462.066 3.97965 3785.15     92.1222  3785.15     92.1222  367.083    60          85.0765     60          
1 1 1 11 0  32 o 11 534.578 4.49203 5066.55     120.303  5066.55     120.303  401.557    120         53.4662     120         
1 1 1 11 0  33 o 9  141.124 2.30308 353.455     16.2685  353.455     16.2685  20.75      2.58347e-06 24.2527     180         
1 1 1 11 0  34 o 6  1073.64 8.77195 20450.6     471.829  20450.6     471.829  851.747    240         203.397     240         
1 1 1 11 0  35 o 10 746.514 6.54236 9884.1      244.671  9884.1      244.671  622.731    300         204.414     300         
1 1 1 11 0  36 o 14 646.82  5.73495 7419.88     185.832  7419.88     185.832  420.572    360         59.1088     180         
1 1 1 11 0  37 o 2  395.122 4.10024 2768.72     81.1503  2768.72     81.1503  227.177    240         94.4742     60          
1 1 1 11 0  38 o 1  48.8239 2.67503 42.997      6.45237  42.997      6.45237  52.5524    120         127.567     120         
1 1 1 11 0  39 o 9  452.838 4.37627 3636.74     99.2715  3636.74     99.2715  431.458    180         236.557     180         
1 1 1 11 0  40 o 4  675.358 6.19702 8092.4      209.659  8092.4      209.659  544.281    60          156.454     60          
1 1 1 11 0  41 o 19 119.072 2.45783 251.886     14.638   251.886     14.638   54.9689    300         24.3446     120         
1 1 1 11 0  42 o 15 434.584 4.38239 3350.11     95.3995  3350.11     95.3995  325.042    3.19874e-06 52.9981     3.19874e-06 
1 1 1 11 0  43 o 19 198.446 3.02255 698.916     30.0276  698.916     30.0276  91.2919    240         89.3946     60          
1 1 1 11 0  44 o 8  261.837 3.3966  1216.42     44.5355  1216.42     44.5355  205.36     300         52.6918     300         
1 1 1 11 0  45 o 1  190.741 3.15619 645.915     30.1322  645.915     30.1322  178.346    180         109.105     180         
1 1 1 11 0  46 o 4  448.076 5.13445 3563.74     115.226  3563.74     115.226  305.338    60          1.01128     59.9997     
1 1 1 11 0  47 o 13 34.2617 3.89198 22.3543     6.16587  22.3543     6.16587  14.0905    120         33.2154     120         
1 1 1 11 0  48 f 0  69.7699 2.61501 86.9987     9.08424  86.9987     9.08424  1.24895    2.77059e-08 0           0           
1 1 1 11 0  49 o 6  247.793 3.33915 1089.66     41.4313  1089.66     41.4313  252.767    240         171.081     240         
1 1 1 11 0  50 o 9  365.842 3.83486 2374.69     70.273   2374.69     70.273   251.834    120         11.149      120         
1 1 1 11 0  51 o 14 93.655  2.4143  156.076     11.2971  156.076     11.2971  53.8725    8.40908e-08 8.5933      8.40908e-08 
1 1 1 11 0  52 o 2  41.3366 3.57286 31.6266     7.10615  31.6266     7.10615  1.34912    59.9999     4.4985      59.9999     
1 1 1 11 0  53 o 7  69.486  2.37816 86.1759     8.23688  86.1759     8.23688  15.4132    300         20.4288     120         
1 1 1 11 0  54 o 17 240.485 2.93765 1026.15     35.3799  1026.15     35.3799  129.272    180         61.5106     8.61707e-06 
1 1 1 11 0  55 o 13 45.8838 2.85691 38.1816     6.44686  38.1816     6.44686  16.4554    60          63.665      60          
1 1 1 11 0  56 o 9  233.354 3.16309 966.532     36.9596  966.532     36.9596  165.198    120         21.7142     120         
1 1 1 11 0  57 o 13 424.127 3.84241 3192.08     81.6394  3192.08     81.6394  376.621    180         193.954     180         
1 1 1 11 0  58 o 2  230.827 2.91977 945.55      33.7507  945.55      33.7507  163.407    60          23.3924     60          
1 1 1 11 0  59 o 17 187.891 2.73342 626.682     25.7133  626.682     25.7133  163.109    120         80.0668     120         
1 1 1 11 0  60 o 19 181.261 2.78049 583.372     25.2304  583.372     25.2304  155.928    180         75.1548     180         
1 1 1 11 0  61 o 2  137.116 2.6356  334.093     18.0802  334.093     18.0802  116.266    60          54.3838     60          
1 1 1 11 0  62 o 9  79.7396 3.08923 113.794     12.2595  113.794     12.2595  18.324     300         66.5011     120         
1 1 1 11 0  63 o 18 194.059 3.10998 669.14      30.2098  669.14      30.2098  152.364    180         53.8672     180         
1 1 1 11 0  64 f 0  22.0469 6.91592 12.4797     8.063    12.4797     8.063    32.4049    240         0           0           
1 1 1 11 0  65 o 12 121.911 2.96529 264.663     18.0677  264.663     18.0677  59.7586    300         36.9653     120         
1 1 1 11 0  66 o 8  77.9866 3.11626 108.993     12.0894  108.993     12.0894  59.7841    0           33.4645     0           
1 1 1 11 0  67 o 12 112.297 2.9564  224.807     16.5852  224.807     16.5852  69.4552    240         4.18186     60          
1 1 1 11 0  68 o 3  66.7355 3.37961 80.3476     11.1669  80.3476     11.1669  39.4414    300         23.0556     300         
1 1 1 11 0  69 o 12 142.892 2.98078 363.666     21.3031  363.666     21.3031  106.551    180         32.3846     180         
1 1 1 11 0  70 o 18 63.5919 3.44456 73.1739     10.8254  73.1739     10.8254  32.0323    240         14.7762     60          
1 1 1 11 0  71 o 19 37.5805 5.54855 28.2719     9.21018  28.2719     9.21018  19.6164    120         85.8886     120         
1 1 1 11 0  72 o 18 86.7804 3.15532 135.018     13.639   135.018     13.639   51.4681    360         5.54025     180         
1 1 1 11 0  73 o 14 246.988 3.4897  1088.18     43.1552  1088.18     43.1552  164.939    240         22.3757     240         
1 1 1 11 0  74 o 13 57.0179 3.63918 59.3759     10.1941  59.3759     10.1941  40.6681    300         10.9475     300         
1 1 1 11 0  75 o 10 68.4669 3.39628 84.8178     11.5191  84.8178     11.5191  40.8188    180         2.90823     8.65138e-06 
1 1 1 11 0  76 o 11 17.6808 6.51654 8.30118     7.53196  8.30118     7.53196  0.256516   240         1.28827     240         
1 1 1 11 0  77 o 2  90.2036 3.10056 146.116     13.9402  146.116     13.9402  46.8589    120         16.7399     300         
1 1 1 11 0  78 o 3  8.08831 4.04334 -8.12723    6.67501  -8.12723    6.67501  7.73322    180         17.1467     180         
1 1 1 11 0  79 o 18 11.8158 5.38833 0.170161    7.39828  0.170161    7.39828  2.8517     240         7.57257     240         
1 1 1 11 0  80 o 8  18.9641 7.1543  9.61574     9.24771  9.61574     9.24771  3.74924    120         25.5453     120         
1 1 1 11 0  81 o 1  32.9914 7.22402 24.8087     10.4566  24.8087     10.4566  15.0485    180         8.97953     180         
1 1 1 11 0  82 o 1  14.8391 6.68081 1.80115     10.9268  1.80115     10.9268  9.17567    60          32.6606     60          
1 1 1 11 0  83 o 1  24.8684 7.80282 16.656      10.2636  16.656      10.2636  7.18085    300         43.8593     300         
1 1 1 11 0  84 o 18 110.629 3.56643 221.694     19.6787  221.694     19.6787  66.8064    5.99771e-07 2.29741     5.9977e-07  
1 1 1 11 0  85 o 1  12.5944 5.8991  -1.64337    9.77676  -1.64337    9.77676  0.729252   240         2.63929     240         
1 1 1 11 0  86 o 13 30.5633 8.15494 23.7415     11.6959  23.7415     11.6959  1.66039    300         32.4567     120         
1 1 1 11 0  87 o 5  32.8857 8.1418  26.656      12.1479  26.656      12.1479  18.6399    180         5.43319     180         
1 1 1 11 0  88 o 10 47.4318 8.21672 49.413      16.915   49.413      16.915   36.8489    240         19.2881     240         
1 1 1 11 0  89 o 11 26.8359 9.41306 21.2609     15.2722  21.2609     15.2722  9.69006    300         3.08856     300         
1 1 1 11 0  90 o 4  19.7833 9.03149 4.46484     20.8586  4.46484     20.8586  3.49932    180         6.93111     8.55687e-06 
1 1 1 11 0  91 o 12 20.6346 9.58908 3.37689     25.0437  3.37689     25.0437  4.17245    60          6.85684     240         
1 1 1 11 0  92 x 5  ?       ?       ?           ?        ?           ?        22.3748    300         0           0           
1 1 1 11 0  93 x 7  ?       ?       ?           ?        ?           ?        2.67079    360         0           0           
1 1 1 11 0  94 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 1  0  o 7  1546    13.2875 42485       1029.12  42485       1029.12  1288.72    180         346.307     180         
1 1 1 11 1  1  o 15 700.867 6.06319 8782.65     217.211  8644.54     208.68   545.819    9.5709      101.973     9.5709      
1 1 1 11 1  2  o 16 464.963 4.22142 3771.28     102.003  3894.45     94.4391  386.699    219.289     142.774     219.289     
1 1 1 11 1  3  f 0  769.145 6.73891 10485.6     259.749  10507.7     259.754  483.295    144.409     0           0           
1 1 1 11 1  4  o 9  76.6957 2.20989 102.158     8.66955  106.688     8.26548  98.7629    147.329     239.955     147.329     
1 1 1 11 1  5  o 10 449.063 4.65266 3585.42     104.707  3565.33     104.703  284.789    35.1864     49.5243     215.186     
1 1 1 11 1  6  o 12 481.931 4.92327 4104.58     118.901  4131.76     118.907  365.432    98.6243     67.7501     98.6243     
1 1 1 11 1  7  o 12 747.179 7.29302 9802.06     286.238  10012.5     258.923  583.479    33.8078     109.494     33.8077     
1 1 1 11 1  8  o 15 444.606 4.75601 3450.1      108.665  3559.64     103.093  336.76     120.555     67.1561     120.555     
1 1 1 11 1  9  o 3  746.246 7.22181 9864.03     270.071  9898.11     270.084  669.805    327.087     288.396     327.087     
1 1 1 11 1  10 o 8  1021.11 8.69002 18369.6     453.401  18652.9     435.635  745.961    207.342     34.5566     207.342     
1 1 1 11 1  11 o 15 377.101 3.50508 2506.17     67.4452  2534.63     64.9954  233.156    46.5418     44.8554     226.542     
1 1 1 11 1  12 o 14 828.423 6.90428 12070.9     286.618  12276       286.64   593.4      22.2426     10.1958     22.2426     
1 1 1 11 1  13 o 15 472.375 4.18318 3950.69     100.839  3959.5      97.1773  346.225    231.584     40.6312     231.584     
1 1 1 11 1  14 o 11 451.497 3.99668 3538.79     92.0315  3687.96     88.7006  302.65     357.058     18.0612     177.058     
1 1 1 11 1  15 o 14 639.495 5.50675 7183.09     176.462  7317.36     176.485  622.098    21.2571     355.755     21.2571     
1 1 1 11 1  16 o 9  560.074 4.7842  5551.89     136.732  5568.37     131.778  471.918    209.27      165.342     209.27      
1 1 1 11 1  17 o 1  639.629 5.36657 7233.91     175.157  7270.92     168.813  404.391    256.146     92.759      76.1465     
1 1 1 11 1  18 o 1  994.397 8.12125 17585.9     412.131  17491       397.188  757.405    161.037     102.908     161.037     
1 1 1 11 1  19 o 7  151.887 2.36714 389.683     17.6149  428.34      18.4198  8.64535    77.0355     193.929     77.0355     
1 1 1 11 1  20 o 14 333.574 3.5077  1986.84     57.3374  1956.95     59.8879  130.22     321.941     195.505     141.941     
1 1 1 11 1  21 o 7  609.305 5.71277 6638.72     166.246  6523.55     182.12   478.187    293.99      104.635     293.99      
1 1 1 11 1  22 o 6  753.511 6.93476 10021.6     249.717  10112.5     273.576  576.431    239.578     92.5512     239.578     
1 1 1 11 1  23 o 14 162.391 2.53213 469.972     19.6375  464.605     21.5215  60.4473    270.112     328.473     270.112     
1 1 1 11 1  24 o 1  444.473 4.54235 3489.41     93.6864  3513.45     108.197  315.367    191.117     19.059      191.117     
1 1 1 11 1  25 o 8  368.843 3.7167  2428.25     67.1742  2393.79     70.17    245.199    302.832     10.6505     122.832     
1 1 1 11 1  26 o 15 341.135 3.48012 2093.59     58.155   2031.28     60.7573  242.521    116.534     27.9104     116.534     
1 1 1 11 1  27 o 8  555.854 4.97513 5466.16     130.013  5487.23     146.692  413.813    179.264     57.4549     179.264     
1 1 1 11 1  28 o 1  203.349 2.56629 706.63      24.5655  759.328     27.7316  109.231    186.44      49.223      186.44      
1 1 1 11 1  29 o 12 516.171 4.56789 4717.73     113.522  4727.19     122.631  333.163    120.027     45.2499     300.027     
1 1 1 11 1  30 f 0  631.652 5.40617 6955.41     164.49   7191.94     177.701  335.581    351.082     0           0           
1 1 1 11 1  31 o 2  471.993 4.32995 3946.89     100.345  3950.49     104.453  266.412    162.969     113.104     342.969     
1 1 1 11 1  32 o 5  555.473 4.92523 5437.33     134.341  5502.36     139.841  395.629    73.0446     30.2025     73.0446     
1 1 1 11 1  33 o 16 602.922 5.25157 6415.32     155.474  6474.63     161.84   499.931    83.9235     174.243     83.9235     
1 1 1 11 1  34 o 9  309.568 3.26609 1715.1      51.7586  1681.84     49.5741  215.656    313.457     28.9538     313.457     
1 1 1 11 1  35 o 9  190.987 2.59101 642.19      24.7841  650.64      24.8133  110.571    310.93      12.5844     310.93      
1 1 1 11 1  36 o 4  846.281 7.27148 12749.3     308.396  12672.5     308.379  637.856    204.562     105.523     204.562     
1 1 1 11 1  37 o 17 275.032 3.12475 1329.47     42.1182  1351.99     44.0116  80.0508    34.2153     208.742     214.215     
1 1 1 11 1  38 o 4  307.505 3.25757 1660.56     50.1895  1691.72     50.2081  202.867    63.3979     3.33113     243.398     
1 1 1 11 1  39 o 18 329.607 3.36677 1927.8      55.6068  1923.88     55.6174  242.805    282.146     46.2184     282.146     
1 1 1 11 1  40 o 3  763.678 6.49102 10265.1     243.451  10443.6     253.358  592.783    239.576     137.63      239.576     
1 1 1 11 1  41 o 4  448.108 4.281   3486.06     98.1364  3637.26     93.97    399.294    46.2205     194.351     46.2205     
1 1 1 11 1  42 o 17 399.961 4.08687 2781.65     85.476   2893.14     78.0148  305.975    129.888     73.2691     129.888     
1 1 1 11 1  43 o 10 236.951 3.0501  986.271     36.2243  1004.55     36.2106  184.939    332.426     66.9699     332.426     
1 1 1 11 1  44 o 18 362.2   4.38782 2288.22     84.2886  2367.25     74.5154  284.556    39.4766     86.2149     39.4766     
1 1 1 11 1  45 o 5  323.903 3.65934 1785.61     62.0987  1937.42     56.2402  266.338    314.424     106.026     314.424     
1 1 1 11 1  46 o 18 357.54  3.74833 2255.24     69.8079  2279.88     64.3742  204.177    233.597     70.2829     53.5974     
1 1 1 11 1  47 o 16 355.365 3.82441 2246.4      69.7252  2234.2      66.4603  262.401    101.718     51.401      101.718     
1 1 1 11 1  48 o 8  244.156 3.02239 1061.45     37.8626  1052.72     36.0847  199.748    262.595     82.8829     262.595     
1 1 1 11 1  49 o 15 193.639 2.81666 666.83      28.6838  662.902     25.92    95.9       287.46      61.0984     107.46      
1 1 1 11 1  50 o 17 400.413 4.26712 2852.07     85.6306  2840.05     85.6202  299.751    316.842     65.9718     316.842     
1 1 1 11 1  51 o 12 185.397 2.78672 625.988     25.9232  593.263     25.8475  161.694    148.489     95.6497     148.489     
1 1 1 11 1  52 o 12 300.953 3.6237  1617        56.075   1597.44     53.2088  191.992    11.493      12.4376     191.493     
1 1 1 11 1  53 o 7  34.0584 3.38956 20.6377     5.07477  21.331      6.13535  20.132     231.946     52.3369     231.946     
1 1 1 11 1  54 o 1  138.852 2.44688 342.229     17.0375  341.488     17.0153  72.3558    93.0044     26.3768     273.004     
1 1 1 11 1  55 f 0  171.516 2.59872 536.194     22.3804  507.393     22.2835  79.2096    297.803     0           0           
1 1 1 11 1  56 o 4  240.537 3.1998  1088.11     36.4524  966.833     40.2684  149.95     323.654     10.5806     143.654     
1 1 1 11 1  57 o 6  275.515 3.46821 1362.21     51.6257  1332.5      43.915   220.463    342.757     86.3355     342.757     
1 1 1 11 1  58 f 0  361.314 4.10899 2349.02     76.4002  2289.53     72.3905  227.887    296.602     0           0           
1 1 1 11 1  59 o 7  326.556 3.66382 1909.9      61.4208  1877.82     58.4821  264.872    305.717     108.2       305.717     
1 1 1 11 1  60 f 0  150.252 2.59636 412.933     20.1219  388.306     18.9825  59.9164    249.016     0           0           
1 1 1 11 1  61 o 14 165.849 2.75276 498.44      23.5612  477.982     22.1979  112.44     252.315     16.7424     252.315     
1 1 1 11 1  62 o 6  34.6458 4.76524 26.4458     7.94747  18.0705     7.9637   5.29656    230.608     24.7199     230.608     
1 1 1 11 1  63 o 3  124.664 2.88805 284.999     19.8233  267.756     16.1231  57.7963    42.9496     39.1491     222.95      
1 1 1 11 1  64 o 11 63.0229 3.21912 64.0798     10.9256  78.2221     8.84729  26.6555    356.529     8.72076     176.529     
1 1 1 11 1  65 o 19 42.7006 4.11873 34.1642     10.0185  32.0296     6.91158  2.49202    292.832     44.5064     292.832     
1 1 1 11 1  66 o 2  63.3324 3.66971 71.5208     12.4707  72.3578     10.5117  12.4433    326.751     47.4236     146.751     
1 1 1 11 1  67 o 19 138.724 3.04601 352.474     23.7095  333.306     18.384   66.1962    267.434     40.1819     87.4342     
1 1 1 11 1  68 o 9  54.9287 3.9979  62.2636     11.6325  47.227      10.0622  19.2885    61.9328     17.5776     241.933     
1 1 1 11 1  69 o 18 214.759 3.75971 856.634     45.1143  793.263     35.5068  139.449    60.7865     10.4904     60.7865     
1 1 1 11 1  70 o 10 164.402 3.31764 503.721     29.2681  462.415     25.3302  111.764    160.889     20.2763     160.889     
1 1 1 11 1  71 o 16 118.827 3.24821 259.169     20.6825  245.998     17.8893  73.8216    110.356     2.21626     110.356     
1 1 1 11 1  72 o 16 31.7137 5.96327 19.3316     11.1042  18.5308     8.24712  1.2007     320.718     0.0450646   140.718     
1 1 1 11 1  73 o 4  190.571 3.45554 675.506     35.3427  627.128     30.5947  105.268    10.2403     25.4396     190.24      
1 1 1 11 1  74 o 17 30.3216 5.69526 20.5533     9.34492  14.4883     8.34345  0.933487   245.272     33.331      245.272     
1 1 1 11 1  75 o 15 69.7161 3.66108 90.6642     13.3573  85.2925     12.0376  41.6204    247.315     1.20327     247.315     
1 1 1 11 1  76 o 8  62.5813 4.04223 70.9606     13.4194  71.8622     11.5549  36.6744    190.991     0.724603    190.991     
1 1 1 11 1  77 o 11 69.4616 4.02964 94.8939     14.2498  81.2943     13.5378  38.0203    310.508     5.70643     130.508     
1 1 1 11 1  78 f 0  78.7423 3.73221 118.623     15.7252  106.666     13.5616  48.3089    208.199     0           0           
1 1 1 11 1  79 o 11 68.3497 4.00744 81.2911     14.5013  89.5636     12.4677  46.3476    336.979     13.5936     336.979     
1 1 1 11 1  80 o 17 34.4744 5.76261 25.2224     10.1557  20.9843     9.46189  13.7419    145.944     8.5608      325.944     
1 1 1 11 1  81 o 2  16.5196 5.22259 -0.36525    8.571    -6.68849    9.41923  4.68158    132.625     22.4681     132.625     
1 1 1 11 1  82 o 17 35.868  5.72125 24.2305     10.5506  26.2348     9.53512  17.6178    220.589     2.64449     40.5894     
1 1 1 11 1  83 o 10 21.2965 5.71609 6.15772     8.29374  7.43436     8.52691  3.60521    74.3429     28.5251     74.3429     
1 1 1 11 1  84 o 5  77.425  3.49088 98.6719     13.4343  121.955     13.3784  46.7735    121.242     3.62646     121.242     
1 1 1 11 1  85 o 4  23.8397 6.34798 10.0757     10.1185  8.59461     10.5517  6.34742    53.1903     3.48278     233.19      
1 1 1 11 1  86 o 4  57.7422 5.31797 61.2912     13.8427  68.2893     16.1924  32.0879    236.737     0.584748    56.7379     
1 1 1 11 1  87 o 8  33.4705 7.69066 26.5248     15.3687  21.1381     14.2192  9.7357     229.238     14.3287     49.2379     
1 1 1 11 1  88 f 0  27.3137 7.63577 20.1152     14.5686  -7.8607     20.8802  12.8671    187.171     0           0           
1 1 1 11 1  89 o 1  31.2672 8.46117 13.5811     15.2763  25.7068     21.6535  14.8372    180.085     4.88027     180.085     
1 1 1 11 1  90 o 18 30.1911 8.64064 -0.474922   20.4103  28.9151     22.2218  12.8048    36.5992     1.39142     216.599     
1 1 1 11 1  91 o 11 31.9775 10.4029 16.9251     25.5621  -17.3738    61.8278  12.5693    69.8011     4.14513     249.801     
1 1 1 11 1  92 x 1  ?       ?       ?           ?        ?           ?        9.7659     290.743     0           0           
1 1 1 11 1  93 x 7  ?       ?       ?           ?        ?           ?        7.25369    256.051     0           0           
1 1 1 11 1  94 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 2  0  o 9  877.157 10.0389 13663       441.031  13663       441.031  698.574    180         130.656     180         
1 1 1 11 2  1  o 15 468.993 5.23352 3871.16     126.539  3929.47     119.304  270.415    243.039     112.339     63.0388     
1 1 1 11 2  2  o 7  435.494 4.79512 3354.04     104.65   3371.06     104.651  311.555    264.968     26.7957     264.968     
1 1 1 11 2  3  o 1  726.918 7.6039  9257.15     284.895  9499.28     268.622  444.288    329.249     145.445     149.249     
1 1 1 11 2  4  o 3  178.713 2.85579 565.45      25.5763  566.578     25.5769  23.2365    108.785     152.421     288.785     
1 1 1 11 2  5  o 16 336.383 3.86524 1979        66.8212  2032.55     63.3964  81.9012    271.48      297.826     91.48       
1 1 1 11 2  6  o 12 463.668 5.00321 3757.02     116.243  3866.86     116.252  349.271    305.418     60.5495     305.417     
1 1 1 11 2  7  o 18 487.549 4.64986 4195.64     116.035  4232.49     111.109  361.02     206.862     46.8653     206.862     
1 1 1 11 2  8  o 8  780.383 7.40188 10785.3     309.414  10824.9     267.964  560.25     172.16      11.2132     172.16      
1 1 1 11 2  9  o 13 414.336 4.05001 3016.1      85.8778  3069.88     82.2352  290.78     42.68       15.5568     42.6799     
1 1 1 11 2  10 o 8  653.585 5.82559 7643.56     190.802  7505.82     190.807  587.766    110.152     259.513     110.152     
1 1 1 11 2  11 o 16 1162.71 9.80825 24058.3     582.825  23947.2     560.011  900.192    264.199     137.68      264.199     
1 1 1 11 2  12 o 18 91.6239 2.08406 151.476     9.74781  146.364     9.36648  6.44804    233.509     21.1394     233.509     
1 1 1 11 2  13 o 14 1032.29 8.74263 19047.5     461.276  18770.2     443.213  882.288    119.589     293.918     119.589     
1 1 1 11 2  14 o 3  917.868 7.5084  14815.8     351.619  15069.4     338.882  743.403    248.587     181.782     248.587     
1 1 1 11 2  15 o 13 177.874 2.46334 594.368     21.4372  527.895     22.3571  68.442     35.0945     10.0339     215.094     
1 1 1 11 2  16 o 4  606.124 5.54879 6544.7      172.181  6480.6      164.866  414.936    109.419     23.4106     289.419     
1 1 1 11 2  17 o 19 708.358 6.3692  8964.56     230.985  8827.66     221.171  448.023    113.154     106.493     293.154     
1 1 1 11 2  18 o 19 1432.09 12.7175 36005.4     912.567  36849       912.755  1039.99    359.782     37.2445     359.782     
1 1 1 11 2  19 o 9  537.432 5.13968 5167.33     138.417  5071.98     138.428  251.976    154.668     251.591     334.668     
1 1 1 11 2  20 o 15 518.796 4.96864 4697.17     129.153  4844.44     129.184  310.67     9.30525     104.405     189.305     
1 1 1 11 2  21 o 13 606.821 5.67795 6483.6      172.645  6571.43     172.685  454.247    190.14      58.3306     190.14      
1 1 1 11 2  22 o 15 1170.11 9.60116 24220       562.947  24365       563.053  924.86     327.636     190.751     327.636     
1 1 1 11 2  23 f 0  593.715 5.09833 6282.17     151.677  6214.11     151.706  365.687    269.409     0           0           
1 1 1 11 2  24 o 10 934.356 7.72873 15515.8     361.857  15450.3     361.929  527.468    33.5956     265.845     213.596     
1 1 1 11 2  25 o 11 514.012 4.63377 4704.49     121.723  4661.42     116.974  465.381    124.039     224.344     124.039     
1 1 1 11 2  26 o 14 616.457 5.30769 6822.67     170.22   6650.69     157.621  401.788    58.0828     57.6082     238.083     
1 1 1 11 2  27 o 18 365.48  3.59321 2399.28     69.6919  2335.38     61.7929  266.172    84.6578     42.0563     84.6578     
1 1 1 11 2  28 o 3  774.831 6.49939 10700.2     261.923  10590.9     242.541  675.774    244.636     271.944     244.636     
1 1 1 11 2  29 o 18 960.817 8.0839  16504.8     396.974  16250.3     381.462  609.435    280.305     127.971     100.305     
1 1 1 11 2  30 o 2  597.998 5.15821 6366.54     160.424  6312.39     148.561  343.8      174.282     141.108     354.282     
1 1 1 11 2  31 o 6  657.749 5.6271  7713.57     192.504  7627.94     178.264  393.573    19.2241     124.767     199.224     
1 1 1 11 2  32 o 2  772.931 6.5242  10830.6     257.784  10363.3     247.672  640.921    311.966     211.271     311.966     
1 1 1 11 2  33 o 4  849.336 7.03575 12771       299.448  12823.8     299.488  582.995    38.3715     14.6406     218.372     
1 1 1 11 2  34 o 3  252.94  2.84437 1096.52     35.3283  1171.77     36.7852  119.361    300.29      90.2966     120.29      
1 1 1 11 2  35 o 4  355.072 3.44339 2272.82     60.0104  2196.81     62.4548  231.872    351.994     13.4675     171.994     
1 1 1 11 2  36 o 15 314.46  3.31698 1747.86     50.0483  1757.59     54.4162  258.667    129.468     105.279     129.468     
1 1 1 11 2  37 o 4  383.901 3.83943 2626.52     72.2329  2599.03     75.4462  313.029    227.591     110.271     227.591     
1 1 1 11 2  38 o 17 572.23  5.15103 5762.49     141.463  5854.2      153.8    515.865    118.162     250.373     118.162     
1 1 1 11 2  39 o 2  319.689 3.32293 1819.76     50.9534  1803.73     55.4058  248.481    143.739     71.817      143.739     
1 1 1 11 2  40 o 5  186.804 2.49952 650.412     23.114   587.358     23.611   87.6854    314.284     63.8859     134.284     
1 1 1 11 2  41 o 4  172.207 2.46978 507.538     20.4054  544.012     22.228   111.014    176.736     12.6151     176.736     
1 1 1 11 2  42 o 7  312.245 3.45067 1729.26     52.6892  1728.25     55.2705  205.009    348.878     7.33996     168.878     
1 1 1 11 2  43 o 4  78.2401 2.60495 107.616     9.96916  109.895     10.4002  8.01197    150.317     83.4939     150.317     
1 1 1 11 2  44 o 18 459.758 4.53447 3731.35     109.104  3770.55     99.577   367.459    162.344     115.419     162.344     
1 1 1 11 2  45 o 2  88.7482 2.49653 144.542     11.6767  135.217     10.484   2.77024    248.979     84.2446     68.9791     
1 1 1 11 2  46 o 15 347.596 3.76116 2136.07     67.0719  2150.5      63.9135  197.37     103.352     71.0812     283.352     
1 1 1 11 2  47 o 16 107.216 2.42187 207.311     13.3556  200.692     12.6359  49.2942    273.809     17.4023     93.8092     
1 1 1 11 2  48 o 1  520.307 5.05239 4778.65     140.686  4837.75     122.005  377.618    166.658     54.7913     166.658     
1 1 1 11 2  49 o 13 190.219 2.79612 637.717     28.1779  645.501     25.0171  100.356    156.092     47.1055     336.092     
1 1 1 11 2  50 o 10 57.4716 2.91788 60.8602     8.38356  56.9257     8.30729  36.1708    93.8885     134.084     93.8885     
1 1 1 11 2  51 o 8  409.648 4.80241 2996.72     101.642  2965.42     95.47    263.11     108.706     19.4434     288.706     
1 1 1 11 2  52 o 19 124.323 2.43728 271.959     15.5108  276.568     14.8154  83.7062    329.67      27.0577     329.67      
1 1 1 11 2  53 o 1  318.803 3.86664 1855.06     61.4477  1753.92     62.0486  211.245    325.099     2.94918     325.1       
1 1 1 11 2  54 o 15 149.484 2.54775 391.579     19.0652  400.955     19.1049  120.877    322.431     71.3081     322.431     
1 1 1 11 2  55 f 0  134.51  2.83428 334.383     19.6839  308.294     18.4906  93.6232    221.475     0           0           
1 1 1 11 2  56 o 19 275.811 3.45561 1358.59     47.7735  1341.68     47.7522  200.067    342.424     42.7316     342.424     
1 1 1 11 2  57 o 1  211.81  3.37526 804.021     40.8608  789.078     30.0219  146.512    103.272     22.8671     103.272     
1 1 1 11 2  58 o 18 53.5898 3.29837 51.93       9.25871  50.7906     8.26049  1.24207    19.9104     27.5864     199.91      
1 1 1 11 2  59 o 5  143.336 2.66837 377.082     20.1941  352.616     18.1038  91.5791    131.444     6.66716     131.444     
1 1 1 11 2  60 o 1  118.398 2.58478 260.143     16.223   238.01      14.4176  56.9509    178.528     31.421      358.528     
1 1 1 11 2  61 o 2  62.4981 3.07024 75.8936     10.6231  63.7497     8.50166  23.2474    143.714     11.7709     323.714     
1 1 1 11 2  62 o 2  120.695 2.517   257.993     15.6864  259.53      14.7096  60.9721    132.401     27.3893     312.401     
1 1 1 11 2  63 o 2  55.6077 3.12574 62.4275     9.14521  48.5954     8.12588  17.6241    325.92      4.89901     145.92      
1 1 1 11 2  64 o 6  53.8336 3.26571 48.3003     9.16782  55.6513     8.12623  9.55692    167.396     36.2747     347.396     
1 1 1 11 2  65 o 19 187.075 2.81601 639.312     27.861   604.925     24.9236  125.746    154.619     15.8627     154.619     
1 1 1 11 2  66 o 8  119.206 2.7206  259.255     17.4507  246.561     14.9702  62.5476    109.914     21.8505     289.914     
1 1 1 11 2  67 o 4  42.2785 3.97452 32.7424     8.69147  32.2019     7.70557  6.3484     63.5867     22.2365     243.587     
1 1 1 11 2  68 o 19 105.824 2.70193 198.189     15.0379  200.857     13.5207  57.472     192.81      13.3007     12.8099     
1 1 1 11 2  69 o 12 79.8842 2.92718 111.842     12.1426  116.161     11.1701  54.0443    272.468     20.2161     272.468     
1 1 1 11 2  70 o 9  209.425 3.17715 787.133     36.1018  778.221     30.3659  155.939    31.7821     50.8662     31.7821     
1 1 1 11 2  71 o 1  141.043 3.09398 377.139     23.3167  334.47      20.3865  98.3531    172.705     22.5854     172.705     
1 1 1 11 2  72 o 12 109.279 3.35373 221.867     17.8413  206.474     18.7398  84.6194    306.776     36.4446     306.776     
1 1 1 11 2  73 o 15 21.3704 5.50218 2.11932     8.13879  10.3738     7.807    2.89264    343.531     19.41       343.531     
1 1 1 11 2  74 o 3  106.174 3.33759 193.588     18.1368  211.855     17.2056  68.3565    338.327     7.71806     338.327     
1 1 1 11 2  75 o 18 69.0882 3.67539 92.9691     13.1079  80.1799     12.1557  37.7561    42.2399     6.21762     222.24      
1 1 1 11 2  76 o 4  129.307 3.16413 300.266     20.8616  300.87      20.0755  88.9532    253.133     20.9137     253.133     
1 1 1 11 2  77 o 9  39.1834 4.9143  32.0971     9.17577  25.8209     9.35365  18.127     121.632     4.95496     301.632     
1 1 1 11 2  78 o 7  55.092  4.18638 49.3158     10.8502  62.6199     11.8693  33.8545    138.221     5.33448     138.221     
1 1 1 11 2  79 o 8  82.6029 3.50514 130.276     13.6157  117.294     15.1072  51.962     93.3075     6.16119     93.3075     
1 1 1 11 2  80 o 3  31.1923 5.8183  14.7562     8.68687  23.3623     9.93473  4.98076    13.6609     23.6741     193.661     
1 1 1 11 2  81 o 3  91.5174 3.4503  145.725     14.9413  159.122     16.5981  67.6662    358.613     27.4145     358.613     
1 1 1 11 2  82 o 1  38.8988 5.36734 21.626      9.40082  38.0999     10.8133  22.8541    301.049     4.52214     301.049     
1 1 1 11 2  83 o 16 20.8854 5.7765  6.74084     8.05673  4.68629     9.59689  3.23617    248.077     9.87018     68.0765     
1 1 1 11 2  84 o 5  32.9306 6.45096 23.1069     10.6232  21.0508     11.4529  17.538     332.376     5.37558     332.376     
1 1 1 11 2  85 o 6  71.2375 4.07695 90.7738     14.4537  98.6828     14.3799  37.3756    100.141     7.40506     280.141     
1 1 1 11 2  86 o 8  61.2291 5.03766 85.9554     14.4155  59.3246     15.1542  25.5379    86.0676     18.6317     266.068     
1 1 1 11 2  87 o 14 44.9323 7.09152 51.9432     16.3254  33.6794     15.0058  19.6521    21.8907     9.333       201.891     
1 1 1 11 2  88 o 5  56.0731 7.33697 82.1645     18.2177  50.798      20.6808  27.7622    93.2569     6.96287     273.257     
1 1 1 11 2  89 o 7  35.1479 8.44356 22.887      15.8587  31.9102     19.6655  9.2775     299.05      18.678      119.05      
1 1 1 11 2  90 o 10 26.1966 8.01305 -5.82708    19.9886  14.7499     19.8584  8.58497    208.354     0.515927    208.354     
1 1 1 11 2  91 o 10 33.6403 10.7482 19.477      21.3298  19.8465     66.0799  14.9352    149.64      0.856902    149.64      
1 1 1 11 2  92 x 15 ?       ?       ?           ?        ?           ?        4.714      309.479     0           0           
1 1 1 11 2  93 x 4  ?       ?       ?           ?        ?           ?        5.52117    343.304     0           0           
1 1 1 11 2  94 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 3  0  o 3  194.163 2.90508 668.923     28.2388  668.923     28.2388  21.4638    180         319.561     180         
1 1 1 11 3  1  o 16 771.052 7.8125  10565       301.875  10534.9     301.884  586.776    45.8807     76.3209     45.8807     
1 1 1 11 3  2  o 11 268.504 3.36784 1290.82     44.0974  1264.72     46.4779  182.627    43.6817     99.2903     43.6817     
1 1 1 11 3  3  o 7  225.621 2.91365 919.774     32.1357  884.637     33.6943  86.9459    271.001     103.84      91.0015     
1 1 1 11 3  4  f 0  769.762 6.91332 10541.3     260.808  10480       272.406  387.344    334.425     0           0           
1 1 1 11 3  5  o 6  1059.05 9.56672 19721.1     507.699  20110.3     507.743  794.812    154.346     72.153      154.346     
1 1 1 11 3  6  o 11 789.544 6.78908 10975.4     263.21   11138.4     274.001  610.074    75.6766     96.5789     75.6766     
1 1 1 11 3  7  o 12 611.18  5.26646 6595.4      161.291  6649.64     161.318  507.168    54.584      155.631     54.584      
1 1 1 11 3  8  o 5  882.566 7.8951  13830.2     325.57   13808.6     371.274  607.061    273.813     46.5135     93.813      
1 1 1 11 3  9  o 10 237.68  3.14449 981.393     40.9299  1021.05     33.4445  74.3409    142.062     158.757     322.062     
1 1 1 11 3  10 o 11 510.69  4.83224 4579.13     115.379  4667.16     131.576  387.263    127.182     62.4511     127.182     
1 1 1 11 3  11 o 17 418.146 3.91237 3086.1      80.3247  3111.56     83.6225  259.73     229.336     58.9621     49.3364     
1 1 1 11 3  12 o 3  709.737 6.70296 8900.74     232.662  8963.63     244.06   617.837    343.843     233.342     343.843     
1 1 1 11 3  13 o 7  192.511 2.70197 649.293     25.4421  664.184     26.6892  22.4891    227.883     197.52      47.8826     
1 1 1 11 3  14 o 8  719.161 6.73416 9205.23     236.81   9135.57     248.405  600.503    87.024      184.122     87.024      
1 1 1 11 3  15 o 15 503.812 4.92641 4456.52     121.398  4541.68     127.343  251.544    124.007     205.521     304.007     
1 1 1 11 3  16 o 3  1060.71 9.96732 19949.6     529.779  19980       529.88   689.191    11.4108     135.199     191.411     
1 1 1 11 3  17 f 0  663.854 6.40399 7891.41     213.029  7735.22     213.057  439.929    285.9       0           0           
1 1 1 11 3  18 o 17 687.079 6.63683 8508.31     239.847  8232.32     216.954  451.222    146.18      69.2112     326.18      
1 1 1 11 3  19 o 16 178.688 2.48845 573.28      22.282   558.324     22.2822  7.49418    189.011     210.598     9.01117     
1 1 1 11 3  20 o 15 1709.73 14.4789 52169       1240.46  51743.8     1240.67  1282.31    126.129     127.032     126.129     
1 1 1 11 3  21 o 15 709.489 6.24148 9014.8      221.895  8833.95     221.925  433.395    72.9996     135.535     253         
1 1 1 11 3  22 o 3  365.006 3.53568 2375.57     65.955   2346.52     63.3825  273.609    65.1621     53.0556     65.1621     
1 1 1 11 3  23 o 18 738.828 6.2653  9713.66     236.563  9642.23     227.332  627.035    103.625     215.559     103.625     
1 1 1 11 3  24 o 15 1566.95 12.9849 44136.7     1039.95  43119       999.32   1209.76    248.065     197.098     248.065     
1 1 1 11 3  25 o 11 575.596 5.31011 6016.82     156.497  5730.9      149.87   423.552    105.373     45.0554     105.373     
1 1 1 11 3  26 o 9  756.589 6.59246 10210.3     249.924  10090       249.986  523.713    200.311     14.295      20.3111     
1 1 1 11 3  27 o 5  488.361 4.41575 4274.05     105.84   4180.65     110.199  331.505    318.413     10.3262     138.413     
1 1 1 11 3  28 o 4  1087.14 9.3398  21428.3     486.598  20528.8     529.106  796.526    92.8407     64.8563     92.8408     
1 1 1 11 3  29 o 3  233.098 2.74155 1003.9      31.314   922.651     32.6253  94.0588    120.13      106.31      300.13      
1 1 1 11 3  30 o 17 277.162 3.06694 1383.16     40.7328  1339.73     44.324   92.5614    106.143     180.428     286.143     
1 1 1 11 3  31 o 7  1052.78 9.01535 19867.6     455.142  19483.8     494.883  824.412    185.452     177.245     185.452     
1 1 1 11 3  32 o 2  526.968 4.86613 4938.44     125.649  4907.98     131.286  462.211    196.382     206.398     196.382     
1 1 1 11 3  33 o 11 468.155 4.48767 3979.29     102.879  3792.71     107.487  381.171    22.6902     126.013     22.6902     
1 1 1 11 3  34 o 8  288.91  3.32495 1537.84     45.7597  1422.12     50.1902  191.569    80.016      3.38974     80.016      
1 1 1 11 3  35 o 2  545.219 5.17561 5261        134.805  5282.65     147.753  304.977    113.359     142.672     293.359     
1 1 1 11 3  36 o 6  277.416 3.11526 1387.36     42.3031  1340.99     44.2519  151.746    71.0752     66.2705     251.075     
1 1 1 11 3  37 o 5  521.45  4.95828 4833.32     123.514  4812.08     135.328  387.432    131.658     59.7848     131.658     
1 1 1 11 3  38 o 8  544.175 5.13657 5250.88     133.547  5255.49     146.324  415.981    331.904     85.9299     331.904     
1 1 1 11 3  39 o 2  312.647 3.38951 1724.67     50.6286  1741.19     55.4958  263.224    88.5308     112.279     88.5308     
1 1 1 11 3  40 o 16 487.929 4.64174 4211.86     108.209  4234.87     118.582  427.392    150.95      191.377     150.95      
1 1 1 11 3  41 o 5  273.93  3.28768 1335.82     45.1218  1325.01     45.1426  249.443    86.9643     146.615     86.9643     
1 1 1 11 3  42 o 15 240.031 3.05776 1037.02     32.8044  1006.04     40.2598  191.907    118.192     75.7393     118.192     
1 1 1 11 3  43 o 12 338.67  3.85844 2036.51     68.7782  2032.37     62.0259  170.091    73.0875     116.082     253.087     
1 1 1 11 3  44 o 2  400.481 4.00181 2849.97     83.8876  2840.58     76.5882  247.785    342.297     44.6517     162.297     
1 1 1 11 3  45 o 15 126.594 2.50219 283.888     16.935   284.752     14.6991  24.5313    131.114     107.053     311.114     
1 1 1 11 3  46 o 4  291.488 3.12542 1513.08     47.5326  1500.35     43.713   174.471    339.722     39.7089     159.722     
1 1 1 11 3  47 o 2  173.23  2.57731 510.339     22.8179  554.159     21.8522  76.3984    28.2324     72.1688     208.232     
1 1 1 11 3  48 o 3  190.354 2.50514 649.697     24.9048  635.164     22.8679  139.863    86.2081     34.678      86.2081     
1 1 1 11 3  49 o 1  360.849 3.70257 2257.17     68.3446  2364.28     65.4411  221.864    227.127     38.9529     47.1266     
1 1 1 11 3  50 o 19 396.236 4.33738 2785.48     92.6991  2789.69     78.9949  343.674    239.962     160.523     239.962     
1 1 1 11 3  51 o 6  386.821 3.82627 2677.21     78.9293  2634.3      69.1688  310.836    234.989     108.294     234.989     
1 1 1 11 3  52 o 12 47.3036 2.95159 45.2054     8.26264  35.1008     5.57846  8.85275    52.21       39.5658     52.21       
1 1 1 11 3  53 o 2  150.167 2.79969 391.251     21.0245  409.302     21.0697  95.6412    64.1876     5.65031     64.1876     
1 1 1 11 3  54 o 5  41.9843 3.31663 38.4245     7.44936  25.5695     6.23404  11.0475    135.877     37.7191     135.877     
1 1 1 11 3  55 o 19 156.098 2.79479 427.814     21.2518  436.893     22.4488  128.669    281.088     74.3746     281.088     
1 1 1 11 3  56 o 2  144.416 2.6772  373.554     19.3744  366.8       19.3424  75.4551    110.321     28.8135     290.321     
1 1 1 11 3  57 f 0  45.9151 3.80763 36.8139     8.8929   39.1036     8.25029  73.0546    216.518     0           0           
1 1 1 11 3  58 o 11 264.878 3.61295 1254.64     49.3441  1237.3      46.5504  186.96     148.085     31.7826     148.085     
1 1 1 11 3  59 o 5  192.836 2.94574 661.235     27.8254  658.742     29.092   124.183    336.952     2.5956      336.952     
1 1 1 11 3  60 o 14 195.151 2.82847 670.237     28.3657  681.717     26.9256  134.571    171.086     20.4332     171.086     
1 1 1 11 3  61 o 18 87.4171 2.71548 138.613     12.3166  133.223     11.4145  39.9       47.8526     23.1871     227.853     
1 1 1 11 3  62 o 6  118.625 2.65253 249.093     16.2411  251.061     15.236   86.44      5.38678     30.1842     5.38678     
1 1 1 11 3  63 f 0  265.941 3.24822 1255.9      44.393   1258.83     42.1557  121.348    134.023     0           0           
1 1 1 11 3  64 o 4  204.953 2.88261 752.485     30.4262  740.594     28.7772  121.421    327.282     17.6775     147.282     
1 1 1 11 3  65 o 12 258.199 3.18631 1190.03     42.3327  1182.43     40.1013  170.563    303.604     12.3477     303.604     
1 1 1 11 3  66 o 12 147.324 2.75462 397.997     20.9362  374.624     19.7074  71.2424    191.172     42.2063     11.1724     
1 1 1 11 3  67 o 19 204.152 3.14092 752.192     33.9978  732.793     30.2024  154.219    350.742     52.2436     350.742     
1 1 1 11 3  68 o 5  70.7825 3.24015 98.1127     13.0153  81.6901     9.84248  25.519     68.3666     31.054      248.367     
1 1 1 11 3  69 f 0  107.101 2.95522 197.001     17.1654  212.62      14.2187  75.8688    243.167     0           0           
1 1 1 11 3  70 o 8  59.7268 3.51792 56.6801     10.8514  72.2275     9.68765  34.0993    262.675     2.37979     262.675     
1 1 1 11 3  71 o 15 87.6504 2.97603 130.013     14.0804  145.054     11.7053  51.4837    17.1266     3.66911     197.127     
1 1 1 11 3  72 o 3  132.431 3.11202 293.914     20.7463  334.59      20.4119  76.9608    165.043     9.75261     345.043     
1 1 1 11 3  73 o 6  19.1156 5.14211 3.78842     6.61231  5.80409     7.03844  1.31933    96.6452     7.37021     96.6452     
1 1 1 11 3  74 o 8  90.8364 3.00266 147.851     13.3321  148.294     13.9236  51.9178    351.995     6.14708     171.995     
1 1 1 11 3  75 o 2  40.7247 4.78383 36.0664     10.3694  26.2953     8.50637  14.0794    250.976     16.7864     70.9757     
1 1 1 11 3  76 o 18 64.9902 3.95235 75.6626     11.0673  78.3026     14.2464  32.7886    66.8445     11.0843     246.845     
1 1 1 11 3  77 o 11 84.6404 3.2504  133.383     13.443   125.172     13.9917  58.6178    321.903     16.7179     321.903     
1 1 1 11 3  78 o 16 55.5295 4.75578 59.6797     10.5162  54.8651     14.6882  30.6873    299.678     2.33        119.678     
1 1 1 11 3  79 o 13 37.0314 5.13556 19.9079     8.84601  33.0522     9.53218  6.42492    136.52      28.7031     316.52      
1 1 1 11 3  80 o 5  69.1262 3.50109 81.007      11.7454  93.2703     12.3385  50.364     55.0269     20.3075     55.0269     
1 1 1 11 3  81 o 4  85.1884 3.33765 123.591     13.8275  140.646     14.551   54.1503    191.19      7.58623     191.19      
1 1 1 11 3  82 o 6  26.6256 5.93223 7.94955     8.3916   19.3151     9.85649  10.0475    72.1871     3.95447     252.187     
1 1 1 11 3  83 o 4  60.5093 4.0733  66.7558     11.3865  69.6357     12.9861  41.0009    178.272     12.9217     178.272     
1 1 1 11 3  84 o 18 23.0344 6.20022 3.906       9.65472  12.2738     10.543   4.56275    52.4754     10.5694     232.475     
1 1 1 11 3  85 f 0  17.3706 5.29358 6.41632     9.13998  -15.3921    9.82388  6.50759    169.555     0           0           
1 1 1 11 3  86 o 3  36.1149 7.52104 36.2755     15.4495  19.8148     14.34    8.0613     255.521     22.387      75.5208     
1 1 1 11 3  87 o 6  62.4288 6.00677 87.2995     18.7915  68.3919     17.689   28.5233    245.165     13.6904     65.1652     
1 1 1 11 3  88 o 6  19.4827 6.436   -26.0787    21.0829  -2.28091    11.7845  2.22749    250.396     3.95216     70.3956     
1 1 1 11 3  89 o 4  22.6196 9.88133 0           0        1.7788      14.9874  4.0309     127.501     6.26181     307.501     
1 1 1 11 3  90 o 15 31.578  9.7842  -5.6148     52.3336  18.7987     17.7073  13.2335    17.4266     2.47457     197.427     
1 1 1 11 3  91 o 10 30.7724 9.63482 -33.3417    62.4881  20.355      17.7606  10.8946    177.128     2.82963     177.128     
1 1 1 11 3  92 o 9  30.8132 13.6698 0           0        17.6834     29.7295  2.80732    117.122     0.0749735   297.122     
1 1 1 11 3  93 x 1  ?       ?       ?           ?        ?           ?        12.252     238.952     0           0           
1 1 1 11 3  94 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 4  0  o 8  1101.05 9.88687 21512.1     545.34   21512.1     545.34   775.737    180         40.145      360         
1 1 1 11 4  1  o 1  351.472 3.52607 2169.89     62.1034  2208.86     62.1077  241.459    153.255     9.69546     153.255     
1 1 1 11 4  2  o 17 382.308 3.75651 2572.28     68.9237  2608.61     74.9325  212.777    347.834     101.793     167.834     
1 1 1 11 4  3  o 11 569.514 5.38674 5892.15     146.401  5609.97     160.352  504.364    265.446     212.561     265.446     
1 1 1 11 4  4  o 8  210.883 2.83629 802.078     29.2406  774.204     30.6597  57.2029    306.396     150.234     126.396     
1 1 1 11 4  5  o 8  741.558 7.16421 9954.46     252.298  9553.87     278.884  497.372    294.174     62.8379     114.174     
1 1 1 11 4  6  o 3  513.132 5.09169 4679.73     121.199  4655.4      139.945  238.618    193.06      248.241     13.0598     
1 1 1 11 4  7  o 19 361.543 3.88608 2299.91     65.2146  2333.43     75.3121  238.731    17.8617     14.4088     197.862     
1 1 1 11 4  8  o 18 298.993 3.84015 1656.65     51.9909  1513.67     62.1     198.803    147.242     5.77873     147.242     
1 1 1 11 4  9  o 17 513.997 5.97495 4730.62     159.018  4637.42     148.712  167.784    340.04      392.963     160.04      
1 1 1 11 4  10 o 4  901.482 9.25166 14480.4     368.426  14359.3     461.834  710.363    214.199     133.367     214.199     
1 1 1 11 4  11 o 17 332.881 3.84797 2012.01     58.7851  1916.18     68.9218  274.049    33.0962     113.052     33.0962     
1 1 1 11 4  12 o 6  483.467 5.11403 4175.78     113.63   4110.6      133.242  374.428    212.452     75.5301     212.452     
1 1 1 11 4  13 o 7  1131.52 10.9032 22572.4     567.589  22881.4     665.673  976.399    331.068     335.129     331.068     
1 1 1 11 4  14 o 8  663.813 6.62935 7694.22     214.697  7931.86     226.357  562.178    89.9369     187.421     89.9369     
1 1 1 11 4  15 o 14 382.134 3.88976 2599.2      71.0028  2576.58     77.7917  225.862    302.024     75.7701     122.024     
1 1 1 11 4  16 o 15 977.274 8.80362 16885.1     411.107  16997.7     450.439  721.126    181.942     48.8408     181.942     
1 1 1 11 4  17 o 11 470.665 4.55674 3899.16     107.457  3953.36     107.499  328.837    72.8806     1.59796     72.8806     
1 1 1 11 4  18 o 17 796.032 7.09271 11277.9     289.013  11193.9     276.788  554.309    294.911     21.4193     114.911     
1 1 1 11 4  19 o 14 622.785 5.66684 6859.68     180.628  6891.38     172.999  510.792    258.482     146.353     258.482     
1 1 1 11 4  20 o 11 970.593 8.34762 16716.6     405.979  16702.8     406.085  781.89     307.155     185.728     307.156     
1 1 1 11 4  21 o 2  252.179 2.94664 1168.1      38.0454  1086.48     36.4367  118.896    223.94      95.6075     43.9397     
1 1 1 11 4  22 o 7  682.137 6.03841 8247.31     206.392  8251.55     206.451  428.687    136.548     105.319     316.548     
1 1 1 11 4  23 o 13 479.778 4.54063 4062.91     106.76   4096.92     111.553  308.145    241.812     51.3593     61.8117     
1 1 1 11 4  24 o 5  571.055 5.28281 5869.79     147.784  5692.28     154.381  412.174    355.204     27.1265     355.204     
1 1 1 11 4  25 o 16 935.358 8.23763 15616.8     377.554  15424.3     394.417  524.363    270.487     272.662     90.4865     
1 1 1 11 4  26 o 2  1275.96 11.1066 29091.9     694.414  28736.2     725.427  1050.08    8.58628     298.142     8.58628     
1 1 1 11 4  27 o 11 486.058 4.5027  4146.6      107.261  4228.81     112.082  268.749    22.1834     135.143     202.183     
1 1 1 11 4  28 o 7  544.803 5.06858 5300.42     135.297  5223.2      141.355  283.052    300.378     190.549     120.378     
1 1 1 11 4  29 o 5  485.178 4.62775 4175.53     110.022  4170.04     114.961  382.469    26.037      103.343     26.037      
1 1 1 11 4  30 o 19 188.101 2.65001 684.726     24.283   571.83      25.412   94.6669    141.25      12.9329     141.25      
1 1 1 11 4  31 o 4  1052.8  9.19751 20000.4     474.343  19365.8     495.513  751.028    13.4382     27.6813     13.4382     
1 1 1 11 4  32 o 2  233.587 2.85208 1025.04     32.546   910.597     34.0347  169.7      100.407     62.0064     100.407     
1 1 1 11 4  33 o 19 143.093 2.5192  389.564     17.1138  337.362     18.7679  10.6349    288.541     148.825     108.541     
1 1 1 11 4  34 o 8  400.986 4.16392 2921.04     75.479   2781.03     90.7559  229.536    314.483     90.0498     134.483     
1 1 1 11 4  35 o 17 93.2105 2.27754 147.431     10.085   161.023     11.1652  29.0943    72.5351     154.22      72.5351     
1 1 1 11 4  36 o 12 558.193 5.06434 5575.24     135.555  5478.1      147.417  404.949    182.411     40.617      182.411     
1 1 1 11 4  37 o 6  169.324 2.54894 533.735     20.0637  483.176     22.9182  109.731    3.11887     62.1064     3.11887     
1 1 1 11 4  38 o 3  446.729 4.31239 3550.14     89.9696  3528.46     102.659  328.623    111.414     46.7821     111.414     
1 1 1 11 4  39 o 4  440.503 4.1767  3442.84     88.2342  3440.05     96.0032  412.909    281.707     229.462     281.707     
1 1 1 11 4  40 o 1  153.437 2.4078  401.282     17.2101  433.595     19.8072  96.5699    343.481     55.031      343.481     
1 1 1 11 4  41 o 12 468.812 4.378   3910.59     107.039  3887.82     98.5225  400.828    269.879     165.411     269.879     
1 1 1 11 4  42 o 18 356.132 3.68478 2267.27     62.6783  2231.63     68.6609  280.984    305.128     84.2781     305.128     
1 1 1 11 4  43 f 0  249.357 2.87981 1104.18     36.04    1100.64     35.9342  218.966    289.875     0           0           
1 1 1 11 4  44 o 12 253.378 2.8813  1143.2      36.5668  1133.37     36.6048  172.439    51.7905     11.2576     51.7905     
1 1 1 11 4  45 o 11 137.682 2.48681 326.476     17.4718  345.999     16.7907  49.2562    262.735     73.8038     82.7353     
1 1 1 11 4  46 o 16 238.679 2.92757 1005.26     35.0025  1015.04     35.0314  117.457    178.212     82.4956     358.212     
1 1 1 11 4  47 o 9  91.6759 2.43192 153.553     11.6742  144.923     10.6306  23.069     99.2764     61.3322     279.276     
1 1 1 11 4  48 o 7  549.361 5.02515 5329.26     141.275  5393.52     135.313  422.859    323.636     104.807     323.636     
1 1 1 11 4  49 o 6  194.175 2.72378 658.387     26.6572  678.853     26.3421  118.289    161.23      15.9235     341.23      
1 1 1 11 4  50 o 12 250.128 3.1693  1106.62     39.7862  1113        39.6671  186.491    105.449     45.1867     105.449     
1 1 1 11 4  51 o 8  226.415 2.98778 919.315     34.9816  899.303     32.8065  160.456    340.949     26.427      340.949     
1 1 1 11 4  52 o 19 211.902 2.71141 801.062     29.8763  791.615     27.6805  171.322    249.754     71.8947     249.754     
1 1 1 11 4  53 o 14 309.823 3.49351 1663.49     56.5981  1744.04     51.6307  215.551    27.9518     23.4634     27.9518     
1 1 1 11 4  54 o 14 367.784 4.22864 2400.17     82.158   2405.01     73.4659  316.88     344.091     150.933     344.091     
1 1 1 11 4  55 o 5  403.999 4.29955 2870.43     87.0623  2928.92     87.0285  333.345    86.1509     135.614     86.1509     
1 1 1 11 4  56 o 18 255.476 2.99255 1160.39     40.2263  1155.68     36.3078  165.013    51.3452     1.78997     231.345     
1 1 1 11 4  57 o 18 206.452 3.01785 783.72      33.2069  729.469     29.2246  143.845    72.1812     23.8133     72.1812     
1 1 1 11 4  58 o 3  176.231 2.96245 556.732     28.7171  546.05      23.3545  125.982    112.839     29.5939     112.839     
1 1 1 11 4  59 o 2  70.9804 3.17413 100.851     10.6988  79.4223     11.5186  30.9401    17.4579     3.03004     17.4578     
1 1 1 11 4  60 o 19 324.956 3.85854 1882.64     61.1481  1872.53     64.4698  240.24     170.476     58.9478     170.476     
1 1 1 11 4  61 o 14 91.0219 2.77147 151.66      12.6769  143.146     12.5433  41.7971    324.454     25.254      144.454     
1 1 1 11 4  62 o 11 184.264 2.95091 602.152     27.4325  604.253     27.0642  145.041    289.835     57.4518     289.835     
1 1 1 11 4  63 o 18 112.468 2.75969 225.824     16.2325  224.135     14.8003  58.8565    149.558     20.8408     329.558     
1 1 1 11 4  64 o 16 74.5784 3.09334 107.428     12.5587  91.4096     10.4795  40.7044    79.4726     1.71973     259.473     
1 1 1 11 4  65 o 17 190.122 2.85743 639.727     27.4664  645.919     26.9786  144.976    97.1629     50.3861     97.1629     
1 1 1 11 4  66 o 5  109.452 2.75085 219.883     15.5508  206.933     14.582   81.0563    187.973     30.9908     187.973     
1 1 1 11 4  67 o 9  83.9275 2.94663 120.149     12.8354  131.468     11.7806  59.1768    174.5       24.673      174.5       
1 1 1 11 4  68 o 8  125.214 2.83618 274.251     18.5364  284.858     16.9384  81.117     345.965     8.74654     345.965     
1 1 1 11 4  69 o 14 157.082 2.79515 423.998     22.3283  455.863     21.6027  90.1479    175.632     15.7224     355.632     
1 1 1 11 4  70 o 1  61.109  3.31138 70.4276     10.4465  63.9017     9.68542  44.0206    31.3971     23.4233     31.3971     
1 1 1 11 4  71 o 7  131.531 2.77759 308.93      18.7761  308.914     17.7863  83.5059    259.295     3.95245     259.295     
1 1 1 11 4  72 o 3  103.454 2.85897 194.569     15.1164  188.423     14.4715  68.7338    11.3866     10.9627     11.3867     
1 1 1 11 4  73 o 1  68.9083 2.98633 95.4367     10.5388  75.7071     9.94051  38.4218    110.541     5.22266     290.541     
1 1 1 11 4  74 o 10 50.3929 3.46195 51.9999     8.89397  40.5128     8.32138  22.0256    281.89      14.0076     101.89      
1 1 1 11 4  75 o 13 119.843 2.70168 269.158     16.4788  245.558     15.9263  79.936     46.001      13.7998     46.001      
1 1 1 11 4  76 o 8  76.6119 3.06258 108.332     12.3845  103.129     11.023   47.4794    175.938     3.78442     175.938     
1 1 1 11 4  77 o 5  82.8778 2.94848 126.95      12.1475  120.276     12.2555  44.2475    222.423     10.7972     42.4231     
1 1 1 11 4  78 o 18 31.4582 4.88243 23.2811     7.76633  14.757      7.29081  12.9967    228.016     3.81942     48.016      
1 1 1 11 4  79 o 12 91.5071 3.08315 145.666     13.942   156.805     14.249   61.696     235.758     14.2707     235.758     
1 1 1 11 4  80 o 2  50.744  4.05434 53.8796     10.0569  41.7885     10.0399  21.1663    208.519     16.575      28.5191     
1 1 1 11 4  81 o 16 107.847 2.97722 211.244     16.5321  209.721     15.5757  62.0883    31.9586     4.56126     211.959     
1 1 1 11 4  82 o 10 21.845  5.89249 7.19692     8.24695  7.09122     9.69411  4.89206    240.101     3.20117     60.1013     
1 1 1 11 4  83 o 13 31.0647 6.24527 11.2249     10.9225  27.1642     10.6424  1.65871    263.18      30.6861     83.18       
1 1 1 11 4  84 o 18 39.9014 6.05079 27.9748     11.9344  36.3273     11.5668  24.2087    267.886     7.22825     267.886     
1 1 1 11 4  85 o 10 57.9782 5.75483 62.3729     18.1195  70.0289     13.4101  34.0908    36.3458     2.96216     36.3458     
1 1 1 11 4  86 o 9  29.0265 8.16371 -7.422      30.668   18.757      12.4136  8.46058    108.101     9.45723     288.101     
1 1 1 11 4  87 o 9  55.4124 10.6528 88.7001     50.9732  67.7942     15.6914  29.5134    32.7085     1.9688      212.709     
1 1 1 11 4  88 o 16 35.7142 9.12892 38.534      29.2945  21.0044     13.1906  15.5343    180.538     5.5901      0.537754    
1 1 1 11 4  89 o 8  29.6098 8.64551 -1.79083    30.1796  19.8743     16.3716  12.8243    80.5597     0.736373    80.5598     
1 1 1 11 4  90 o 15 24.3577 7.71022 -39.6445    30.3596  11.0275     16.2721  6.78563    3.3578      4.82315     183.358     
1 1 1 11 4  91 o 5  34.1426 9.75701 49.2439     32.39    14.4678     18.6425  13.7485    64.6934     4.36655     244.693     
1 1 1 11 4  92 o 5  26.365  12.357  0           0        -1.72438    29.0469  2.43934    11.0252     2.6893      191.025     
1 1 1 11 4  93 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 5  0  o 2  435.569 4.77622 3364.56     104.2    3364.56     104.2    358.737    7.43926e-06 87.4117     7.43926e-06 
1 1 1 11 5  1  o 19 960.345 9.30145 16400.9     435.693  16330.2     459.243  634.963    204.842     109.593     24.8419     
1 1 1 11 5  2  o 9  336.383 3.74695 2039.95     63.1628  1971.06     63.1525  204.868    57.7924     47.8608     237.792     
1 1 1 11 5  3  o 15 310.935 3.74441 1733.81     58.3465  1693.12     58.3397  255.087    83.4755     114.436     83.4755     
1 1 1 11 5  4  o 10 676.96  7.10648 8175.3      233.85   8078.32     248.028  468.959    38.2752     26.664      218.275     
1 1 1 11 5  5  o 4  550.871 6.32501 5438.95     180.406  5322.01     168.732  467.681    354.565     162.061     354.565     
1 1 1 11 5  6  o 10 714.557 8.10166 9181.01     259.117  8932.84     317.334  617.272    231.103     219.303     231.103     
1 1 1 11 5  7  o 15 393.482 4.83311 2804.27     91.9983  2684.95     98.333   284.814    154.713     28.1943     154.713     
1 1 1 11 5  8  o 17 544.245 6.24379 5309.85     164.46   5193.23     175.8    299.191    245.035     173.196     65.0352     
1 1 1 11 5  9  o 2  621.965 7.97991 7002.04     226.651  6721.11     268.136  450.185    61.869      18.1757     61.869      
1 1 1 11 5  10 o 18 973.722 10.2326 17316.3     499.245  16343       499.09   677.513    33.9262     40.4316     213.926     
1 1 1 11 5  11 o 6  771.245 8.14775 10747.1     285.297  10353.9     340.935  518.712    158.442     63.3246     338.443     
1 1 1 11 5  12 o 13 225.408 2.92036 917.471     32.1826  883.386     33.7385  130.32     18.5773     16.6067     198.577     
1 1 1 11 5  13 o 7  720.637 6.65538 9324.75     229.054  9090.73     250.85   402.998    247.486     221.51      67.4861     
1 1 1 11 5  14 o 8  652.94  5.97551 7596.12     182.284  7519.56     207.804  522.735    259.133     121.511     259.133     
1 1 1 11 5  15 f 0  343.834 3.58565 2103.87     57.6038  2086.27     65.6663  230.187    12.5248     0           0           
1 1 1 11 5  16 o 1  605.846 5.60126 6657.13     158.336  6357.62     180.488  387.784    349.667     81.9699     169.667     
1 1 1 11 5  17 o 12 617.56  5.52209 6752.18     163.63   6768.83     177.89   326.158    192.209     223.325     12.2093     
1 1 1 11 5  18 o 10 981.077 8.44073 17094.3     397.295  17052.1     431.926  707.442    338.063     16.586      338.063     
1 1 1 11 5  19 o 13 1182.74 10.0941 24797.4     572.828  24855.6     622.776  923.207    84.1934     159.792     84.1934     
1 1 1 11 5  20 o 15 691.786 6.12819 8500.07     203.389  8469.25     221.116  583.891    123.804     192.074     123.804     
1 1 1 11 5  21 o 18 271.336 2.92293 1315.61     37.2683  1293.73     42.0368  177.893    124.817     1.27873     124.817     
1 1 1 11 5  22 o 18 469.791 4.29633 3928.34     94.8644  3895.08     107.016  278.657    250.901     97.7452     70.901      
1 1 1 11 5  23 o 15 1286.71 10.7525 29418       650.353  29372       733.747  1055.14    143.106     283.777     143.106     
1 1 1 11 5  24 o 1  177.479 2.41026 567.367     20.0947  549.028     22.657   7.36514    10.3142     239.257     10.3142     
1 1 1 11 5  25 o 19 826.198 7.0773  12189.1     274.768  12023.7     309.979  529.969    6.76068     104.757     186.761     
1 1 1 11 5  26 o 1  369.036 3.70291 2428.25     62.483   2399.11     73.9291  320.008    160.011     157.776     160.011     
1 1 1 11 5  27 o 3  460.651 4.46353 3788.73     96.0377  3734.13     109.502  318.399    254.561     5.38431     254.561     
1 1 1 11 5  28 o 16 148.211 2.58988 404.661     17.7188  374.445     20.5004  12.7397    304.486     196.559     304.486     
1 1 1 11 5  29 o 19 410.927 4.08575 2998.2      78.4447  2988.05     89.4531  276.86     218.571     6.20332     38.5711     
1 1 1 11 5  30 o 4  135.467 2.37847 334.021     15.3708  316.719     16.8262  31.4268    254.675     46.982      74.6752     
1 1 1 11 5  31 o 6  794.448 7.08669 11281.5     275.865  11117.4     288.184  473.57     168.288     164.372     348.288     
1 1 1 11 5  32 o 2  347.906 3.53604 2142.47     59.0061  2148.42     64.1936  115.863    107.029     245.471     287.03      
1 1 1 11 5  33 f 0  232.921 2.83245 980.442     31.5946  942.782     34.4055  155.662    179.744     0           0           
1 1 1 11 5  34 o 11 192.79  2.63808 662.391     23.6811  655.062     27.1559  115.43     300.149     8.56171     120.149     
1 1 1 11 5  35 o 12 373.004 3.74335 2435.69     65.2664  2497.77     74.4843  244.433    26.8462     20.1089     206.846     
1 1 1 11 5  36 o 11 327.83  3.35299 1900.36     52.6975  1910.06     57.386   212.673    350.43      18.8489     170.43      
1 1 1 11 5  37 o 4  572.023 5.29272 5784.71     141.475  5827.2      161.386  382.798    164.179     24.2537     344.179     
1 1 1 11 5  38 o 5  284.532 3.16897 1426.1      42.1132  1444.42     48.0983  215.118    30.2887     50.7083     30.2887     
1 1 1 11 5  39 o 5  333.722 3.48661 1958.68     54.3642  1990.92     62.0624  240.493    97.8048     30.3164     97.8048     
1 1 1 11 5  40 o 2  188.046 2.67566 632.971     26.2952  620.731     24.1063  102.471    336.286     36.7079     156.286     
1 1 1 11 5  41 o 5  435.608 4.23751 3309.6      88.2072  3423.92     96.7315  338.48     124.047     85.2029     124.047     
1 1 1 11 5  42 o 19 320.329 3.28429 1772.5      50.4554  1867.31     54.984   216.672    202.307     3.47536     202.307     
1 1 1 11 5  43 o 16 302.903 3.10908 1596.33     46.1941  1657.82     48.1998  219.779    144.84      35.1079     144.84      
1 1 1 11 5  44 o 15 289.809 3.09345 1452.14     44.8536  1527.06     44.9841  183.781    236.196     20.457      56.1958     
1 1 1 11 5  45 o 19 342.017 3.60848 1986.16     63.1209  2165.89     60.3377  266.573    359.605     73.7877     359.605     
1 1 1 11 5  46 o 2  147.44  2.22302 369.409     15.9867  401.629     16.8679  78.3905    327.702     31.8546     147.702     
1 1 1 11 5  47 o 2  210.514 2.74812 773.784     28.9586  797.932     29.0209  150.026    64.3331     24.3874     64.3331     
1 1 1 11 5  48 o 3  242.249 2.97255 1046.36     36.0537  1035.22     36.1194  142.481    143.233     36.2764     323.233     
1 1 1 11 5  49 o 8  444.116 4.41729 3451.64     98.2636  3553.96     98.3484  348.062    301.271     100.394     301.271     
1 1 1 11 5  50 o 6  450.857 4.40062 3614.8      97.0036  3605.32     101.79   299.237    288.183     5.76095     108.183     
1 1 1 11 5  51 o 11 326.716 3.61777 1925.77     60.8465  1863.35     57.6187  216.753    163.812     0.210398    343.813     
1 1 1 11 5  52 o 7  333.928 3.74112 1998.08     63.5861  1960.77     61.6248  253.923    337.177     66.557      337.177     
1 1 1 11 5  53 o 2  178.677 2.76805 555.728     24.7779  576.888     24.7875  114.97     24.941      2.37458     24.9409     
1 1 1 11 5  54 o 7  271.335 3.60468 1294.33     50.3477  1319.51     47.6147  182.712    228.17      10.4134     228.17      
1 1 1 11 5  55 o 3  374.323 4.32252 2499.06     76.4391  2480.45     85.4443  264.476    299.674     35.9597     299.674     
1 1 1 11 5  56 o 16 202.384 2.85126 724.557     28.9281  728.846     28.9084  127.673    243.446     4.8227      63.4464     
1 1 1 11 5  57 o 10 161.098 2.78632 447.816     23.0701  473.639     21.8331  59.4973    215.082     87.3902     35.0822     
1 1 1 11 5  58 o 11 153.859 3.09246 428.421     26.4267  412.859     20.9928  55.4891    350.21      85.8772     170.21      
1 1 1 11 5  59 o 10 311.894 3.7731  1706.84     59.0941  1751.78     58.8446  207.349    216.035     8.43514     216.035     
1 1 1 11 5  60 o 8  168.052 2.76801 468.497     24.5335  535.724     21.7091  112.539    302.411     11.4697     302.411     
1 1 1 11 5  61 o 3  60.9074 3.15177 57.8675     9.33251  75.2555     9.68518  2.44241    49.2048     75.4749     49.2047     
1 1 1 11 5  62 o 10 92.1369 2.97316 161.503     13.0218  141.175     14.2049  64.0134    43.6885     23.3628     43.6885     
1 1 1 11 5  63 o 14 94.9699 2.89487 161.988     13.3653  159.236     14.1075  43.1607    354.405     29.2766     174.404     
1 1 1 11 5  64 o 4  75.5662 3.15555 108.688     11.8634  95.451      11.888   33.6531    46.9598     20.9475     226.96      
1 1 1 11 5  65 o 13 112.23  2.68811 223.96      15.1     224.486     15.094   71.9254    296.459     6.39158     296.459     
1 1 1 11 5  66 o 12 44.9262 3.75775 33.8117     8.32591  39.3701     8.20837  9.45477    219.685     21.9183     39.6852     
1 1 1 11 5  67 o 13 79.934  2.957   120.589     11.8339  107.868     11.7498  54.5085    305.373     20.3091     305.373     
1 1 1 11 5  68 o 3  23.5284 5.01379 8.23002     6.68444  11.7239     6.25989  4.10071    55.0073     14.376      55.0073     
1 1 1 11 5  69 o 15 87.6423 2.78465 143.168     12.9273  131.314     11.4733  26.4513    8.13781     54.8981     188.138     
1 1 1 11 5  70 o 2  176.48  2.68543 573.313     23.9311  537.435     23.5613  119.822    97.1338     18.5708     97.1338     
1 1 1 11 5  71 o 17 19.1783 4.64085 -1.63084    6.36702  10.5881     5.94589  5.81507    48.0141     23.7684     48.0141     
1 1 1 11 5  72 o 2  48.559  3.76048 41.9037     8.66429  43.9056     9.33764  32.2248    183.788     18.718      183.788     
1 1 1 11 5  73 f 0  80.2182 2.88469 129.885     11.3453  101.847     11.6014  36.321     95.7486     0           0           
1 1 1 11 5  74 f 0  61.1603 3.26353 69.7999     9.89619  65.3697     9.95039  27.184     198.185     0           0           
1 1 1 11 5  75 o 5  47.2461 3.82802 36.9348     9.02022  44.9627     8.64082  32.2411    336.868     15.8567     336.868     
1 1 1 11 5  76 o 4  44.2325 4.00625 36.4349     8.85082  35.601      8.50236  23.5089    62.0857     1.73311     242.086     
1 1 1 11 5  77 f 0  16.8396 4.86314 5.51451     7.23176  -2.33679    6.20712  9.63202    88.4541     0           0           
1 1 1 11 5  78 o 18 56.9585 3.44792 58.9876     10.1321  59.0917     9.34219  32.1518    302.402     1.97824     122.402     
1 1 1 11 5  79 o 16 22.2947 5.33784 9.61199     7.47147  8.04931     6.72405  3.79637    93.4365     1.72177     273.437     
1 1 1 11 5  80 o 13 29.8645 5.27085 18.9915     8.20975  15.7771     7.53445  7.26745    331.779     17.5019     151.779     
1 1 1 11 5  81 o 10 39.8114 5.2218  30.2312     10.5138  31.1132     9.52855  21.2654    186.478     1.25775     6.47831     
1 1 1 11 5  82 o 10 67.9422 4.23477 83.6769     14.7246  88.6851     13.7486  26.7596    94.1272     26.4296     274.127     
1 1 1 11 5  83 o 15 15.7747 5.19047 -15.4653    9.96271  -2.26172    10.39    0.328461   86.2212     5.12596     86.2212     
1 1 1 11 5  84 f 0  38.4436 6.75245 35.7978     13.9114  25.927      12.083   31.9016    190.539     0           0           
1 1 1 11 5  85 o 4  21.2435 6.87467 -3.00287    21.5019  -2.13976    10.0026  0.943609   104.411     1.40837     284.411     
1 1 1 11 5  86 f 0  31.008  8.25182 15.141      23.092   20.2047     13.4734  9.67247    58.0463     0           0           
1 1 1 11 5  87 o 17 23.7372 7.65249 -4.61798    27.4464  0.577191    12.0662  5.28158    177.036     9.51595     357.036     
1 1 1 11 5  88 o 16 23.1893 7.15954 7.38965     18.4571  -0.976901   12.533   5.93965    14.0319     1.29686     194.032     
1 1 1 11 5  89 o 6  31.9268 8.57223 23.9786     20.2757  19.6101     17.5273  15.1412    260.538     0.935699    260.538     
1 1 1 11 5  90 o 18 33.5603 8.5693  42.241      21.0454  7.78988     18.9183  11.1948    216.668     11.4677     36.6681     
1 1 1 11 5  91 o 2  30.891  8.33211 0.345198    21.5169  35.1613     19.0724  11.1867    341.397     2.2067      341.397     
1 1 1 11 5  92 o 6  24.3881 8.36739 -21.9325    35.1041  -16.6117    28.8028  2.76285    149.416     3.49308     329.416     
1 1 1 11 5  93 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 6  0  o 2  312.7   4.62179 1735.05     72.3553  1735.05     72.3553  232.228    7.4752e-06  12.2436     7.47518e-06 
1 1 1 11 6  1  o 16 831.519 10.2966 12139       391.987  12403.6     463.854  632.223    286.894     72.6262     286.894     
1 1 1 11 6  2  o 15 554.606 6.56257 5442.42     182.394  5464.6      182.4    407.841    265.94      30.5215     265.94      
1 1 1 11 6  3  o 9  366.359 4.60255 2363.82     81.6552  2393.98     87.2874  190.934    3.55643     127.371     183.556     
1 1 1 11 6  4  f 0  272.508 3.4511  1340.5      44.3877  1291.71     49.6179  308.76     212.21      0           0           
1 1 1 11 6  5  o 11 375.921 4.21881 2491.98     79.4745  2517.11     79.4801  339.425    55.841      176.491     55.841      
1 1 1 11 6  6  o 3  158.157 2.68415 442.453     20.7052  444.033     21.8306  47.933     93.2863     62.4005     273.286     
1 1 1 11 6  7  o 7  217.102 2.95486 835.652     30.4992  834.778     33.7155  139.239    16.5417     42.9799     16.5417     
1 1 1 11 6  8  o 11 604.816 5.92708 6504.92     170.4    6464.56     188.389  482.659    286.282     108.363     286.282     
1 1 1 11 6  9  o 6  1076.48 10.0584 20417.9     542.588  20709       542.633  830.915    211.055     115.765     211.055     
1 1 1 11 6  10 o 17 258.031 3.21148 1203.77     39.3496  1156.17     43.5052  124.316    228.929     94.1023     228.929     
1 1 1 11 6  11 o 10 416.204 4.68196 3105.44     100.515  3035.24     94.7668  346.85     88.2104     120.771     88.2104     
1 1 1 11 6  12 o 1  522.076 5.10164 4836.95     130.255  4825.43     136.614  419.264    128.631     105.086     128.631     
1 1 1 11 6  13 o 13 885.344 8.14717 13887       352.763  13917.4     370.002  617.777    29.6308     30.9814     209.631     
1 1 1 11 6  14 o 14 190.907 2.74931 667.738     26.2925  624.268     26.2913  31.6196    305.198     182.948     125.198     
1 1 1 11 6  15 o 12 142.849 2.43292 366.107     16.5836  357.327     18.1759  38.0744    214.727     55.772      34.727      
1 1 1 11 6  16 f 0  811.94  7.4014  11938.4     286.872  11446.1     314.154  630.586    216.838     0           0           
1 1 1 11 6  17 o 17 561.288 5.32956 5690.69     142.819  5479.52     156.401  429.462    148.238     68.053      148.238     
1 1 1 11 6  18 o 18 659.409 6.04365 7857.06     186.006  7562.2      212.024  370.298    291.315     195.726     111.315     
1 1 1 11 6  19 o 4  752.352 6.79043 10206.4     238.489  9868.9      271.849  575.962    236.142     85.1603     236.142     
1 1 1 11 6  20 o 12 318.708 3.41431 1828.86     50.8016  1771.51     57.9079  281.303    91.9847     155.113     91.9847     
1 1 1 11 6  21 o 16 974.482 8.52886 17078       379.815  16618.2     449.279  734.205    161.248     83.9985     161.248     
1 1 1 11 6  22 o 17 425.456 4.10241 3201.41     79.8704  3215        94.4858  225.262    28.9371     140.284     208.937     
1 1 1 11 6  23 o 13 459.838 4.25611 3786.32     91.9535  3709.52     103.723  352.043    242.68      70.7284     242.68      
1 1 1 11 6  24 f 0  736.204 6.357   9630.56     219.998  9591.62     248.168  666.734    52.6057     0           0           
1 1 1 11 6  25 o 14 120.001 2.22961 256.022     12.8757  254.674     13.8953  21.5993    306.373     152.599     306.373     
1 1 1 11 6  26 o 12 720.788 6.07413 9157.33     210.832  9268.62     227.753  536.915    62.6398     63.4116     62.6399     
1 1 1 11 6  27 o 4  827.578 6.87113 12075.4     273.827  12222.2     295.81   620.471    277.506     77.9156     277.506     
1 1 1 11 6  28 o 8  799.661 6.69067 11382       257.56   11304.4     278.216  669.879    326.353     219.307     326.353     
1 1 1 11 6  29 o 13 415.531 3.92655 3061.56     80.1118  3059.71     83.3869  268.806    205.91      33.1221     25.9101     
1 1 1 11 6  30 o 7  367.685 3.49325 2397.07     61.838   2395.44     66.7994  168.372    251.131     168.707     71.1308     
1 1 1 11 6  31 o 11 495.633 4.40984 4339.19     105.245  4371.57     113.688  419.605    336.59      156.214     336.59      
1 1 1 11 6  32 o 7  179.709 2.36149 573.096     20.4316  571.565     22.0696  95.9124    215.917     28.8431     35.9168     
1 1 1 11 6  33 f 0  543.604 4.88759 5229.98     124.906  5251.77     140.94   524.007    86.5543     0           0           
1 1 1 11 6  34 o 16 98.1009 2.18343 172.156     10.2974  169.289     11.1208  8.11782    132.255     72.8259     312.255     
1 1 1 11 6  35 o 1  87.3847 2.21513 135.789     9.29797  135.216     10.0549  38.1304    86.1874     173.083     86.1874     
1 1 1 11 6  36 f 0  65.2176 2.3738  77.7561     7.39961  73.441      8.02804  28.4766    344.158     0           0           
1 1 1 11 6  37 o 16 253.588 2.84202 1140.36     35.3322  1139.5      36.8851  162.435    316.033     13.7437     136.033     
1 1 1 11 6  38 o 19 271.853 2.95686 1331.42     39.4168  1289.07     41.0972  174.409    206.273     15.8208     26.2725     
1 1 1 11 6  39 o 17 271.944 3.11838 1351.93     45.232   1271.09     39.725   195.234    38.3223     28.1871     38.3223     
1 1 1 11 6  40 o 3  215.475 2.64006 821.101     27.8589  825.033     29.1462  127.177    136.154     27.8488     316.154     
1 1 1 11 6  41 o 13 148.939 2.34219 391.295     17.7582  395.125     17.1984  93.3945    211.316     15.6004     211.316     
1 1 1 11 6  42 o 16 340.441 3.35158 2019.15     58.2419  2092.06     56.0464  212.209    185.737     36.2279     5.73684     
1 1 1 11 6  43 f 0  339.378 3.33285 1992.45     55.5217  2093.59     57.8539  250.695    200.797     0           0           
1 1 1 11 6  44 o 1  17.8739 4.21709 6.03132     4.20265  4.47754     4.73233  98.5838    274.386     206.438     274.386     
1 1 1 11 6  45 o 11 853.828 7.42905 12301.9     310.729  13690.8     324.952  669.547    235.229     173.084     235.229     
1 1 1 11 6  46 o 2  207.567 2.58555 740.525     27.3229  787.627     26.412   125.729    81.5515     22.8401     261.552     
1 1 1 11 6  47 o 17 331.531 3.26558 1955.3      54.2211  1944.15     54.2899  242.62     20.1924     40.3888     20.1924     
1 1 1 11 6  48 o 13 154.483 2.49063 419.074     19.5815  427.235     18.9702  120.201    147.286     51.0889     147.286     
1 1 1 11 6  49 o 7  81.3559 2.39574 121.381     10.0421  113.793     9.45298  10.2718    94.9282     71.3475     274.928     
1 1 1 11 6  50 o 17 122.552 2.39084 261.75      14.9492  271.297     14.37    39.7907    49.7734     73.9364     229.773     
1 1 1 11 6  51 o 17 334.609 3.7261  2035.04     65.6     1940.4      59.328   231.902    285.849     19.1565     285.849     
1 1 1 11 6  52 o 18 368.913 3.86225 2395.33     72.3244  2437.48     70.4515  255.319    125.608     20.5155     125.608     
1 1 1 11 6  53 o 12 151.185 2.61018 422.698     20.2634  388.42      19.2915  96.9602    136.194     5.19522     136.194     
1 1 1 11 6  54 o 6  233.979 3.17592 968.013     38.284   974.97      36.1569  174.203    251.814     45.0075     251.814     
1 1 1 11 6  55 o 6  96.2527 2.97485 172.029     14.4962  157.532     14.1264  5.27188    19.8887     107.481     199.889     
1 1 1 11 6  56 o 16 110.616 2.71527 207.517     15.5923  227.4       14.3582  60.6923    171.173     10.8095     351.173     
1 1 1 11 6  57 o 17 214.091 3.24865 817.189     36.0498  810.52      33.6266  128.403    74.4101     20.6853     254.41      
1 1 1 11 6  58 o 12 269.961 3.58474 1314.02     50.0332  1276.18     46.9499  200.72     86.172      50.206      86.172      
1 1 1 11 6  59 o 2  136.906 2.93234 334.878     20.975   331.363     19.184   101.339    69.8979     32.4289     69.8979     
1 1 1 11 6  60 o 15 378.34  4.49241 2526.54     87.7087  2575.82     82.5071  303.898    119.33      115.272     119.33      
1 1 1 11 6  61 o 3  40.0349 4.32514 29.5933     8.42646  28.84       8.37839  1.26037    256.137     7.16354     76.1371     
1 1 1 11 6  62 o 12 109.24  2.94814 214.766     16.6327  210.088     15.5797  63.0178    83.8955     8.39604     263.895     
1 1 1 11 6  63 o 2  109.629 2.4825  217.411     13.6254  210.051     13.6142  67.6961    78.2046     0.781813    78.2047     
1 1 1 11 6  64 o 2  101.725 2.95682 180.734     13.8835  188.15      16.1525  83.3531    107.551     49.4418     107.551     
1 1 1 11 6  65 o 11 77.5525 2.79685 110.188     10.7214  104.438     10.9334  53.0932    271.848     34.2947     271.848     
1 1 1 11 6  66 o 11 76.0669 2.94246 114.489     11.1868  92.8161     11.0754  42.3193    169.479     2.98266     349.479     
1 1 1 11 6  67 f 0  115.623 2.69546 237.198     15.3617  239.364     15.8308  68.1094    193.058     0           0           
1 1 1 11 6  68 o 7  201.504 3.11573 720.595     29.3707  728.651     33.4425  138.994    302.531     23.9009     302.531     
1 1 1 11 6  69 o 17 80.8587 2.95754 124.301     11.6071  109.888     12.198   46.803     257.678     4.85083     77.6778     
1 1 1 11 6  70 o 5  137.591 2.82226 336.959     18.9948  339.435     19.8772  86.2754    269.919     0.756135    269.919     
1 1 1 11 6  71 o 1  106.966 2.98973 202.885     15.1816  206.988     16.7813  71.3261    72.3881     10.8573     72.3881     
1 1 1 11 6  72 o 13 60.5176 3.37894 64.1432     10.0317  68.178      10.2964  21.7692    214.704     29.0382     34.7039     
1 1 1 11 6  73 o 3  52.5977 3.59669 48.627      9.28312  51.9414     9.43738  16.8025    33.6179     28.5564     213.618     
1 1 1 11 6  74 o 11 46.7554 3.92588 38.1644     8.89312  42.0177     9.13764  28.0572    43.0236     4.75289     43.0236     
1 1 1 11 6  75 o 18 85.2526 3.08614 144.527     13.9334  117.933     12.3596  52.5785    293.227     2.29031     293.227     
1 1 1 11 6  76 o 17 32.2554 4.75831 7.94384     7.86752  33.0193     7.76339  14.1354    286.306     0.0834562   106.306     
1 1 1 11 6  77 o 13 60.5695 3.43421 69.8407     10.6919  63.5617     9.98587  33.3692    109.455     4.49572     289.455     
1 1 1 11 6  78 o 19 29.2159 5.40855 19.3619     8.62368  13.8023     7.46095  11.624     307.933     4.70291     127.933     
1 1 1 11 6  79 o 16 39.7141 4.81557 26.0916     9.68136  34.0176     8.54975  17.2224    103.329     10.276      283.329     
1 1 1 11 6  80 f 0  32.1305 5.32598 21.3101     9.07723  19.0773     7.77939  15.6237    172.016     0           0           
1 1 1 11 6  81 o 7  68.9954 3.54221 81.7477     12.9646  93.2355     11.0861  40.812     330.326     0.437772    330.327     
1 1 1 11 6  82 o 2  40.3812 6.08385 34.6635     11.9777  30.9058     11.8975  15.3187    357.831     14.5863     177.831     
1 1 1 11 6  83 o 6  48.8336 5.44945 42.2214     12.9135  51.321      12.7544  32.6038    98.3356     11.5227     98.3356     
1 1 1 11 6  84 o 17 38.7463 6.0416  29.5916     10.8592  31.2877     11.9722  18.7276    262.857     3.69697     82.8572     
1 1 1 11 6  85 o 5  18.3863 5.81364 -1.38637    11.6623  -2.95709    10.2406  1.70458    351.53      16.0997     351.53      
1 1 1 11 6  86 o 17 21.2056 6.32946 2.03802     12.3735  4.56608     10.7776  3.56977    274.552     5.78477     94.5522     
1 1 1 11 6  87 o 9  29.1039 8.03169 24.5134     18.7615  5.04713     15.9876  4.75211    106.69      2.48644     106.69      
1 1 1 11 6  88 f 0  22.2681 6.9053  1.10357     14.5711  1.83523     14.9556  10.6475    123.197     0           0           
1 1 1 11 6  89 o 11 23.0338 6.87985 -19.3725    18.9114  13.589      13.1588  3.51318    134.906     0.175868    314.906     
1 1 1 11 6  90 o 12 30.9393 8.49042 9.33271     20.8014  30.1007     18.9614  12.669     338.427     1.83086     338.427     
1 1 1 11 6  91 o 15 25.7543 7.76604 -9.69388    20.5414  20.2154     18.0177  5.72863    177.348     6.05652     357.348     
1 1 1 11 6  92 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 7  0  o 13 1638.33 15.0185 47662.7     1232.61  47662.7     1232.61  1292.82    4.074e-06   211.971     4.074e-06   
1 1 1 11 7  1  o 14 164.099 2.58734 464.516     20.7715  489.987     21.7871  9.54687    262.778     183.412     82.7781     
1 1 1 11 7  2  f 0  1075.43 10.0145 20270.4     539.679  20776.7     539.707  748.745    233.609     0           0           
1 1 1 11 7  3  o 11 1252.4  11.7106 27820.9     770.815  27876.8     697.244  1055.12    127.206     304.442     127.206     
1 1 1 11 7  4  o 19 489.679 4.8279  4216.8      121.236  4283.39     115.599  319.079    84.6116     54.4188     264.612     
1 1 1 11 7  5  o 10 743.161 7.49639 9763.49     279.191  9824.21     279.182  561.507    5.50517     59.2463     5.50518     
1 1 1 11 7  6  o 10 399.914 4.2359  2874.67     84.8895  2794.51     84.8843  152.949    293.432     258.059     113.432     
1 1 1 11 7  7  o 13 609.574 5.81822 6573.82     173.462  6600.39     181.927  380.541    77.0744     108.56      257.074     
1 1 1 11 7  8  o 12 299.471 3.32482 1606.16     49.8916  1572.48     49.9003  163.306    140.663     81.5607     320.664     
1 1 1 11 7  9  f 0  581.905 5.55838 5955.09     158.204  6049.99     165.941  294.63     249.043     0           0           
1 1 1 11 7  10 o 14 766.592 7.34353 10397.4     295.834  10444.8     267.627  605.483    99.8372     115.267     99.8372     
1 1 1 11 7  11 o 15 567.877 5.72636 5645.25     167.114  5788.73     158.576  508.825    316.01      217.488     316.01      
1 1 1 11 7  12 o 12 914.776 8.38595 14678       375.215  15010.2     393.611  543.52     71.9812     225.701     251.981     
1 1 1 11 7  13 o 17 616.705 5.74198 6643.23     177.425  6842.09     177.466  396.943    239.8       83.8768     59.7998     
1 1 1 11 7  14 o 12 243.702 3.03315 1051.69     36.1409  1053.21     37.9262  180.466    282.216     58.2099     282.216     
1 1 1 11 7  15 o 6  84.2226 2.40156 126.337     9.83551  125.461     10.386   49.7412    69.948      164.189     69.948      
1 1 1 11 7  16 o 11 474.461 4.78619 3915.87     113.769  4065.12     113.807  344.083    89.3334     23.2857     89.3334     
1 1 1 11 7  17 f 0  414.287 4.24595 2996.94     86.0356  3087.33     90.2677  235.789    231.745     0           0           
1 1 1 11 7  18 o 7  1065.68 9.6794  19940.1     504.512  20372.3     529.282  751.48     118.834     19.6091     298.834     
1 1 1 11 7  19 o 6  717.421 6.88488 9034.69     234.894  9220.42     259.776  490.266    329.106     37.1107     149.106     
1 1 1 11 7  20 o 12 616.962 5.58705 6702.66     176.415  6794.02     168.934  392.837    266.557     85.4209     86.5571     
1 1 1 11 7  21 o 5  340.224 3.69364 2014.82     64.407   2088.43     61.4431  111.509    289.142     245.997     109.142     
1 1 1 11 7  22 o 5  172.96  2.52494 522.352     21.3951  537.927     22.376   68.4898    158.852     34.8853     338.852     
1 1 1 11 7  23 o 2  450.188 4.33276 3583.94     95.6025  3600.79     99.8613  331.699    4.05091     44.0342     4.05092     
1 1 1 11 7  24 o 12 711.026 6.39966 8967.39     223.015  8964.35     232.946  381.785    227.46      239.848     47.4598     
1 1 1 11 7  25 o 17 458.529 4.38986 3735.47     98.6452  3718.4      103.044  269.492    227.445     97.2667     47.445      
1 1 1 11 7  26 o 16 336.224 3.43344 1987.64     55.4079  2019.59     60.2313  128.699    237.022     203.502     57.0217     
1 1 1 11 7  27 o 13 626.374 5.61957 6913.96     168.922  7001.58     183.656  485.312    25.671      94.5795     25.671      
1 1 1 11 7  28 o 2  82.2842 2.35407 120.867     9.26643  119.495     10.0852  20.1532    237.003     81.7815     237.003     
1 1 1 11 7  29 o 2  652.175 5.80486 7435.24     181.722  7654.55     197.589  478.917    13.3019     44.5481     13.3019     
1 1 1 11 7  30 o 16 284.986 3.17839 1440.64     44.3909  1438.43     46.3725  120.3      109.66      147.651     289.66      
1 1 1 11 7  31 f 0  698.24  6.20241 8594.39     207.828  8708.4      225.97   463.343    218.126     0           0           
1 1 1 11 7  32 o 19 510.922 4.73444 4578.01     116.098  4681.42     126.236  335.736    50.6421     39.0961     230.642     
1 1 1 11 7  33 f 0  471.442 4.43663 3886.87     100.393  3996.67     109.169  339.112    305.995     0           0           
1 1 1 11 7  34 o 16 299.011 3.19427 1581.14     47.8517  1588.76     47.8785  161.668    17.1119     84.3898     197.112     
1 1 1 11 7  35 o 15 316.1   3.25785 1757.82     50.5542  1785.05     52.6541  240.965    119.298     53.5005     119.298     
1 1 1 11 7  36 f 0  78.9841 2.33848 105.434     8.80697  116.225     9.66996  88.7211    218.93      0           0           
1 1 1 11 7  37 o 18 175.763 2.3714  547.182     20.8702  547.937     20.9055  103.673    353.153     15.6972     173.153     
1 1 1 11 7  38 o 3  166.67  2.31344 498.289     19.297   486.498     19.3465  24.2504    216.278     270.242     216.278     
1 1 1 11 7  39 o 6  359.526 3.75883 2278.05     67.6922  2307.34     67.7543  262.657    355.752     36.7804     355.752     
1 1 1 11 7  40 o 11 173.23  2.61742 499.584     23.1208  565.411     22.1922  105.498    335.286     6.96715     155.286     
1 1 1 11 7  41 o 14 342.296 3.56535 2049.21     59.7968  2107.39     62.5213  285.169    52.9594     109.045     52.9594     
1 1 1 11 7  42 o 13 137.113 2.27232 321.619     15.8141  345.091     15.3807  94.3868    247.753     34.6177     247.753     
1 1 1 11 7  43 o 9  303.883 3.14684 1595.75     48.7566  1680.17     47.0035  212.434    280.402     14.6102     280.402     
1 1 1 11 7  44 o 2  59.9473 2.53422 58.739      7.1743   69.3639     7.98924  1.53256    71.7844     44.4297     251.784     
1 1 1 11 7  45 o 19 613.57  5.30052 6417.36     159.61   6968.47     166.358  413.435    44.4633     10.5378     224.463     
1 1 1 11 7  46 o 2  314.586 3.11835 1660.26     49.9335  1853.05     48.1646  192.397    267.815     39.2886     87.8148     
1 1 1 11 7  47 o 4  84.5564 2.32897 126.014     9.83125  127.895     9.86871  21.9261    314.859     147.842     314.859     
1 1 1 11 7  48 o 9  164.559 2.41048 455.826     20.4951  505.085     19.1293  104.808    2.44099     1.06598     182.441     
1 1 1 11 7  49 o 1  109.919 2.35038 214.821     13.8327  214.016     11.9666  69.9117    155.994     28.4397     155.994     
1 1 1 11 7  50 o 19 438.038 4.27291 3380.91     101.847  3435.17     84.8281  295.925    190.406     4.05014     190.406     
1 1 1 11 7  51 o 17 118.162 2.40442 251.202     15.1591  244.399     13.2466  72.3649    85.4388     6.46633     85.4388     
1 1 1 11 7  52 f 0  178.71  2.91701 587.873     29.4826  546.004     22.5001  100.352    27.9157     0           0           
1 1 1 11 7  53 f 0  158.046 2.67295 457.408     22.4085  428.926     19.9232  109.564    106.498     0           0           
1 1 1 11 7  54 o 15 116.013 2.93277 247.673     17.2307  230.69      16.8121  68.725     145.701     0.689078    325.701     
1 1 1 11 7  55 o 9  339.09  4.43219 2028.11     77.7658  2060.87     72.7389  248.412    327.126     50.0556     327.126     
1 1 1 11 7  56 o 11 286.421 3.6744  1471.14     54.2894  1443.91     51.1726  166.634    301.533     43.0464     121.533     
1 1 1 11 7  57 o 9  179.685 3.25573 572.994     32.7512  574.306     25.3611  129.303    170.601     28.1526     170.601     
1 1 1 11 7  58 f 0  151.627 2.95154 415.694     24.7951  401.216     19.8333  80.8686    181.332     0           0           
1 1 1 11 7  59 o 11 128.395 3.01699 288.862     21.0128  297.513     17.5433  64.6175    178.155     33.2209     358.155     
1 1 1 11 7  60 o 6  89.6506 2.88709 153.267     13.1619  133.242     12.6922  64.677     204.928     31.8716     204.928     
1 1 1 11 7  61 o 11 59.0939 3.30443 62.4516     10.2369  62.5498     9.13998  2.87352    313.389     62.4796     133.389     
1 1 1 11 7  62 o 15 146.823 2.6747  381.236     20.0884  385.417     19.2244  92.2845    270.184     1.23821     90.1843     
1 1 1 11 7  63 o 10 39.8886 3.93689 30.4648     7.77986  27.4382     7.52545  4.34085    61.5812     20.999      241.581     
1 1 1 11 7  64 o 13 95.1816 2.84791 157.354     13.3855  165.692     13.7216  63.4403    164.995     12.8329     164.995     
1 1 1 11 7  65 o 16 84.2797 2.94347 127.208     12.203   126.419     12.5798  36.7575    102.705     29.7938     102.705     
1 1 1 11 7  66 o 6  40.8467 3.99138 35.6711     7.4625   25.5834     8.10241  4.91007    250.726     26.7614     70.7264     
1 1 1 11 7  67 o 11 18.9625 4.83033 2.98473     6.37658  7.24947     5.66343  7.12898    70.5168     19.7109     70.5168     
1 1 1 11 7  68 o 13 170.345 2.64291 550.907     22.7327  484.235     22.3433  125.781    114.228     37.0437     114.228     
1 1 1 11 7  69 o 19 22.3311 5.16982 6.80361     6.8905   10.4373     6.60613  3.91155    211.649     25.0267     211.649     
1 1 1 11 7  70 o 15 128.084 2.69117 300.967     17.4043  285.28      17.1032  75.9844    28.0611     7.98271     208.061     
1 1 1 11 7  71 o 4  22.2063 5.07544 5.90855     6.61879  11.2872     6.55466  0.765324   97.7376     16.2269     97.7376     
1 1 1 11 7  72 o 10 51.823  3.38206 48.3444     8.67853  48.9746     8.68999  15.5618    302.313     30.3668     122.313     
1 1 1 11 7  73 o 18 84.3506 2.91691 132.996     12.7256  122.724     11.8648  56.211     164.758     10.2291     164.758     
1 1 1 11 7  74 o 2  71.9757 3.28233 101.177     12.2667  86.2898     11.2868  40.6857    169.652     5.12865     349.652     
1 1 1 11 7  75 o 15 49.7884 3.9858  39.9291     9.96741  51.4185     9.29291  27.2547    253.137     2.48339     73.1366     
1 1 1 11 7  76 o 5  26.6216 5.32185 20.2029     8.19959  6.39301     7.63876  7.42387    358.827     7.23307     178.827     
1 1 1 11 7  77 o 18 22.9478 5.44721 13.872      8.03419  4.05082     7.46798  0.244972   232.055     21.5815     52.0546     
1 1 1 11 7  78 o 8  43.8331 4.79963 33.9567     10.7441  38.6702     9.48586  16.3248    66.5581     18.0837     246.558     
1 1 1 11 7  79 o 5  15.4906 4.73428 -6.09493    7.274    2.92016     6.86057  2.25359    297.396     14.3018     297.396     
1 1 1 11 7  80 o 3  22.7519 5.63993 5.98303     7.78591  12.0361     8.36035  6.45885    258.029     4.21408     78.0292     
1 1 1 11 7  81 o 7  40.7607 5.01687 38.8113     10.5341  26.068      9.1954   18.7101    221.379     8.35902     41.3786     
1 1 1 11 7  82 o 8  32.7042 6.30096 16.535      10.1609  27.4084     11.3459  11.9732    208.284     10.7839     28.2836     
1 1 1 11 7  83 o 6  51.4455 4.86911 51.5036     11.0435  50.2238     13.2374  27.2898    310.173     3.80419     130.173     
1 1 1 11 7  84 o 12 52.902  5.84055 55.1832     14.0198  56.2223     15.8739  18.1123    131.948     24.2282     311.948     
1 1 1 11 7  85 o 13 76.7627 4.83087 126.568     16.9133  99.4358     19.1438  51.498     159.114     14.5755     159.114     
1 1 1 11 7  86 o 15 47.8874 6.29542 38.2957     13.665   55.7386     15.4441  31.1296    12.5885     10.1016     12.5885     
1 1 1 11 7  87 o 11 45.2553 7.3485  44.4988     14.2864  43.4732     18.393   25.3373    354.571     1.33878     354.571     
1 1 1 11 7  88 o 1  29.9267 7.64248 17.0424     12.8335  20.5838     16.5856  7.83366    313.554     15.0752     133.554     
1 1 1 11 7  89 o 2  21.7057 6.83344 -8.87057    13.072   9.32886     17.0296  3.7962     305.215     7.19983     125.215     
1 1 1 11 7  90 o 2  28.3028 8.33529 16.2509     20.2462  14.5047     18.9202  8.33755    213.318     7.21333     33.3175     
1 1 1 11 7  91 o 10 22.1147 7.22323 -2.7629     20.1995  -3.17037    17.2243  0.359648   274.04      0.750635    94.0402     
1 1 1 11 7  92 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 8  0  o 12 245.731 2.8435  1070.81     34.9955  1070.81     34.9955  206.634    180         65.9868     180         
1 1 1 11 8  1  o 1  655.89  5.80735 7649.76     190.885  7602.78     190.882  574.897    278.48      214.856     278.48      
1 1 1 11 8  2  o 15 967.055 8.47791 16560.6     401.844  16617       419.722  766.413    310.306     139.871     310.306     
1 1 1 11 8  3  o 16 747.11  6.66617 9865.04     254.927  9928.52     244.091  514.971    231.435     42.8511     51.4348     
1 1 1 11 8  4  o 15 967.787 8.86906 16613.5     440.273  16618.3     419.775  657.77     180.368     79.4606     0.367877    
1 1 1 11 8  5  o 19 387.805 4.01821 2680.91     76.2022  2649.85     79.9138  170.635    217.028     205.422     37.0276     
1 1 1 11 8  6  f 0  294.139 3.36047 1502.8      48.3487  1563.93     50.7257  93.8243    219.451     0           0           
1 1 1 11 8  7  o 10 146.049 2.51823 378.183     18.8628  377.756     17.9898  43.9251    321.984     55.8492     141.984     
1 1 1 11 8  8  o 18 275.721 3.24135 1367.1      43.6901  1327.43     45.8206  177.321    74.1467     14.4647     254.147     
1 1 1 11 8  9  o 13 1047.25 9.68973 19399.3     508.523  19526.4     508.548  761.524    87.3154     15.1746     87.3154     
1 1 1 11 8  10 o 4  130.04  2.4709  306.746     16.473   293.064     15.7048  26.7965    182.332     55.0869     2.3322      
1 1 1 11 8  11 o 3  595.389 5.70462 6376.41     166.051  6192.99     174.13   421.168    259.944     5.20831     79.9439     
1 1 1 11 8  12 o 10 202.129 2.7988  738.549     30.3406  709.58      26.288   23.3838    281.269     221.37      101.269     
1 1 1 11 8  13 o 6  880.164 7.86949 13748       347.106  13733.8     347.119  638.771    42.005      16.3048     42.0047     
1 1 1 11 8  14 o 13 390.302 4.05955 2695.53     77.4824  2704.23     81.285   285.296    95.1361     30.8352     95.1361     
1 1 1 11 8  15 o 10 753.004 6.84691 10065.6     258.371  10044.2     258.381  671.733    45.6477     273.177     45.6477     
1 1 1 11 8  16 o 8  314.889 3.43677 1749.29     54.2329  1765.16     54.2335  194.511    68.6021     37.7377     248.602     
1 1 1 11 8  17 o 9  288.428 3.34418 1484.46     49.4805  1464.16     47.1822  124.895    39.5045     141.452     219.505     
1 1 1 11 8  18 o 5  1268.11 11.2    28639.5     711.756  28487.1     711.77   938.557    262.669     61.7827     262.669     
1 1 1 11 8  19 o 10 618.898 5.75347 6707.82     170.203  6875.16     186.498  525.716    96.9785     181.637     96.9785     
1 1 1 11 8  20 o 19 391.747 4.05141 2690.89     77.625   2749.39     81.4383  170.653    28.5708     202.776     208.571     
1 1 1 11 8  21 o 15 707.912 6.47171 8815.04     218.964  8960.28     239.903  592.209    113.295     186.91      113.295     
1 1 1 11 8  22 o 1  402.775 4.05926 2860.38     78.1257  2890.6      85.6111  267.757    193.301     18.1174     13.3012     
1 1 1 11 8  23 o 7  275.409 3.17591 1335.88     41.7938  1352.65     45.8053  194.949    319.61      36.2303     319.61      
1 1 1 11 8  24 o 9  661.04  6.09502 7701.64     192.544  7798.27     210.968  456.915    22.4905     17.7895     202.491     
1 1 1 11 8  25 o 17 557.008 5.13539 5533.13     140.178  5469.46     146.413  296.432    25.5282     190.341     205.528     
1 1 1 11 8  26 f 0  660.302 5.81773 7660.77     184.362  7805.62     200.461  452.694    69.776      0           0           
1 1 1 11 8  27 o 9  194.37  2.60986 674.049     24.3243  665.031     26.4593  114.411    69.5949     9.20752     249.595     
1 1 1 11 8  28 o 5  270.571 3.02828 1301.43     39.2987  1293.66     42.7422  224.111    34.6032     96.0733     34.6032     
1 1 1 11 8  29 o 1  330.766 3.41497 1936.76     54.1895  1941.93     58.9311  192.495    287.574     69.527      107.574     
1 1 1 11 8  30 o 4  653.899 5.78938 7494.2      181.7    7679.6      197.571  368.052    270.476     182.585     90.4759     
1 1 1 11 8  31 o 16 349.832 3.41579 2179.62     57.5242  2159.46     62.1328  234.705    67.551      11.4101     247.551     
1 1 1 11 8  32 o 5  687.616 5.82641 8331.14     192.935  8451.84     208.416  483.72     237.658     4.37587     237.657     
1 1 1 11 8  33 o 11 311.371 3.38239 1702.18     49.2535  1735.6      56.1423  314.947    14.2301     222.697     14.2301     
1 1 1 11 8  34 o 13 302.045 3.23248 1579.64     46.8706  1655.66     50.9778  269.51     44.8167     134.234     44.8167     
1 1 1 11 8  35 o 7  444.925 4.23683 3485.29     90.4678  3537.64     98.3591  271.403    327.244     73.5223     147.244     
1 1 1 11 8  36 o 15 420.57  3.83549 3147        77.6615  3127.23     83.8758  305.274    314.812     31.3157     314.812     
1 1 1 11 8  37 o 8  647.033 5.54443 7446.37     172.726  7422.61     186.546  454.676    155.835     11.4939     155.834     
1 1 1 11 8  38 o 16 230.69  2.76772 926.512     31.9966  960.604     31.9898  142.643    55.6033     20.9771     235.603     
1 1 1 11 8  39 o 19 209.647 2.72109 788.047     26.6225  770.427     30.3849  189.935    289.549     130.634     289.549     
1 1 1 11 8  40 o 1  178.171 2.44967 531.05      21.0196  595.363     22.7368  102.85     247.078     25.0391     67.0783     
1 1 1 11 8  41 o 18 213.546 2.58786 805.975     26.6026  810.962     28.751   139.382    233.155     4.19182     53.1554     
1 1 1 11 8  42 o 1  69.2472 2.34106 86.851      7.93057  83.5643     8.25824  5.2249     141.088     53.9887     321.088     
1 1 1 11 8  43 o 12 270.516 2.97351 1278.1      37.831   1317.56     42.7098  172.282    89.6007     21.2375     269.601     
1 1 1 11 8  44 o 1  345.341 3.34873 2076.3      55.6898  2155.3      60.2008  278.741    114.586     89.9044     114.586     
1 1 1 11 8  45 o 5  89.2022 2.34156 137.872     9.87362  144.696     11.0165  6.78164    325.915     94.6058     145.915     
1 1 1 11 8  46 o 19 247.097 2.7986  1058.14     33.9264  1107.78     35.3883  142.053    133.236     46.6826     313.236     
1 1 1 11 8  47 o 4  93.3586 2.39166 149.945     10.88    159.609     11.4647  30.7858    258.757     46.8283     78.7569     
1 1 1 11 8  48 o 10 339.077 3.31991 1996.86     55.2441  2083.61     57.5898  230.968    213.399     6.46902     213.399     
1 1 1 11 8  49 o 7  419.503 3.9056  3025.08     79.0807  3225.54     85.1537  310.464    330.795     56.7924     330.795     
1 1 1 11 8  50 o 6  484.442 4.44195 4142.39     110.101  4197.06     105.493  395.231    37.5924     139.892     37.5924     
1 1 1 11 8  51 o 6  71.5418 2.51508 91.3921     8.92418  90.5935     9.05247  9.56294    345.915     1.51991     165.915     
1 1 1 11 8  52 o 17 245.01  2.92449 1066.85     38.2853  1063.18     33.3705  176.254    62.6435     30.8922     62.6435     
1 1 1 11 8  53 o 10 143.14  2.64843 378.438     20.7542  349.035     17.1723  63.9474    67.5142     54.6426     247.514     
1 1 1 11 8  54 f 0  153.549 2.70972 407.536     21.857   429.497     19.6992  107.46     149.236     0           0           
1 1 1 11 8  55 o 1  262.615 3.23243 1233.06     45.3576  1216.04     39.5647  186.075    203.298     27.4835     203.298     
1 1 1 11 8  56 o 11 246.786 3.47724 1068.1      46.2741  1096.01     39.3587  212.974    328.458     104.878     328.458     
1 1 1 11 8  57 o 3  101.287 2.86879 183.435     15.6487  181.435     13.3333  67.4593    22.5515     13.7003     22.5515     
1 1 1 11 8  58 f 0  172.613 2.85535 535.648     25.3218  522.672     24.0743  103.327    50.4244     0           0           
1 1 1 11 8  59 f 0  89.1297 2.94275 141.412     12.9099  141.485     13.3031  97.4024    155.002     0           0           
1 1 1 11 8  60 o 13 82.64   3.35174 141.512     12.9232  103.723     14.2152  56.2879    270.359     22.5096     270.359     
1 1 1 11 8  61 o 1  143.195 3.049   369.506     22.2207  360.53      21.4897  63.6863    178.551     55.6466     358.551     
1 1 1 11 8  62 o 15 142.987 2.99283 377.696     22.1929  350.684     20.6585  88.6396    53.235      4.03477     233.235     
1 1 1 11 8  63 f 0  38.462  4.56249 29.4028     8.64751  25.0674     8.30726  7.10515    4.97702     0           0           
1 1 1 11 8  64 o 18 251.494 3.15814 1160.76     40.1757  1094.34     39.4233  172.587    88.3902     22.4011     88.3902     
1 1 1 11 8  65 o 18 126.851 2.74483 290.373     17.759   283.213     17.0977  95.1593    177.746     33.6106     177.746     
1 1 1 11 8  66 o 9  27.1156 5.12992 11.1075     7.4313   16.222      6.96186  5.52528    136.863     28.0061     136.863     
1 1 1 11 8  67 o 13 59.6311 3.17801 69.7026     9.70636  58.274      9.13142  33.3711    26.3328     1.91567     206.333     
1 1 1 11 8  68 o 14 57.0241 3.25984 55.7557     9.4853   61.3574     8.92954  28.0161    285.721     11.7865     105.721     
1 1 1 11 8  69 o 16 93.404  2.93631 164.316     14.8598  148.313     12.5528  55.1555    13.6676     5.43425     193.668     
1 1 1 11 8  70 o 18 57.0656 3.36223 61.2708     10.0267  56.4032     9.03181  44.2603    199.42      27.9646     199.42      
1 1 1 11 8  71 o 11 64.7062 3.05158 75.0379     10.6554  75.6765     8.92923  53.7182    315.813     35.0341     315.813     
1 1 1 11 8  72 o 6  29.1988 4.71255 19.0355     7.21409  13.4431     6.32255  7.3547     257.01      12.753      77.0102     
1 1 1 11 8  73 o 11 87.649  3.13001 137.707     14.8231  139.007     12.4609  72.4407    103.168     39.632      103.168     
1 1 1 11 8  74 o 2  90.4417 3.06862 148.531     14.9877  146.076     12.6607  65.3332    91.2452     21.0293     91.2452     
1 1 1 11 8  75 o 7  107.85  2.88971 193.713     16.2066  225.102     14.7533  63.1974    70.5099     5.62259     250.51      
1 1 1 11 8  76 o 14 40.6727 4.66025 24.1848     8.94341  38.7585     9.11141  16.9977    5.76499     12.0461     185.765     
1 1 1 11 8  77 o 11 72.4537 3.35335 90.7593     12.0416  100.13      12.1577  46.0259    261.039     5.30992     261.039     
1 1 1 11 8  78 o 1  56.0486 3.68436 47.8422     9.76297  68.4869     10.5439  34.8548    102.847     4.0588      102.847     
1 1 1 11 8  79 o 15 23.04   5.46415 12.7358     7.33437  5.79025     8.11115  6.72773    55.5629     5.05106     235.563     
1 1 1 11 8  80 o 15 41.6438 5.11537 44.6827     9.76062  23.7426     10.2496  23.3492    24.6235     0.187587    24.6237     
1 1 1 11 8  81 o 17 42.4353 5.31978 51.9856     10.3566  21.082      10.704   23.3798    68.937      0.496412    248.937     
1 1 1 11 8  82 o 8  43.0267 6.09737 55.3201     10.7356  20.7433     14.5367  13.6852    320.61      21.5105     140.61      
1 1 1 11 8  83 o 10 45.9819 6.15888 39.1889     12.3713  46.5887     14.9898  27.7246    71.7273     5.39195     71.7273     
1 1 1 11 8  84 o 18 30.3522 6.91365 18.4043     12.0417  19.648      11.8747  12.7047    285.42      2.70913     285.42      
1 1 1 11 8  85 o 4  49.8265 6.0091  50.0834     15.0628  49.6853     13.8457  29.2431    346.325     2.96243     346.325     
1 1 1 11 8  86 o 17 48.5021 5.97575 48.0376     14.1668  46.7748     13.8283  25.046     138.891     4.35506     318.891     
1 1 1 11 8  87 o 15 31.0065 7.35581 21.2652     13.0921  19.6978     13.911   4.61784    251.233     23.9547     71.2326     
1 1 1 11 8  88 o 15 26.6557 7.24793 14.0738     12.8572  12.6318     14.4905  9.88202    311.811     2.35038     131.811     
1 1 1 11 8  89 o 1  22.1471 6.71907 -6.12078    13.8081  11.6314     14.1059  3.27129    167.859     3.22224     347.859     
1 1 1 11 8  90 o 11 25.0349 7.51458 1.31469     14.5393  17.6787     18.4317  3.68869    290.909     1.70699     110.909     
1 1 1 11 8  91 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 9  0  o 15 35.0158 2.98064 22.6532     5.0296   22.6532     5.0296   78.1418    2.23118e-05 166.64      2.23118e-05 
1 1 1 11 9  1  o 2  586.157 5.36279 6113.08     160.935  6068.18     154.076  448.428    185.993     60.2326     185.993     
1 1 1 11 9  2  o 3  134.571 2.35005 328.494     15.4869  313.591     16.1663  28.0257    199.716     74.6162     19.716      
1 1 1 11 9  3  o 18 589.674 5.40216 6104.92     156.151  6223.29     163.108  427.401    313.052     12.4189     313.052     
1 1 1 11 9  4  o 3  327.96  3.53475 1890.72     60.6521  1921.6      55.3724  192.391    62.858      69.5055     242.858     
1 1 1 11 9  5  o 9  438.257 4.23924 3423.63     91.048   3384.75     95.0944  270.083    27.7066     79.4608     207.707     
1 1 1 11 9  6  o 5  808.834 6.99102 11627.4     283.375  11575.2     283.372  705.46     111.44      250.424     111.44      
1 1 1 11 9  7  o 3  306.479 3.23046 1675.68     49.6164  1653.46     49.6147  189.641    97.952      39.6201     277.952     
1 1 1 11 9  8  o 4  485.409 4.68204 4210.43     113.897  4142.48     113.887  294.428    307.904     99.8733     127.904     
1 1 1 11 9  9  o 11 51.7731 2.73654 46.1095     6.69977  49.4471     7.39828  71.214     95.2873     164.129     95.2873     
1 1 1 11 9  10 o 14 678.246 6.37703 8118.23     221.821  8195.07     211.512  449.651    289.836     71.1834     109.836     
1 1 1 11 9  11 f 0  123.949 2.40907 261.38      14.9495  283.735     14.9306  224.13     94.7616     0           0           
1 1 1 11 9  12 o 10 352.313 4.19392 2169.28     76.1545  2230.86     71.8043  267.684    246.671     55.1351     246.671     
1 1 1 11 9  13 o 3  558.811 5.50722 5498.67     154.217  5573.51     154.231  397.399    202.62      3.07503     202.619     
1 1 1 11 9  14 o 14 51.0567 2.75034 46.3964     7.13274  46.5276     6.83172  90.9131    358.577     205.638     358.577     
1 1 1 11 9  15 o 12 640.298 5.78194 7242.94     181.458  7295.07     189.542  420.369    119.753     69.9543     299.753     
1 1 1 11 9  16 o 4  450.688 4.20627 3626.08     95.0006  3574.45     95.0004  400.772    16.6824     182.016     16.6824     
1 1 1 11 9  17 o 15 449.641 4.30954 3633.25     99.2271  3534.32     94.9882  276.975    43.6317     74.6678     223.632     
1 1 1 11 9  18 o 15 667.72  5.99545 7902.96     204.933  7908.94     196.211  400.213    72.6068     147.913     252.607     
1 1 1 11 9  19 o 6  701.06  6.28412 8724.17     225.533  8708.19     215.932  453.236    242.78      89.0761     62.7804     
1 1 1 11 9  20 o 4  927.814 8.10625 15312.7     385.038  15241       368.646  667.732    197.894     12.9085     197.894     
1 1 1 11 9  21 o 6  531.674 4.95707 5007.79     134.917  5015.53     129.173  304.683    246.9       139.959     66.9003     
1 1 1 11 9  22 o 5  324.809 3.43958 1898.87     57.2191  1841.1      54.7574  254.435    307.832     74.8383     307.832     
1 1 1 11 9  23 o 19 708.796 6.64486 8870.17     230.347  8955.65     241.627  485.613    207.2       32.9128     27.2003     
1 1 1 11 9  24 o 11 414.03  4.25344 3038.03     86.1211  3039.9      90.3371  342.289    85.4754     113.801     85.4754     
1 1 1 11 9  25 o 13 432.354 4.37705 3289.56     92.5619  3338.89     97.0892  346.042    213.665     92.2558     213.665     
1 1 1 11 9  26 o 13 685.703 6.43929 8405.6      215.895  8281.47     226.443  480.021    138.16      8.92707     318.16      
1 1 1 11 9  27 o 9  598.704 5.7396  6337.99     168.059  6380.41     176.285  494.455    129.931     147.795     129.931     
1 1 1 11 9  28 o 18 477.002 4.76567 4065.32     111.152  4005.31     116.581  310.795    172.476     46.2479     352.476     
1 1 1 11 9  29 o 1  154.581 2.47456 419.939     18.7569  427.066     19.5795  93.4793    173.345     37.1742     173.345     
1 1 1 11 9  30 o 17 381.186 3.86265 2566.04     68.8094  2586.71     78.485   292.465    287.636     58.255      287.636     
1 1 1 11 9  31 o 18 348.118 3.52515 2123.08     58.8994  2174.26     64.0446  172.537    250.745     137.888     70.745      
1 1 1 11 9  32 o 11 363.426 3.68853 2311.97     65.7004  2372.22     68.6537  303.953    118.649     108.471     118.649     
1 1 1 11 9  33 o 17 46.7296 2.82739 41.0019     6.23569  37.0354     6.81739  31.3118    334.809     83.7753     334.809     
1 1 1 11 9  34 o 6  394.08  3.79488 2695.29     73.438   2813.85     76.4608  339.568    168.419     137.691     168.419     
1 1 1 11 9  35 o 17 305.468 3.12567 1626.1      45.9905  1683.04     49.6881  177.814    124.114     62.5825     304.114     
1 1 1 11 9  36 o 12 618.312 5.34837 6698.91     159.281  6879.09     172.07   547.214    339.01      236.422     339.01      
1 1 1 11 9  37 o 6  180.891 2.53869 553.474     22.0566  607.28      23.9828  95.7768    307.645     43.2913     127.645     
1 1 1 11 9  38 o 19 65.5373 2.65701 75.746      8.26271  77.0502     9.10284  54.471     17.006      180.343     17.006      
1 1 1 11 9  39 f 0  356.085 3.36878 2234.15     58.994   2263.6      61.2289  275.829    101.943     0           0           
1 1 1 11 9  40 o 4  134.009 2.23664 317.01      14.7384  319.666     15.2999  39.8185    133.974     93.3805     313.974     
1 1 1 11 9  41 o 6  238.039 2.79246 978.285     32.6383  1031.51     33.9893  175.738    232.125     31.7309     232.125     
1 1 1 11 9  42 o 13 256.679 2.85146 1166.38     35.938   1170.29     37.4078  132.758    304.005     83.1127     124.005     
1 1 1 11 9  43 o 17 349.471 3.54851 2170.74     62.1464  2163.04     62.1466  257.08     200.206     38.3116     200.206     
1 1 1 11 9  44 o 18 35.3426 3.32969 20.5997     5.50297  24.5903     5.99612  35.9848    127.15      94.8233     127.15      
1 1 1 11 9  45 o 2  110.517 2.46025 205.924     12.9123  227.914     14.3144  59.4751    150.491     12.4185     330.491     
1 1 1 11 9  46 o 7  391.017 3.83365 2726.79     73.464   2701.29     76.7284  292.507    354.939     55.3361     354.939     
1 1 1 11 9  47 o 11 130.768 2.34119 284.344     14.9051  322.877     15.7626  93.1684    142.097     30.3701     142.097     
1 1 1 11 9  48 o 14 201.047 2.60719 706.971     25.1095  726.755     27.4047  157.884    94.4716     54.7952     94.4716     
1 1 1 11 9  49 o 7  318.315 3.16134 1745        49.3651  1851.45     51.5023  255.193    219.693     85.585      219.693     
1 1 1 11 9  50 o 12 327.915 3.24281 1869.12     52.1748  1947.59     54.4103  252.037    265.516     66.4776     265.516     
1 1 1 11 9  51 o 2  136.208 2.24431 307.317     14.7561  351.371     15.8864  75.5055    316.041     20.4976     136.041     
1 1 1 11 9  52 o 16 180.737 2.68198 586.622     24.139   572.358     24.4376  72.1943    325.238     92.3067     145.238     
1 1 1 11 9  53 o 9  117.019 2.56267 248.386     16.2596  237.964     13.7     80.9261    347.062     23.4119     347.062     
1 1 1 11 9  54 o 10 87.2782 2.64593 139.145     11.7491  131.721     11.3441  36.5047    21.5908     29.5187     201.591     
1 1 1 11 9  55 o 19 34.6963 4.66981 17.6708     7.96869  26.9561     7.57019  14.5679    325.13      52.0346     325.13      
1 1 1 11 9  56 o 8  187.052 3.05196 637.412     28.3047  605.551     28.8812  132.974    314.966     23.0873     314.966     
1 1 1 11 9  57 o 2  318.727 3.94451 1829.12     64.8656  1786.94     61.1246  247.178    300.715     75.1285     300.715     
1 1 1 11 9  58 o 17 200.375 3.07692 709.11      33.0081  718.001     28.5984  146.992    237.108     34.2705     237.108     
1 1 1 11 9  59 o 17 106.382 2.83044 195.522     15.5983  207.317     14.4609  47.2393    339.038     39.1871     159.038     
1 1 1 11 9  60 o 6  116.323 3.03238 238.626     18.2693  243.311     16.986   67.8365    277.993     10.4577     97.993      
1 1 1 11 9  61 o 5  52.5166 3.7641  54.1454     10.0828  45.4074     9.44137  14.7995    114.668     25.7936     294.668     
1 1 1 11 9  62 o 10 199.58  2.78267 736.95      28.1214  680.823     27.5294  123.819    304.774     9.50185     124.774     
1 1 1 11 9  63 o 11 165.723 2.87639 499.81      22.8666  478.617     24.7966  117.161    227.988     23.4349     227.988     
1 1 1 11 9  64 o 2  34.2909 4.577   20.6381     7.6131   22.9629     7.53346  2.05955    345.47      30.2898     345.47      
1 1 1 11 9  65 o 19 79.2529 3.00355 113.479     12.588   111.167     11.1513  51.6712    308.768     9.93958     308.768     
1 1 1 11 9  66 o 13 172.052 2.84471 537.314     25.9036  518.456     23.1151  114.607    204.89      10.3967     204.89      
1 1 1 11 9  67 o 15 80.193  3.07419 109.555     13.0633  121.007     11.3779  59.8931    245.537     22.1656     245.537     
1 1 1 11 9  68 f 0  105.917 2.84517 193.876     15.9397  207.503     14.0685  72.7701    306.206     0           0           
1 1 1 11 9  69 o 19 43.7871 4.60879 35.5199     9.70465  35.4052     9.9047   13.8715    239.538     22.9053     59.5375     
1 1 1 11 9  70 o 18 34.7184 4.83158 23.7052     7.95501  21.6484     8.25043  12.2854    5.77802     4.3413      5.77802     
1 1 1 11 9  71 o 4  33.7413 4.61092 28.0959     7.55762  15.3976     7.40422  10.7707    92.9802     13.8643     272.98      
1 1 1 11 9  72 o 13 58.8639 3.28479 59.3265     9.63612  66.1668     9.55673  32.3946    150.581     5.29238     330.581     
1 1 1 11 9  73 o 12 66.3155 3.2075  75.1813     10.2331  83.886      10.9612  35.2498    286.478     9.44372     106.478     
1 1 1 11 9  74 o 5  22.0802 5.06572 12.2092     6.88078  4.9991      6.35937  1.26874    72.9514     22.3438     72.9514     
1 1 1 11 9  75 o 5  26.545  5.29968 2.51743     7.9732   23.023      8.81465  8.34717    208.764     5.14217     28.764      
1 1 1 11 9  76 o 10 44.3027 4.48406 28.0987     9.19836  46.4254     9.76961  28.2854    200.933     6.99339     200.933     
1 1 1 11 9  77 o 11 19.8996 5.45935 7.24794     6.93607  1.69922     9.18163  0.466537   112.784     19.139      112.784     
1 1 1 11 9  78 o 2  78.4701 3.36567 121.118     11.9807  103.888     14.0313  43.7857    214.463     6.96252     34.463      
1 1 1 11 9  79 o 8  53.5316 4.08441 46.2099     9.72676  61.2929     11.8756  37.7726    178.508     13.8865     178.508     
1 1 1 11 9  80 o 14 84.4813 3.63614 124.208     14.231   139.163     16.4179  65.5439    61.5904     30.8835     61.5904     
1 1 1 11 9  81 o 13 18.2245 5.4672  -0.192634   9.03499  3.0778      8.42634  1.15556    154.36      4.09892     334.36      
1 1 1 11 9  82 o 5  32.778  6.42184 12.2136     9.5864   33.5553     13.1273  14.1017    231.82      5.19789     51.82       
1 1 1 11 9  83 o 17 58.6791 5.39961 64.8511     14.6759  70.1209     16.3249  28.8044    286.878     9.92982     106.878     
1 1 1 11 9  84 o 1  37.5699 6.82723 39.6222     12.9017  19.7784     14.1508  14.4489    268.041     11.929      88.0414     
1 1 1 11 9  85 o 19 62.8892 5.46108 89.9943     15.6394  65.7125     17.1785  30.6254    199.795     11.556      19.7948     
1 1 1 11 9  86 o 11 20.4505 6.32158 -0.395423   11.5471  2.20553     12.9927  3.57886    116.023     2.47767     296.023     
1 1 1 11 9  87 o 12 31.9783 7.2845  10.7375     13.0066  33.7457     15.1383  8.60272    124.217     16.7249     304.217     
1 1 1 11 9  88 o 9  64.5421 6.1358  95.0587     19.4893  78.4954     19.045   43.5395    200.14      14.8487     200.14      
1 1 1 11 9  89 o 11 29.2168 7.3515  3.22284     15.3186  30.822      15.058   10.0183    38.9298     5.07066     218.93      
1 1 1 11 9  90 x 15 ?       ?       ?           ?        ?           ?        17.8936    12.1058     0           0           
1 1 1 11 9  91 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 10 0  o 6  89.4836 2.3069  142.446     10.3138  142.446     10.3138  28.5454    180         114.18      180         
1 1 1 11 10 1  o 9  401.706 3.85828 2863.04     77.6727  2856.78     77.6707  321.708    60.5015     85.3778     60.5015     
1 1 1 11 10 2  o 17 155.26  2.41559 429.413     18.7978  424.895     18.7919  15.5383    164.399     155.532     344.399     
1 1 1 11 10 3  o 18 984.565 8.61809 17078.3     415.917  17320.4     434.439  886.115    176.788     353.247     176.788     
1 1 1 11 10 4  o 16 480.749 4.67098 4123.02     117.573  4070.41     107.325  421.457    173.093     168.773     173.093     
1 1 1 11 10 5  o 15 535.227 4.94408 5097.06     129.691  5058.99     135.448  432.091    272.949     105.672     272.949     
1 1 1 11 10 6  o 14 370.075 3.64984 2405.22     67.6845  2449.29     67.6911  248.696    220.273     16.4574     40.2732     
1 1 1 11 10 7  o 12 467.508 4.56433 3916.33     111.746  3832.08     102.002  328.392    83.2039     2.92067     263.204     
1 1 1 11 10 8  o 5  512.71  4.80455 4673.41     126.111  4645.99     120.742  325.358    92.3305     77.5012     272.331     
1 1 1 11 10 9  o 8  558.964 5.66622 5590.1      154.463  5488.9      162.786  344.861    147.333     106.747     327.333     
1 1 1 11 10 10 f 0  390.4   3.87563 2709.95     77.454   2692.6      74.1704  257.449    285.602     0           0           
1 1 1 11 10 11 o 19 333.388 3.40372 1965.43     56.8641  1974.17     56.8707  137.148    310.544     188.551     130.544     
1 1 1 11 10 12 o 15 325.962 3.3496  1894.55     54.7157  1871.51     54.7163  288.671    230.524     158.67      230.524     
1 1 1 11 10 13 o 14 521.543 4.93392 4794.24     128.952  4849.82     128.957  456.716    85.9565     183.484     85.9565     
1 1 1 11 10 14 o 1  222.823 3.06492 886.749     35.1196  873.061     33.3186  103.604    264.971     74.5891     84.9706     
1 1 1 11 10 15 o 15 218.065 2.81576 824.131     30.7624  861.456     30.7685  137.555    206.662     46.3485     206.662     
1 1 1 11 10 16 f 0  340.335 3.74977 2036.93     63.951   2068.99     63.9554  119.414    223.903     0           0           
1 1 1 11 10 17 o 19 133.665 2.45696 307.727     16.4246  326.039     16.4538  36.8029    77.4656     231.257     77.4656     
1 1 1 11 10 18 o 12 548.026 5.17158 5290.16     142.024  5359.99     142.035  430.72     272.745     89.1934     272.745     
1 1 1 11 10 19 o 13 161.701 2.5554  466.482     20.7044  460.246     20.7102  59.4214    251.409     10.1201     251.409     
1 1 1 11 10 20 o 12 644.998 5.6919  7337.16     183.971  7419.04     183.989  453.28     267.801     9.24723     87.8008     
1 1 1 11 10 21 o 4  862.461 7.59902 12991.6     335.314  13416       321.121  727.932    131.753     227.444     131.753     
1 1 1 11 10 22 o 8  429.737 4.18356 3282        88.1153  3265.92     92.0256  328.255    290.849     56.8642     290.849     
1 1 1 11 10 23 o 17 253.775 2.91482 1160.35     37.0688  1122.64     37.0635  135.187    142.653     72.9839     322.653     
1 1 1 11 10 24 o 11 183.485 2.54461 603.75      23.3954  589.598     23.3985  115.903    7.91676     7.48425     7.91676     
1 1 1 11 10 25 o 11 140.425 2.39543 345.908     16.8567  353.047     16.8567  62.6704    358.537     30.5035     178.537     
1 1 1 11 10 26 o 8  866.469 7.45541 13223.7     323.707  13445.2     323.739  640.153    357.625     50.3914     357.625     
1 1 1 11 10 27 o 14 286.75  3.06473 1457.94     43.1384  1457.09     44.9247  139.086    57.6582     117.534     237.658     
1 1 1 11 10 28 o 10 318.193 3.46221 1823.64     55.2076  1766.52     55.1986  196.368    229.38      47.2239     49.3798     
1 1 1 11 10 29 o 12 388.163 3.95421 2702.08     76.9183  2641.74     76.9127  279.037    47.9913     17.8282     47.9913     
1 1 1 11 10 30 o 5  356.808 3.72246 2243.21     66.5608  2271.88     66.5607  251.709    99.1025     8.45792     99.1025     
1 1 1 11 10 31 o 7  134.537 2.60756 331.052     17.56    311.259     17.5559  79.4294    259.648     16.1886     259.648     
1 1 1 11 10 32 o 6  73.6309 2.64812 93.4017     9.9469   99.3485     9.50513  11.5136    48.3685     86.134      48.3685     
1 1 1 11 10 33 o 14 374.243 3.80456 2505.94     72.9056  2462.41     69.7918  306.392    25.7051     97.1331     25.7051     
1 1 1 11 10 34 o 13 241.417 2.83289 1043.69     34.2746  1022.91     34.2696  157.188    219.374     10.4274     39.3737     
1 1 1 11 10 35 o 10 190.397 2.60346 642.435     24.3163  642.863     25.3554  147.717    316.844     56.0225     316.844     
1 1 1 11 10 36 o 12 348.374 3.57491 2139.69     62.4084  2165.68     62.415   285.784    93.5476     95.145      93.5476     
1 1 1 11 10 37 o 2  101.59  2.52811 178.408     12.4869  188.03      13.2168  27.8344    51.7009     60.6021     231.701     
1 1 1 11 10 38 o 2  406.798 4.0333  2917.84     80.443   2955.14     83.9874  321.616    170.605     82.8101     170.605     
1 1 1 11 10 39 o 4  489.202 4.67488 4208.5      112.112  4290.17     117.092  364.703    345.906     52.8449     345.906     
1 1 1 11 10 40 o 13 276.916 3.16843 1314.43     41.0636  1406.49     46.8432  175.498    39.7486     27.3513     219.749     
1 1 1 11 10 41 o 9  98.8493 2.51355 163.879     12.4384  183.33      12.3914  3.02726    95.1843     119.678     275.184     
1 1 1 11 10 42 o 10 50.0041 2.90923 50.758      6.80957  38.9314     7.42894  12.3172    351.344     61.8246     351.344     
1 1 1 11 10 43 o 6  150.568 2.41752 396.987     17.4633  406.959     19.0042  53.6394    41.2918     91.1294     221.292     
1 1 1 11 10 44 o 9  397.834 3.74457 2785.41     73.1369  2832.95     76.1656  298.916    144.132     55.4384     144.132     
1 1 1 11 10 45 o 19 281.952 2.98938 1398.97     43.0269  1421.39     41.4217  209.575    93.673      39.6443     93.673      
1 1 1 11 10 46 f 0  482.023 4.45603 4192.33     107.647  4063.58     107.615  289.168    159.572     0           0           
1 1 1 11 10 47 o 7  165.194 2.34263 479.883     19.3634  487.891     19.4232  116.715    252.064     21.6024     252.064     
1 1 1 11 10 48 o 5  415.847 3.91485 3026.11     79.9378  3115.75     83.2332  316.512    110.661     71.2353     110.661     
1 1 1 11 10 49 o 7  60.8314 2.65958 64.9133     7.78627  66.8629     8.34694  4.95237    77.3921     70.8923     77.3921     
1 1 1 11 10 50 o 2  68.9812 2.5697  79.3984     8.5737   90.0334     9.12997  18.9858    335.6       12.9598     155.6       
1 1 1 11 10 51 o 2  13.046  4.0172  -4.79429    4.32007  1.89486     5.74461  40.9116    15.7107     84.9167     15.7107     
1 1 1 11 10 52 o 5  349.355 3.54044 2143.02     60.597   2192.23     63.3668  261.701    177.188     57.1701     177.188     
1 1 1 11 10 53 o 7  166.298 2.6504  477.488     22.572   504.116     21.5525  111.359    108.239     7.59997     108.239     
1 1 1 11 10 54 o 3  342.178 3.90335 2124.81     64.928   2039.28     68.7834  260.603    86.1692     66.3505     86.1692     
1 1 1 11 10 55 o 13 225.228 2.84515 888.334     31.8608  913.074     32.3667  118.544    170.102     60.2164     350.102     
1 1 1 11 10 56 o 6  138.995 2.38071 355.109     16.792   330.851     16.3708  111.307    167.672     47.4859     167.672     
1 1 1 11 10 57 o 16 110.082 3.02522 217.796     15.7869  213.556     17.4658  80.9409    169.528     27.1551     169.528     
1 1 1 11 10 58 o 8  130.452 2.74387 297.69      17.9988  307.575     17.8305  84.3634    60.5342     2.9503      60.5342     
1 1 1 11 10 59 o 8  51.5284 3.7425  41.9964     9.45311  53.9954     9.46251  13.6776    45.2275     25.0559     225.228     
1 1 1 11 10 60 o 2  109.916 3.0797  212.594     18.3845  218.103     15.2856  71.4003    143.549     5.60237     143.549     
1 1 1 11 10 61 o 4  41.7609 4.94826 41.284      11.3204  24.0842     8.69698  8.20939    130.834     10.6909     310.834     
1 1 1 11 10 62 o 18 99.3112 3.03711 176.337     16.0931  175.727     13.9931  54.1411    115.381     15.0336     295.381     
1 1 1 11 10 63 o 9  24.6112 5.79435 15.5718     9.29152  4.60551     8.14882  32.8514    190.75      88.3505     190.75      
1 1 1 11 10 64 o 14 50.5697 4.23865 50.4512     11.0527  42.7267     10.0179  23.1257    94.8733     2.30421     274.873     
1 1 1 11 10 65 o 2  143.605 3.11673 376.686     22.5915  360.472     22.214   107.637    57.454      33.3631     57.454      
1 1 1 11 10 66 f 0  46.3955 4.42672 42.3206     9.84876  36.6818     10.1331  32.7063    54.7991     0           0           
1 1 1 11 10 67 o 11 52.653  3.84065 52.9663     9.58823  47.7701     10.3027  26.4517    12.4422     9.2629      192.442     
1 1 1 11 10 68 o 14 16.3336 4.94886 2.13737     7.102    -3.48271    7.66932  7.42971    288.316     23.8453     288.316     
1 1 1 11 10 69 o 9  19.7291 5.18314 8.83271     6.98291  0.821991    7.39018  5.06656    261.809     24.7832     261.809     
1 1 1 11 10 70 o 17 19.5327 5.13641 9.30074     7.07205  -0.411336   7.30425  0.2946     289.897     4.88534     289.897     
1 1 1 11 10 71 o 2  43.497  4.29728 33.9705     8.60886  36.0564     9.60869  22.0694    206.366     4.96007     26.3656     
1 1 1 11 10 72 f 0  112.589 2.69869 223.288     14.3922  231.374     15.9984  51.7215    113.366     0           0           
1 1 1 11 10 73 o 10 73.8426 2.85267 97.5868     10.5456  98.6776     10.4865  38.8387    140.172     12.3398     320.172     
1 1 1 11 10 74 o 6  38.2312 4.1336  29.2321     7.69102  25.231      7.61745  9.80758    295.029     24.4017     115.029     
1 1 1 11 10 75 o 6  41.5332 4.27304 27.2243     8.43686  37.5152     8.67539  23.343     285.108     0.119759    105.107     
1 1 1 11 10 76 o 7  33.3347 4.75877 23.4288     7.92465  19.1847     7.43506  19.4252    359.147     9.84627     359.147     
1 1 1 11 10 77 o 11 44.2769 4.18685 36.5846     8.85763  36.7972     9.25271  24.1896    54.8014     2.73717     234.801     
1 1 1 11 10 78 o 3  39.0104 4.26722 31.9675     8.45039  25.7448     7.69018  22.4297    101.982     1.26305     101.982     
1 1 1 11 10 79 o 17 49.1304 4.33704 46.6237     10.474   44.5332     10.4146  29.8482    141.887     3.02971     141.887     
1 1 1 11 10 80 o 11 33.2592 5.63853 17.3601     9.4387   27.1853     9.33872  15.561     232.433     4.1056      52.4329     
1 1 1 11 10 81 o 13 55.8058 4.17392 54.3796     11.3371  63.0861     11.6157  34.0311    55.4002     3.66657     55.4002     
1 1 1 11 10 82 o 16 25.0208 6.66322 6.38419     11.5566  14.6936     11.6236  6.47406    8.99786     7.31804     188.998     
1 1 1 11 10 83 o 9  66.5237 4.8743  79.4036     15.6143  90.983      16.3965  47.9728    70.7483     19.5332     70.7483     
1 1 1 11 10 84 o 14 25.1679 6.14207 24.5716     12.0673  -12.4165    12.0716  6.26347    184.536     1.7719      184.536     
1 1 1 11 10 85 o 18 27.3453 6.83809 4.2502      12.2939  22.9556     12.833   11.8269    145.639     2.74307     145.639     
1 1 1 11 10 86 o 8  33.444  7.25589 27.346      13.3289  21.6029     13.4736  16.7874    100.658     0.321304    280.658     
1 1 1 11 10 87 o 14 59.6412 6.49249 68.4606     18.6584  81.7238     18.7712  39.2273    25.8774     11.6183     25.8774     
1 1 1 11 10 88 o 19 27.8607 7.63691 20.8413     15.5381  11.1721     15.3216  9.19906    48.1406     0.633812    228.141     
1 1 1 11 10 89 o 3  30.9801 7.54153 7.89968     15.4067  34.9851     15.8025  11.6885    240.117     1.19613     60.117      
1 1 1 11 10 90 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 11 11 0  o 6  243.992 4.02364 1056.61     49.1385  1056.61     49.1385  155.76     8.54697e-06 665.847     8.54697e-06 
1 1 1 11 11 1  o 17 349.595 3.49009 2167.02     61.1178  2167.02     61.1178  181.101    30          146.315     210         
1 1 1 11 11 2  o 9  1009.4  8.63298 18075       436.558  18075       436.558  722.23     60          23.6876     240         
1 1 1 11 11 3  o 10 793.414 6.87977 11164.3     273.456  11164.3     273.456  737.5      270         321.158     270         
1 1 1 11 11 4  o 5  203.905 2.76861 737.545     28.2676  737.545     28.2676  142.817    120         38.8342     120         
1 1 1 11 11 5  o 13 486.729 4.71082 4200.86     114.858  4200.86     114.858  413.058    150         118.592     150         
1 1 1 11 11 6  f 0  82.959  2.33816 122.526     9.68554  122.526     9.68554  4.49662    180         0           0           
1 1 1 11 11 7  o 16 19.9202 5.35278 9.52734     5.02265  9.52734     5.02265  17.9371    210         36.4647     210         
1 1 1 11 11 8  f 0  842.744 7.27673 12596.8     307.218  12596.8     307.218  442.75     60          0           0           
1 1 1 11 11 9  o 4  43.9875 3.09649 35.2942     6.6591   35.2942     6.6591   43.5181    90          94.8304     90          
1 1 1 11 11 10 o 2  699.003 6.41605 8665.68     224.669  8665.68     224.669  492.868    120         28.2514     300         
1 1 1 11 11 11 o 1  213.929 2.68871 811.717     28.8048  811.717     28.8048  112.33     330         66.2203     330         
1 1 1 11 11 12 o 8  319.941 3.32064 1815.07     53.2159  1815.07     53.2159  319.115    180         179.432     180         
1 1 1 11 11 13 o 2  44.5593 3.09785 36.193      6.75332  36.193      6.75332  66.3957    30          146.649     30          
1 1 1 11 11 14 o 15 677.035 6.21899 8129.79     210.924  8129.79     210.924  541.688    60          103.858     60          
1 1 1 11 11 15 o 13 485.117 4.49744 4173.04     109.296  4173.04     109.296  357.86     270         14.428      270         
1 1 1 11 11 16 o 13 463.134 4.31826 3803.4      100.186  3803.4      100.186  478.989    120         289.044     120         
1 1 1 11 11 17 o 15 235.767 2.79766 985.825     33.0342  985.825     33.0342  173.721    150         9.58283     150         
1 1 1 11 11 18 o 17 404.367 3.89147 2899.44     78.8259  2899.44     78.8259  315.356    180         47.7498     180         
1 1 1 11 11 19 o 11 44.0078 3.27724 35.4473     7.02675  35.4473     7.02675  32.0202    30.0001     73.5451     30.0001     
1 1 1 11 11 20 o 6  1175.07 10.3361 24523       608.454  24523       608.454  862.593    60          34.6795     59.9999     
1 1 1 11 11 21 f 0  463.652 4.52354 3812.55     105.062  3812.55     105.062  488.289    270         0           0           
1 1 1 11 11 22 o 6  843.801 7.57506 12635.9     320.206  12635.9     320.206  658.142    120         105.172     120         
1 1 1 11 11 23 o 9  699.38  6.75719 8679.77     236.732  8679.77     236.732  397.065    330         208.447     150         
1 1 1 11 11 24 o 3  41.9317 3.26455 32.277      6.6483   32.277      6.6483   10.6224    8.49944e-06 25.2664     8.49944e-06 
1 1 1 11 11 25 o 7  292.147 3.13705 1513.64     45.9047  1513.64     45.9047  287.018    210         156.473     210         
1 1 1 11 11 26 o 6  142.779 2.39282 361.856     17.0995  361.856     17.0995  103.961    60          411.76      60          
1 1 1 11 11 27 o 8  114.835 2.3537  234.272     13.5194  234.272     13.5194  44.1474    90          8.80433     90          
1 1 1 11 11 28 o 13 407.511 3.9459  2945.36     80.5493  2945.36     80.5493  322.305    120         64.5366     120         
1 1 1 11 11 29 o 15 17.5076 5.47174 7.82145     5.04765  7.82145     5.04765  27.7624    150         57.3194     150         
1 1 1 11 11 30 o 14 560.394 5.05775 5571.75     141.988  5571.75     141.988  475.617    360         156.091     360         
1 1 1 11 11 31 o 2  77.1123 2.32324 105.95      8.9408   105.95      8.9408   51.929     210         206.002     210         
1 1 1 11 11 32 o 9  435.711 4.13617 3367.7      90.278   3367.7      90.278   347.353    240         78.5907     240         
1 1 1 11 11 33 o 9  248.396 2.89755 1094.48     36.0471  1094.48     36.0471  189.933    270         29.2601     270         
1 1 1 11 11 34 o 9  251.138 2.92384 1118.79     36.7757  1118.79     36.7757  159.292    120         35.2435     300         
1 1 1 11 11 35 o 3  222.071 3.02522 875.1       33.6392  875.1       33.6392  159.613    150         6.95238     150         
1 1 1 11 11 36 o 11 22.6465 5.85786 12.1281     6.13024  12.1281     6.13024  1.9499     8.68455e-06 4.20843     8.68455e-06 
1 1 1 11 11 37 o 2  86.324  2.54348 132.759     10.9597  132.759     10.9597  37.7375    210         5.87686     30          
1 1 1 11 11 38 o 17 287.252 3.13741 1463.76     45.1399  1463.76     45.1399  254.631    60          107.762     60          
1 1 1 11 11 39 o 2  25.8925 5.25282 14.4729     5.90832  14.4729     5.90832  32.1131    270         74.2545     270         
1 1 1 11 11 40 o 15 569.221 5.66239 5754.56     161.453  5754.56     161.453  419.868    300         47.5441     300         
1 1 1 11 11 41 o 6  464.042 4.60773 3822.29     107.106  3822.29     107.106  412.787    330         181.207     330         
1 1 1 11 11 42 o 11 200.925 2.61115 716.317     26.2721  716.317     26.2721  159.864    360         41.3648     360         
1 1 1 11 11 43 o 4  515.846 4.78668 4724.05     123.693  4724.05     123.693  323.628    210         65.7297     30          
1 1 1 11 11 44 o 4  19.8513 5.67621 9.72371     5.516    9.72371     5.516    46.3624    240         100.164     240         
1 1 1 11 11 45 o 14 23.4548 5.9525  12.914      6.39744  12.914      6.39744  13.6241    270         30.6318     270         
1 1 1 11 11 46 o 5  156.146 2.41487 432.793     18.8763  432.793     18.8763  76.9912    300         60.2466     120         
1 1 1 11 11 47 o 5  105.798 2.31275 198.969     12.2356  198.969     12.2356  66.7913    330         7.49976     150         
1 1 1 11 11 48 o 9  86.8803 2.47187 134.45      10.7227  134.45      10.7227  34.8944    2.52882e-06 14.9601     2.52882e-06 
1 1 1 11 11 49 o 10 331.368 3.47229 1948.73     57.6331  1948.73     57.6331  233.74     30          16.4076     30          
1 1 1 11 11 50 o 1  178.976 2.574   568.588     23.0652  568.588     23.0652  84.3813    240         74.2012     60          
1 1 1 11 11 51 o 6  363.947 3.47089 2350.9      63.2792  2350.9      63.2792  320.909    270         149.13      270         
1 1 1 11 11 52 o 7  385.907 3.6275  2643.81     70.1257  2643.81     70.1257  338.973    300         157.014     300         
1 1 1 11 11 53 o 2  31.6286 5.48433 20.662      7.52802  20.662      7.52802  4.71739    150         17.2489     150         
1 1 1 11 11 54 o 18 122.509 2.47462 266.787     15.1648  266.787     15.1648  115.759    180         67.8847     180         
1 1 1 11 11 55 o 17 566.41  5.62944 5714.79     159.721  5714.79     159.721  396.886    30          35.9353     30          
1 1 1 11 11 56 o 12 33.2761 5.96042 23.1017     8.59408  23.1017     8.59408  7.02744    60          36.2621     60          
1 1 1 11 11 57 o 11 95.2779 2.87628 161.967     13.6765  161.967     13.6765  25.8484    270         74.993      90          
1 1 1 11 11 58 o 5  28.3313 7.05756 18.7928     9.09321  18.7928     9.09321  8.24265    120         31.455      120         
1 1 1 11 11 59 o 7  81.8085 3.47772 120.196     14.1387  120.196     14.1387  41.9648    150         24.0512     330         
1 1 1 11 11 60 o 11 103.09  3.02291 189.728     15.556   189.728     15.556   88.9738    360         42.4067     360         
1 1 1 11 11 61 o 2  48.6927 5.16438 45.0446     11.7665  45.0446     11.7665  9.16529    210         2.0874      210         
1 1 1 11 11 62 o 13 182.715 3.12265 594.473     28.5552  594.473     28.5552  147.015    240         55.0334     240         
1 1 1 11 11 63 o 13 33.229  5.89197 23.0714     8.48682  23.0714     8.48682  3.16346    270         16.9408     90          
1 1 1 11 11 64 o 17 11.674  5.3295  -0.0405093  7.2638   -0.0405093  7.2638   7.71389    120         17.4258     120         
1 1 1 11 11 65 o 17 19.6961 6.78529 10.3028     7.87835  10.3028     7.87835  4.73135    330         22.8878     330         
1 1 1 11 11 66 o 12 13.4177 5.81675 2.75934     7.50582  2.75934     7.50582  4.93032    8.65198e-06 13.1158     8.65198e-06 
1 1 1 11 11 67 o 7  35.9273 5.0615  25.6651     8.09137  25.6651     8.09137  3.01758    30          52.0546     30          
1 1 1 11 11 68 o 16 102.411 2.69269 187.413     13.776   187.413     13.776   77.6595    240         24.2205     240         
1 1 1 11 11 69 o 6  23.7918 6.62388 14.0635     7.57935  14.0635     7.57935  5.16301    90          38.0747     90          
1 1 1 11 11 70 o 8  56.3627 3.51199 58.0631     9.73473  58.0631     9.73473  51.5534    120         32.9326     120         
1 1 1 11 11 71 o 12 45.7557 4.12955 39.3059     9.04785  39.3059     9.04785  34.2079    330         11.5158     330         
1 1 1 11 11 72 o 19 132.817 2.69371 315.111     17.896   315.111     17.896   83.1137    360         1.1842      180         
1 1 1 11 11 73 o 15 29.4567 6.43162 19.601      8.30798  19.601      8.30798  13.2761    30          6.76598     210         
1 1 1 11 11 74 o 10 95.9173 2.69501 164.857     12.9079  164.857     12.9079  48.5667    60          22.7954     240         
1 1 1 11 11 75 o 14 15.8148 6.17845 6.45433     7.14085  6.45433     7.14085  1.12586    90          12.5701     90          
1 1 1 11 11 76 o 9  13.2101 5.65114 3.27162     6.88228  3.27162     6.88228  7.10581    120         25.2237     120         
1 1 1 11 11 77 o 8  15.5943 6.1284  6.30476     7.07352  6.30476     7.07352  0.0906955  150         8.51089     150         
1 1 1 11 11 78 o 17 87.4865 3.69674 139.575     16.0739  139.575     16.0739  59.7187    7.45411e-07 11.8727     7.45411e-07 
1 1 1 11 11 79 o 14 18.9934 7.04751 10.0692     8.85332  10.0692     8.85332  2.93904    30          7.72263     210         
1 1 1 11 11 80 o 2  34.8971 6.53709 26.689      9.87706  26.689      9.87706  24.1442    60          8.18289     60          
1 1 1 11 11 81 o 2  127.09  3.24402 292.1       20.6     292.1       20.6     94.5443    270         34.8783     270         
1 1 1 11 11 82 o 6  41.4442 7.82866 38.51       14.0484  38.51       14.0484  22.3604    120         5.22241     300         
1 1 1 11 11 83 o 8  33.2073 9.77395 30.5008     16.2313  30.5008     16.2313  7.68181    330         24.4732     150         
1 1 1 11 11 84 o 5  56.5979 5.84123 63.1549     15.5379  63.1549     15.5379  30.858     360         6.0267      180         
1 1 1 11 11 85 o 13 12.2577 5.93242 -5.85812    11.5482  -5.85812    11.5482  0.496642   210         2.11867     210         
1 1 1 11 11 86 o 3  78.1757 4.70226 115.398     18.1035  115.398     18.1035  55.4194    240         18.1444     240         
1 1 1 11 11 87 o 5  15.5105 7.01838 3.03422     12.2447  3.03422     12.2447  0.956583   90          7.11642     90          
1 1 1 11 11 88 o 8  15.5214 7.21189 1.00018     14.1579  1.00018     14.1579  2.14192    300         10.1659     300         
1 1 1 11 11 89 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 0  0  o 2  274.271 4.30601 1334.98     59.1196  1334.98     59.1196  28.4767    180         321.708     1.06137e-05 
1 1 1 12 0  1  o 4  72.0721 2.51148 92.7117     9.02056  92.7117     9.02056  6.67277    240         16.1653     240         
1 1 1 12 0  2  o 16 642.556 5.90367 7322.85     190.033  7322.85     190.033  540.098    120         152.634     120         
1 1 1 12 0  3  o 9  338.142 3.53761 2027.58     59.9177  2027.58     59.9177  319.034    4.66118e-06 165.007     4.66118e-06 
1 1 1 12 0  4  o 11 258.405 2.98028 1184.18     38.5707  1184.18     38.5707  170.777    60          16.4328     240         
1 1 1 12 0  5  o 9  71.9155 2.2385  92.173      8.03186  92.173      8.03186  77.9597    120         188.216     120         
1 1 1 12 0  6  o 18 186.101 2.58637 614.406     24.1002  614.406     24.1002  57.7372    180         119.322     1.44266e-05 
1 1 1 12 0  7  o 13 364.935 3.75232 2361.59     68.5914  2361.59     68.5914  288.726    240         52.1007     240         
1 1 1 12 0  8  o 17 323.069 3.35683 1850.76     54.3217  1850.76     54.3217  310.127    120         182.002     120         
1 1 1 12 0  9  o 10 636.606 5.9602  7187.48     190.073  7187.48     190.073  590.564    180         264.109     180         
1 1 1 12 0  10 o 7  526.218 4.63548 4909.75     122.2    4909.75     122.2    237.125    60          283.361     240         
1 1 1 12 0  11 o 18 1006.99 8.07891 17986.7     407.581  17986.7     407.581  760.314    300         71.6749     300         
1 1 1 12 0  12 o 18 218.231 2.49697 844.533     27.2919  844.533     27.2919  91.3342    3.77248e-06 122.677     180         
1 1 1 12 0  13 o 16 194.417 2.28898 670.294     22.2876  670.294     22.2876  79.4096    60          100.827     240         
1 1 1 12 0  14 o 1  1010.43 8.02389 18107       406.187  18107       406.187  617.379    120         216.124     300         
1 1 1 12 0  15 o 3  851.346 6.88547 12852.2     293.678  12852.2     293.678  652.376    180         83.2731     180         
1 1 1 12 0  16 o 13 555.532 5.06472 5471.95     140.949  5471.95     140.949  700.146    60          617.035     60          
1 1 1 12 0  17 o 4  544.495 4.99212 5256.62     136.168  5256.62     136.168  306.195    120         167.449     300         
1 1 1 12 0  18 f 0  1572.34 13.987  43889.6     1101.74  43889.6     1101.74  1042.57    8.21643e-07 0           0           
1 1 1 12 0  19 o 7  1265.97 11.1536 28435.4     707.366  28435.4     707.366  1068.61    240         327.67      240         
1 1 1 12 0  20 o 2  240.535 2.89728 1026.07     34.9015  1026.07     34.9015  77.568     120         187.849     300         
1 1 1 12 0  21 o 18 893.612 8.05865 14162.3     360.755  14162.3     360.755  711.016    180         147.542     180         
1 1 1 12 0  22 o 17 894.276 8.10711 14183.6     363.193  14183.6     363.193  681.295    60          88.6678     60          
1 1 1 12 0  23 o 12 174.216 2.57911 538.498     22.4951  538.498     22.4951  39.0212    300         163.736     120         
1 1 1 12 0  24 o 7  503.437 4.59683 4493.62     115.931  4493.62     115.931  366.828    2.58033e-06 18.3173     2.58032e-06 
1 1 1 12 0  25 f 0  26.4118 3.21896 13.4085     3.88131  13.4085     3.88131  156.284    240         0           0           
1 1 1 12 0  26 o 14 738.778 6.19575 9677.56     229.314  9677.56     229.314  676.186    300         305.532     300         
1 1 1 12 0  27 o 17 1906.86 15.4358 64581.4     1474.61  64581.4     1474.61  1413.54    3.60193e-07 129.045     3.60193e-07 
1 1 1 12 0  28 o 8  201.096 2.50427 717.217     25.2198  717.217     25.2198  39.4823    240         22.3841     240         
1 1 1 12 0  29 o 15 1206.43 10.2695 25825.3     620.688  25825.3     620.688  868.786    300         35.8463     300         
1 1 1 12 0  30 o 3  98.9323 2.32945 174.003     11.5202  174.003     11.5202  5.49953    180         27.49       180         
1 1 1 12 0  31 o 15 669.726 5.90652 7953.81     198.17   7953.81     198.17   481.198    240         20.846      240         
1 1 1 12 0  32 o 19 1039.84 8.83374 19183.3     460.181  19183.3     460.181  706.732    300         45.8682     120         
1 1 1 12 0  33 o 3  485.357 4.68893 4177.35     114.002  4177.35     114.002  360.845    360         41.7493     360         
1 1 1 12 0  34 o 19 854.207 7.71562 12945.2     330.168  12945.2     330.168  627.455    60          60.4596     60          
1 1 1 12 0  35 o 15 269.108 3.13234 1284.36     42.2173  1284.36     42.2173  209.927    120         45.0692     120         
1 1 1 12 0  36 o 10 1004.47 8.93173 17909.7     449.449  17909.7     449.449  843.153    7.29107e-07 287.157     7.29107e-07 
1 1 1 12 0  37 o 5  432.925 4.27667 3323.88     92.7446  3323.88     92.7446  377.353    60          152.892     60          
1 1 1 12 0  38 o 4  30.3885 3.77205 17.8014     5.21548  17.8014     5.21548  8.47193    120.001     18.2443     120.001     
1 1 1 12 0  39 o 9  259.392 3.10455 1193.43     40.3306  1193.43     40.3306  126.907    180         105.255     8.66068e-06 
1 1 1 12 0  40 o 2  526.207 4.60911 4910.93     121.502  4910.93     121.502  353.81     60          19.2089     240         
1 1 1 12 0  41 o 18 12.6178 4.62063 4.11316     3.76978  4.11316     3.76978  3.06008    299.999     6.21308     299.999     
1 1 1 12 0  42 o 16 93.6995 2.39556 156.194     11.2154  156.194     11.2154  20.7634    360         54.4891     180         
1 1 1 12 0  43 o 10 296.57  3.46306 1560.28     51.4377  1560.28     51.4377  176.862    60          53.1077     240         
1 1 1 12 0  44 o 16 54.956  2.49504 54.1823     6.80572  54.1823     6.80572  7.96978    300         26.8072     300         
1 1 1 12 0  45 o 2  222.298 2.74311 876.621     30.538   876.621     30.538   194.475    180         86.0064     180         
1 1 1 12 0  46 o 13 289.88  3.27525 1490.66     47.5526  1490.66     47.5526  211.128    60          27.5253     60          
1 1 1 12 0  47 o 7  433.46  4.29157 3333.65     93.1825  3333.65     93.1825  361.062    300         133.395     300         
1 1 1 12 0  48 o 14 76.8277 2.5419  105.297     9.73773  105.297     9.73773  19.6805    3.76807e-11 46.9276     180         
1 1 1 12 0  49 o 15 111.133 2.4297  219.518     13.5025  219.518     13.5025  50.1363    240         48.7497     60          
1 1 1 12 0  50 o 3  190.804 2.58345 645.981     24.6825  645.981     24.6825  174.469    120         92.0432     120         
1 1 1 12 0  51 o 16 279.255 3.05416 1383.43     42.7189  1383.43     42.7189  248.397    360         121.593     360         
1 1 1 12 0  52 o 17 89.7409 2.65308 143.496     11.8841  143.496     11.8841  24.1234    240         9.05554     240         
1 1 1 12 0  53 o 17 38.7661 3.20911 27.7191     6.01111  27.7191     6.01111  3.96899    300         12.0325     300         
1 1 1 12 0  54 o 13 433.56  4.28112 3336.44     92.9772  3336.44     92.9772  318.422    360         59.3738     360         
1 1 1 12 0  55 o 14 97.7093 2.19973 169.725     10.7465  169.725     10.7465  59.268     240         20.8207     240         
1 1 1 12 0  56 o 2  95.6444 2.22072 162.662     10.6182  162.662     10.6182  38.7357    300         19.9854     300         
1 1 1 12 0  57 o 13 228.356 2.78127 925.29      31.8071  925.29      31.8071  172.768    360         44.1703     360         
1 1 1 12 0  58 o 8  295.05  3.56887 1545.38     52.7351  1545.38     52.7351  225        60          61.8517     60          
1 1 1 12 0  59 o 14 171.064 2.67852 519.578     22.9368  519.578     22.9368  114.224    120         4.13441     120         
1 1 1 12 0  60 o 15 269.032 3.0964  1284.68     41.7217  1284.68     41.7217  213.865    360         76.1098     360         
1 1 1 12 0  61 o 15 174.163 2.45562 538.447     21.4135  538.447     21.4135  98.419     60          30.0302     240         
1 1 1 12 0  62 o 8  32.6826 4.07528 20.634      6.05509  20.634      6.05509  19.0998    300         65.7314     300         
1 1 1 12 0  63 o 7  170.999 3.01288 519.754     25.7826  519.754     25.7826  104.188    1.93079e-06 12.8495     180         
1 1 1 12 0  64 o 12 81.8344 3.06656 119.838     12.495   119.838     12.495   63.6131    240         34.3199     240         
1 1 1 12 0  65 o 3  121.573 2.70701 263.02      16.4555  263.02      16.4555  83.2824    120         10.3962     120         
1 1 1 12 0  66 o 2  94.0263 3.011   157.916     14.1215  157.916     14.1215  48.7031    360         22.9184     180         
1 1 1 12 0  67 o 8  246.637 3.29444 1081.88     40.6864  1081.88     40.6864  150.939    60          12.6486     240         
1 1 1 12 0  68 o 2  86.7103 3.17661 134.669     13.7186  134.669     13.7186  59.0788    120         47.1207     120         
1 1 1 12 0  69 o 11 12.4059 5.47772 1.66707     6.9596   1.66707     6.9596   14.4159    180         31.2813     180         
1 1 1 12 0  70 o 1  99.8134 3.08358 178.114     15.3571  178.114     15.3571  86.8407    60          47.9718     60          
1 1 1 12 0  71 o 12 136.034 3.01175 330.002     20.4862  330.002     20.4862  74.061     300         22.7303     120         
1 1 1 12 0  72 o 7  105.644 3.22456 199.749     16.9991  199.749     16.9991  101.642    180         71.1272     180         
1 1 1 12 0  73 o 1  9.04258 4.41149 -5.06099    6.68825  -5.06099    6.68825  12.3529    60          27.3491     60          
1 1 1 12 0  74 o 18 74.6398 3.47794 100.642     12.8778  100.642     12.8778  20.6049    300         51.4142     120         
1 1 1 12 0  75 o 16 77.2006 3.48294 107.661     13.3476  107.661     13.3476  59.2278    2.75895e-06 23.0504     2.75895e-06 
1 1 1 12 0  76 o 11 13.7948 5.92837 3.28322     7.64784  3.28322     7.64784  0.506066   240         1.48127     240         
1 1 1 12 0  77 o 15 78.1858 3.46097 110.483     13.4376  110.483     13.4376  51.9235    300         8.02976     300         
1 1 1 12 0  78 o 9  69.8481 3.45012 88.4512     11.939   88.4512     11.939   58.097     360         30.9831     360         
1 1 1 12 0  79 o 5  18.0055 6.72348 8.65423     8.09796  8.65423     8.09796  0.024129   60.0002     0.916563    60.0003     
1 1 1 12 0  80 f 0  18.8158 6.83963 9.58664     8.2199   9.58664     8.2199   1.4601     120         0           0           
1 1 1 12 0  81 o 6  73.082  3.5064  97.0672     12.7041  97.0672     12.7041  59.5917    180         31.1718     180         
1 1 1 12 0  82 o 5  13.6914 5.99675 2.79196     8.17352  2.79196     8.17352  1.27519    240         6.18326     240         
1 1 1 12 0  83 o 10 10.5846 5.13961 -5.56896    8.8307   -5.56896    8.8307   3.97674    120         11.3067     120         
1 1 1 12 0  84 o 2  32.3375 7.52861 24.7987     10.8291  24.7987     10.8291  9.49864    180         19.2217     8.65668e-06 
1 1 1 12 0  85 o 16 16.0483 7.1482  3.45634     12.1313  3.45634     12.1313  0.0505483  240         1.05864     240         
1 1 1 12 0  86 o 6  12.4671 6.01184 -5.64802    11.6265  -5.64802    11.6265  12.0316    300         33.8626     300         
1 1 1 12 0  87 o 11 84.3448 4.8232  132.847     20.0705  132.847     20.0705  47.9214    3.71948e-06 2.9418      180         
1 1 1 12 0  88 o 5  69.8774 8.41369 101.442     26.9001  101.442     26.9001  52.5694    60          23.6938     60          
1 1 1 12 0  89 o 14 16.8718 8.04447 -4.78666    19.6636  -4.78666    19.6636  0.511351   120         2.50801     300         
1 1 1 12 0  90 o 7  23.1072 10.8107 4.87294     32.6821  4.87294     32.6821  3.34928    0           0.24173     180         
1 1 1 12 0  91 o 2  44.6908 18.4096 105.601     68.1343  105.601     68.1343  27.1403    240         4.07865     240         
1 1 1 12 0  92 x 6  ?       ?       ?           ?        ?           ?        23.0161    120         0           0           
1 1 1 12 0  93 x 19 ?       ?       ?           ?        ?           ?        1.37135    4.80197e-05 0           0           
1 1 1 12 0  94 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 1  0  o 15 1158.71 11.5853 23845.5     672.428  23845.5     672.428  878.154    4.07302e-06 82.7191     4.07302e-06 
1 1 1 12 1  1  o 8  243.579 3.24705 1057.57     39.6371  1045.48     39.6338  122.148    209.574     52.8597     29.5743     
1 1 1 12 1  2  o 15 607.026 6.73597 6539.69     217.351  6533.64     191.677  411.631    6.05543     33.8406     186.055     
1 1 1 12 1  3  o 5  340.193 3.78255 2022.29     64.4768  2080.52     64.4872  231.055    184.467     11.7722     184.467     
1 1 1 12 1  4  o 13 243.557 2.78924 1035.76     35.4074  1066.84     32.575   100.197    183.247     106.856     3.24682     
1 1 1 12 1  5  o 9  109.583 2.13992 207.367     12.1658  218.611     11.2675  37.9345    221.505     148.931     221.505     
1 1 1 12 1  6  o 5  645.552 5.54798 7310.03     186.164  7469.02     172.375  468.069    88.3303     23.572      88.3303     
1 1 1 12 1  7  o 2  639.395 5.49922 7217.71     176.203  7279.88     176.215  482.437    85.9628     62.3552     85.9628     
1 1 1 12 1  8  o 15 628.542 5.75576 7040.05     185.221  6970.08     177.328  435.493    15.8948     17.2272     195.895     
1 1 1 12 1  9  o 16 525.644 4.88662 4827.11     138.847  4969.51     117.369  394.844    245.443     55.9335     245.443     
1 1 1 12 1  10 o 12 600.688 5.12067 6362.5      156.954  6430.79     151.254  547.316    329.995     256.555     329.995     
1 1 1 12 1  11 o 5  1072.24 8.60195 20465.3     478.484  20335.1     445.47   698.948    139.946     136.503     319.946     
1 1 1 12 1  12 o 8  832.714 6.77063 12200.2     292.356  12393       272.199  671.761    207.416     160.125     207.416     
1 1 1 12 1  13 o 9  954.12  8.10908 16136.2     395.392  16160.4     379.91   815.377    339.904     272.432     339.904     
1 1 1 12 1  14 o 14 497.875 4.68406 4316.74     119.313  4471.05     114.257  385.388    192.761     78.6678     192.761     
1 1 1 12 1  15 o 9  152.22  2.43188 423.712     18.5436  397.657     18.5449  21.5821    292.151     117.354     112.151     
1 1 1 12 1  16 o 18 621.195 5.83424 6809.82     181.611  6871.62     181.634  410.519    288.3       55.5163     108.3       
1 1 1 12 1  17 o 7  495.497 4.7116  4336.33     119.496  4366.76     114.422  265.634    279.804     163.429     99.8037     
1 1 1 12 1  18 o 19 1891.89 16.7192 64032.6     1584.99  63325.6     1585.28  1403.42    193.472     103.607     193.472     
1 1 1 12 1  19 o 8  916.14  8.2841  15062.5     397.448  14710.6     362.802  719.286    35.2232     139.23      35.2232     
1 1 1 12 1  20 o 2  678.559 5.92265 8173.17     205.386  8151.6      197.348  502.189    186.398     48.4785     186.398     
1 1 1 12 1  21 o 12 772.384 6.58022 10641.7     259.761  10512.7     249.598  611.958    45.8099     134.218     45.8099     
1 1 1 12 1  22 o 18 549.359 4.80666 5401.05     137.364  5297.49     127.19   457.877    76.2215     151.706     76.2215     
1 1 1 12 1  23 o 6  885.668 7.38559 14081.1     340.309  13740.6     315.088  660.694    101.821     70.1748     101.821     
1 1 1 12 1  24 f 0  949.555 7.9029  16100.8     390.34   15883.8     361.423  651.538    192.284     0           0           
1 1 1 12 1  25 o 16 517.357 4.66525 4708.19     123.323  4780.2      118.498  414.48     202.565     113.426     202.565     
1 1 1 12 1  26 o 3  583.544 5.25266 6044.76     153.603  6027.78     153.613  449.587    180.203     88.194      180.203     
1 1 1 12 1  27 f 0  1082.83 9.42755 20837.8     500.312  20778.4     522.585  761.131    207.412     0           0           
1 1 1 12 1  28 o 8  718.821 6.31922 9166.4      227.629  9157.44     227.647  592.878    17.9439     185.172     17.9439     
1 1 1 12 1  29 o 4  269.375 2.95816 1327.08     39.9219  1245.38     39.9156  133.466    107.134     81.979      287.134     
1 1 1 12 1  30 o 8  473.583 4.42272 3990.92     104.961  3960.05     104.968  308.265    50.9696     30.8121     230.97      
1 1 1 12 1  31 f 0  668.118 5.97079 7971.06     195.486  7860        204.181  333.714    42.2408     0           0           
1 1 1 12 1  32 o 18 1226.01 10.3393 26683       608.191  26721.5     661.231  845.637    158.703     23.4375     338.703     
1 1 1 12 1  33 o 10 664.416 5.74948 7817.91     187.572  7839.3      195.238  430.089    207.598     60.3312     27.5976     
1 1 1 12 1  34 o 1  632.599 5.45822 7104.96     169.533  7088.55     176.464  539.085    148.441     207.381     148.441     
1 1 1 12 1  35 o 3  621.181 5.38189 6859.67     164.145  6827.1      170.847  510.118    193.408     164.893     193.408     
1 1 1 12 1  36 o 12 166.5   2.46719 505.383     20.589   477.402     20.5714  97.7356    174.044     36.4656     174.044     
1 1 1 12 1  37 o 7  494.021 4.47172 4329.01     108.475  4326.45     112.897  357.835    222.349     39.4688     222.349     
1 1 1 12 1  38 f 0  358.04  3.40591 2246.86     61.1072  2298.29     61.1105  138.288    341.78      0           0           
1 1 1 12 1  39 o 6  732.613 6.09683 9475.79     223.842  9578.69     223.835  550.153    10.501      92.0296     10.501      
1 1 1 12 1  40 o 18 236.775 2.64957 977.172     30.8529  1010.35     32.0275  61.7938    139.725     193.265     319.725     
1 1 1 12 1  41 o 12 259.87  2.94666 1191.95     38.3677  1202.39     38.3813  189.504    303.787     37.8705     303.787     
1 1 1 12 1  42 o 14 157.811 2.53571 449.009     20.0427  433.938     20.0603  65.762     215.241     65.5165     35.2409     
1 1 1 12 1  43 o 13 241.572 2.73724 1084.99     32.5448  985.274     33.6125  136.039    176.805     45.6556     356.805     
1 1 1 12 1  44 o 7  257.885 2.96888 1184.16     41.0459  1174.12     35.5149  162.487    325.787     14.1623     145.787     
1 1 1 12 1  45 o 15 197.125 2.57063 698.722     26.4753  679.073     24.2943  120.615    160.471     10.9409     340.471     
1 1 1 12 1  46 o 7  297.234 3.26994 1574.41     49.7723  1559.18     47.6291  216.672    292.997     39.1715     292.997     
1 1 1 12 1  47 o 6  193.757 2.65115 656.64      27.3602  674.607     23.9632  171.715    153.475     105.709     153.475     
1 1 1 12 1  48 o 8  316.374 3.42244 1774.32     57.6216  1776.62     50.6746  240.262    57.7491     59.1701     57.7491     
1 1 1 12 1  49 o 5  529.932 5.06524 4963.7      140.458  5014.22     128.233  350.444    44.9857     11.668      224.986     
1 1 1 12 1  50 o 19 294.275 3.40795 1529.14     51.4309  1543.43     49.0449  201.421    184.968     13.3651     184.968     
1 1 1 12 1  51 o 18 212.472 2.94319 814.993     31.3576  786.484     31.3132  149.771    273.347     24.9065     273.347     
1 1 1 12 1  52 o 13 314.532 3.71289 1790        56.8996  1721.91     60.0297  208.625    182.476     2.16975     182.476     
1 1 1 12 1  53 o 9  454.84  4.56152 3673.32     101.473  3677.06     106.42   328.927    136.946     54.7847     136.946     
1 1 1 12 1  54 o 13 343.181 3.60145 2089.69     61.9356  2090.95     61.9415  280.493    204.463     111.375     204.463     
1 1 1 12 1  55 o 1  370.178 3.90837 2459.25     74.2224  2407.05     70.7767  266.751    64.8127     47.4596     64.8127     
1 1 1 12 1  56 o 15 455.871 4.69037 3708.78     101.632  3679.07     112.36   353.822    163.656     108.741     163.656     
1 1 1 12 1  57 o 13 182.609 2.79992 614.202     24.8681  569.316     26.2769  117.36     135.025     3.6658      135.025     
1 1 1 12 1  58 o 15 244.891 3.02232 1074.56     37.9306  1053.98     36.2467  129.82     163.882     57.094      343.882     
1 1 1 12 1  59 o 4  92.4562 2.56598 153.202     12.2529  150.565     11.4722  53.8698    49.2729     9.44645     49.2729     
1 1 1 12 1  60 o 2  108.975 2.53208 219.225     14.2356  202.794     13.3875  68.0679    245.259     6.72416     245.259     
1 1 1 12 1  61 o 19 126.934 2.51983 293.873     16.49    278.507     15.5392  79.9634    255.106     3.38519     255.106     
1 1 1 12 1  62 o 13 86.2207 2.62062 141.363     11.6884  123.366     10.9058  44.089     25.349      11.9653     205.349     
1 1 1 12 1  63 o 5  163.92  2.64785 497.863     22.3375  456.835     21.1695  87.0593    186.273     33.1174     6.27311     
1 1 1 12 1  64 o 2  30.7102 4.98618 24.1791     7.62966  11.1763     7.7586   1.50112    348.125     6.66713     348.125     
1 1 1 12 1  65 o 13 137.494 2.73861 350.52      20.0393  322.257     17.6628  67.5547    293.852     36.745      113.852     
1 1 1 12 1  66 o 9  178.926 3.05179 589.852     28.9606  549.913     25.7613  110.096    211.984     4.94233     31.9837     
1 1 1 12 1  67 o 17 82.0488 3.11183 112.829     13.0461  127.875     12.3556  45.8324    202.449     3.66939     22.4491     
1 1 1 12 1  68 o 5  104.378 2.37014 208.256     13.1144  180.036     11.663   85.0564    326.992     50.4542     326.992     
1 1 1 12 1  69 o 15 151.614 3.32922 411.248     26.6809  410.07      23.7653  90.2044    220.322     7.58275     40.3223     
1 1 1 12 1  70 o 8  88.1128 3.37854 136.478     15.4641  141.766     14.2029  68.9102    263.671     36.108      263.671     
1 1 1 12 1  71 o 19 104.284 3.33658 204.016     17.9625  185.855     16.8278  71.2599    26.5397     15.1528     26.5397     
1 1 1 12 1  72 o 13 93.2688 3.4179  162.701     16.4262  149.84      15.4212  53.7733    128.272     6.07044     308.272     
1 1 1 12 1  73 o 17 80.8974 3.48413 113.861     14.4372  121.879     13.6224  48.98      178.697     0.799477    178.697     
1 1 1 12 1  74 o 8  91.8908 3.31778 149.438     15.976   154.389     14.4049  54.2833    139.067     2.60001     319.067     
1 1 1 12 1  75 o 15 40.3795 4.99424 35.5315     10.291   26.0126     9.1794   20.7173    124.531     0.294968    124.531     
1 1 1 12 1  76 o 1  88.9052 3.42441 142.644     14.9316  142.735     15.4625  43.6364    43.1749     19.8923     223.175     
1 1 1 12 1  77 f 0  83.8924 3.50411 133.573     14.3908  121.223     14.8826  48.1611    78.6467     0           0           
1 1 1 12 1  78 o 5  72.4523 3.68588 96.8783     13.0454  93.9483     13.5256  35.8866    23.8268     14.0403     203.827     
1 1 1 12 1  79 o 19 108.185 3.36929 214.423     17.988   208.898     18.4442  78.8162    240.816     28.4027     240.816     
1 1 1 12 1  80 o 8  53.9882 4.43138 51.4939     11.2701  56.869      12.2704  40.5557    15.7222     21.2587     15.7222     
1 1 1 12 1  81 o 18 21.2606 5.69086 13.1341     9.51675  -4.54829    9.06761  3.92396    19.2368     6.42408     199.237     
1 1 1 12 1  82 o 13 42.2309 6.00018 35.1922     13.3071  35.1797     11.1688  20.9093    79.5276     5.03876     259.528     
1 1 1 12 1  83 o 11 24.2371 6.41797 5.60771     11.7405  12.4297     9.87886  1.57632    212.838     28.1624     212.838     
1 1 1 12 1  84 o 14 27.0954 7.07841 21.3445     16.1788  7.02269     9.22976  4.05515    332.114     19.3531     152.114     
1 1 1 12 1  85 o 19 34.6528 7.80263 22.0929     17.5327  28.0972     13.6995  14.3765    263.542     6.51088     83.5416     
1 1 1 12 1  86 o 19 23.6731 6.77669 11.3124     12.9156  2.43493     12.4278  3.77945    349.199     11.4865     169.199     
1 1 1 12 1  87 o 10 63.9521 8.77489 90.8409     34.0748  90.0842     17.9749  33.6172    205.592     4.57455     25.592      
1 1 1 12 1  88 o 18 53.5313 9.92021 57.8476     33.3786  78.326      23.1825  23.5078    268.273     12.2635     88.2727     
1 1 1 12 1  89 o 16 25.4113 8.05676 -30.0471    30.7425  9.50391     17.3501  8.10037    96.9184     4.33574     276.918     
1 1 1 12 1  90 o 3  23.9393 8.05641 4.24004     31.5926  -17.17      16.1705  4.84947    160.896     0.373448    340.896     
1 1 1 12 1  91 o 11 36.0663 12.1065 39.8858     55.6066  2.54906     65.6531  16.6254    349.276     3.94184     349.276     
1 1 1 12 1  92 o 15 40.8455 19.2277 0           0        85.2095     71.6773  1.4948     65.3659     0.532881    65.366      
1 1 1 12 1  93 x 9  ?       ?       ?           ?        ?           ?        4.6085     107.617     0           0           
1 1 1 12 1  94 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 2  0  o 16 540.132 5.408   5173.95     146.319  5173.95     146.319  603.676    360         427.118     360         
1 1 1 12 2  1  o 6  729.343 6.89339 9528.16     245.819  9342.73     257.814  607.32     219.414     179.826     219.414     
1 1 1 12 2  2  o 12 647.687 5.92567 7548.72     188.041  7329.33     196.388  623.837    118.116     340.78      118.116     
1 1 1 12 2  3  o 13 290.732 3.26241 1515.93     47.5321  1480.14     47.528   183.177    172.019     131.255     172.019     
1 1 1 12 2  4  o 13 325.562 3.51399 1883.45     54.6552  1873.46     59.8749  272.985    220.265     142.718     220.265     
1 1 1 12 2  5  o 1  318.417 3.33344 1757.78     52.0325  1836.34     54.3584  203.543    70.7646     14.9673     250.765     
1 1 1 12 2  6  o 7  1083.18 9.36434 20902.6     508.334  20750.7     508.308  763.231    265.55      27.3689     85.5501     
1 1 1 12 2  7  o 2  1211.23 10.2384 25957.7     608.948  26140.7     633.825  923.296    276.847     108.101     276.847     
1 1 1 12 2  8  o 12 317.205 3.29903 1778.71     52.4416  1787.59     52.4438  171.445    43.8861     84.0371     223.886     
1 1 1 12 2  9  o 11 649.337 6.08626 7423.18     206.785  7528.62     188.775  431.016    210.396     58.9576     30.3958     
1 1 1 12 2  10 o 7  748.461 7.47031 9862.48     257.259  10008.8     301.687  532.284    335.375     0.303552    155.373     
1 1 1 12 2  11 o 9  798.9   7.55975 11213.6     280.375  11426.1     323.777  552.22     55.7801     34.0142     235.78      
1 1 1 12 2  12 o 11 178.699 2.58413 551.701     22.0833  580.197     24.1944  68.3052    114.809     52.5218     294.809     
1 1 1 12 2  13 o 1  1207.96 11.0954 25550.6     655.601  26260.8     687.695  866.65     3.86133     3.69308     3.86128     
1 1 1 12 2  14 o 12 691.595 6.66528 8492.17     230.997  8468.71     231.022  617.475    346.961     259.644     346.961     
1 1 1 12 2  15 o 9  312.03  3.32475 1843.42     55.7683  1611.23     48.2685  267.051    229.518     142.347     229.518     
1 1 1 12 2  16 o 12 283.675 3.14592 1475.78     47.6416  1377.08     41.7743  183.672    249.373     4.04787     69.3725     
1 1 1 12 2  17 o 14 854.862 7.17007 12850.8     318.629  13065.6     295.047  688.547    120.667     163.522     120.667     
1 1 1 12 2  18 o 4  417.728 3.86003 3051.46     83.8006  3133.67     77.5999  297.681    306.573     19.4078     306.573     
1 1 1 12 2  19 o 12 515.065 4.47509 4693.98     121.739  4709.76     108.904  369.309    133.395     18.8638     133.395     
1 1 1 12 2  20 o 3  1366.38 11.2773 33371.7     829.829  32917.5     710.76   1145.85    329.593     346.183     329.593     
1 1 1 12 2  21 o 5  528.81  4.75071 4976.08     128.391  4936.83     123.373  435.818    312.856     135.759     312.856     
1 1 1 12 2  22 o 18 525.534 4.71495 4928.44     126.641  4862.17     121.691  319.592    176.567     96.8967     356.567     
1 1 1 12 2  23 o 8  541.683 4.92045 5246.54     133.555  5155.55     133.578  461.484    352.673     170.633     352.673     
1 1 1 12 2  24 o 18 773.251 6.60977 10610.9     261.19   10592.7     250.985  560.136    112.661     31.2773     112.661     
1 1 1 12 2  25 o 13 392.503 3.69365 2772.05     72.641   2688.79     72.6539  256.301    222.655     23.5678     42.6554     
1 1 1 12 2  26 o 4  1519.37 12.3254 41160.7     938.404  40870.4     938.545  1284.37    281.325     420.817     281.325     
1 1 1 12 2  27 o 11 867.267 7.33215 13454       325.012  13227.3     312.297  814.193    37.2644     415.905     37.2644     
1 1 1 12 2  28 o 9  390.681 3.74914 2739.62     71.8903  2670.8      74.8398  317.754    160.123     115.987     160.123     
1 1 1 12 2  29 o 2  580.323 5.03289 5941.9      146.345  5998.64     146.39   396.574    88.6619     9.68575     268.662     
1 1 1 12 2  30 o 9  396.765 3.76431 2802.37     76.319   2777.9      73.3594  204.593    300.066     131.04      120.066     
1 1 1 12 2  31 o 6  433.725 4.05126 3301.28     86.2849  3367.73     89.8228  240.085    253.343     113.649     73.3427     
1 1 1 12 2  32 o 13 339.991 3.45242 2062.86     58.8226  2034.7      58.8225  217.723    6.93615     19.5145     186.936     
1 1 1 12 2  33 o 6  468.409 4.38607 3900.4      102.953  3879        102.963  336.181    228.462     31.172      228.462     
1 1 1 12 2  34 o 12 200.476 2.62342 706.553     26.3591  717.999     26.3531  26.4115    137.236     209.457     317.236     
1 1 1 12 2  35 o 19 337.735 3.37802 2068.47     57.17    1975.75     57.1559  282.67     67.8048     116.588     67.8048     
1 1 1 12 2  36 o 17 380.711 3.6628  2580.7      68.4615  2558.22     71.262   257.978    255.607     1.29715     75.6071     
1 1 1 12 2  37 o 9  640.535 5.50201 7330.55     173.021  7227.98     180.079  486.497    50.8921     89.8517     50.8921     
1 1 1 12 2  38 o 12 489.78  4.38865 4269.77     105.536  4238.79     109.842  374.1      208.891     78.1001     208.891     
1 1 1 12 2  39 o 7  559.476 4.93913 5552.45     135.681  5554.05     141.227  514.286    173.224     264.089     173.224     
1 1 1 12 2  40 f 0  496.739 4.47181 4339.32     109.076  4415.03     113.551  293.533    336.569     0           0           
1 1 1 12 2  41 o 7  172.137 2.45808 539.319     21.6756  511.292     20.737   129.485    259.667     71.4411     259.667     
1 1 1 12 2  42 o 5  436.077 4.48795 3391.67     93.0172  3356.58     102.838  301.122    216.868     10.6207     216.868     
1 1 1 12 2  43 o 9  321.711 3.47686 1875.28     56.538   1796.06     55.5686  257.7      277.676     88.2145     277.676     
1 1 1 12 2  44 o 12 329.309 3.48924 1878.84     59.0632  1968.28     55.9658  235.682    114.449     31.4783     114.449     
1 1 1 12 2  45 o 9  293.926 3.31901 1524.15     48.8802  1540.12     48.8959  201.935    336.145     12.8382     336.145     
1 1 1 12 2  46 o 17 136.083 2.35752 330.369     16.749   326.405     15.37    85.7211    317.126     10.3941     317.126     
1 1 1 12 2  47 o 18 489.792 4.719   4206.27     120.904  4313.1      110.368  345.095    230.9       28.8006     230.9       
1 1 1 12 2  48 o 16 410.764 4.07695 2989.57     87.6626  2999.57     79.9968  260.352    300.118     31.6809     120.118     
1 1 1 12 2  49 o 14 336.086 3.6228  2010.29     62.4658  1997.98     59.5427  271.939    267.517     97.1004     267.517     
1 1 1 12 2  50 o 8  154.777 2.57573 435.877     20.4963  413.809     19.4644  77.854     74.023      41.4648     254.023     
1 1 1 12 2  51 o 13 406.757 4.18689 3012.02     88.7375  2864.11     81.9507  308.791    350.473     76.3556     350.473     
1 1 1 12 2  52 o 11 159.166 2.55356 463.365     20.3598  435.319     20.362   106.454    312.46      14.3093     312.46      
1 1 1 12 2  53 o 19 131.758 2.74334 315.802     16.9072  300.609     19.1467  45.1135    252.654     74.7647     72.6536     
1 1 1 12 2  54 o 13 291.16  3.38209 1497.03     50.5114  1511.76     48.1453  202.748    59.5825     24.5457     59.5825     
1 1 1 12 2  55 o 13 125.846 2.46399 289.773     15.5411  272.48      15.4982  75.6117    113.47      1.30696     113.47      
1 1 1 12 2  56 o 11 189.037 2.79185 685.442     25.0712  584.374     27.4554  107.636    326.032     26.5137     146.032     
1 1 1 12 2  57 o 2  142.399 2.57059 360.242     18.4066  359.558     18.2517  72.7328    288.53      31.9902     108.53      
1 1 1 12 2  58 o 12 92.0183 2.85419 151.369     13.8347  149.704     12.3919  28.2687    15.4506     51.8398     195.451     
1 1 1 12 2  59 o 8  121.538 2.687   272.331     15.568   252.589     17.0177  43.7759    278.934     64.0979     98.9335     
1 1 1 12 2  60 o 3  211.876 2.82435 800.435     30.0205  793.259     29.9573  139.738    32.5483     7.58691     32.5483     
1 1 1 12 2  61 o 16 20.9257 4.90258 5.96287     6.29459  8.63323     5.80681  12.3051    209.663     29.445      209.663     
1 1 1 12 2  62 o 5  215.224 2.909   819.864     31.4024  825.734     31.3487  151.741    260.041     28.7752     260.041     
1 1 1 12 2  63 o 19 87.9308 2.63065 140.921     11.4504  134.228     11.6697  55.57      247.817     10.942      247.817     
1 1 1 12 2  64 o 18 45.6494 3.43609 40.6542     7.94186  34.4783     7.52343  7.84116    256.068     64.0518     256.068     
1 1 1 12 2  65 o 3  49.4458 3.22233 46.0961     8.11213  41.7162     7.67836  15.3135    91.8444     8.11174     271.844     
1 1 1 12 2  66 o 2  134.283 2.81086 317.092     19.7023  324.984     18.0259  79.292     352.574     8.29049     172.574     
1 1 1 12 2  67 o 8  117.562 2.80991 248.989     17.6417  243.537     15.3628  96.3827    152.201     53.0922     152.201     
1 1 1 12 2  68 o 2  119.801 2.80365 251.842     17.9335  259.866     15.5563  85.8066    51.9816     26.5317     51.9815     
1 1 1 12 2  69 o 19 107.591 2.81342 216.835     16.4238  196.435     13.8515  61.0203    116.006     9.26463     296.006     
1 1 1 12 2  70 f 0  82.4593 3.14776 120.424     13.3865  123.069     12.5051  52.5907    223.608     0           0           
1 1 1 12 2  71 o 15 25.0116 5.27031 15.0935     7.69063  7.93361     6.77484  19.7849    112.576     66.3818     112.576     
1 1 1 12 2  72 o 19 30.8029 5.56362 15.3457     8.26613  20.7068     9.03531  6.4068     4.89284     15.6343     184.893     
1 1 1 12 2  73 o 6  50.2328 4.2218  41.9958     10.4645  50.5597     10.2597  30.7241    24.5598     6.45364     24.5598     
1 1 1 12 2  74 o 9  67.2602 3.82202 72.4961     12.6093  92.2482     12.8041  34.8744    205.447     10.1356     25.4473     
1 1 1 12 2  75 o 2  33.9883 5.68543 18.0742     9.46159  26.3761     9.72727  9.98862    94.8677     3.64813     94.8677     
1 1 1 12 2  76 o 11 75.086  3.79063 94.4493     14.2506  110.663     13.9884  46.7021    127.98      4.33526     127.98      
1 1 1 12 2  77 f 0  85.9181 3.53028 140.014     14.953   127.378     15.2705  57.5569    229.228     0           0           
1 1 1 12 2  78 o 12 82.8342 3.46549 127.501     14.6989  121.128     13.9464  53.7972    139.995     9.22626     139.996     
1 1 1 12 2  79 o 16 17.7108 5.08434 -11.8254    8.4868   8.24633     8.02081  0.258994   354.47      7.81869     354.47      
1 1 1 12 2  80 o 16 117.209 3.53706 270.257     21.4061  230.048     20.0361  66.6874    222.992     7.26915     42.9917     
1 1 1 12 2  81 o 9  64.7248 4.37341 76.0013     14.5806  79.8695     13.3634  41.6317    143.98      8.01267     143.98      
1 1 1 12 2  82 o 1  16.3053 5.23392 -2.30435    9.81543  -6.12256    8.74267  0.193598   93.2521     8.26066     93.2521     
1 1 1 12 2  83 o 15 43.6681 5.35593 39.2203     11.1106  35.1308     11.444   31.6003    58.9893     21.5009     58.9893     
1 1 1 12 2  84 o 6  33.1265 6.82471 32.5081     13.6302  13.3183     11.3571  5.44907    204.87      25.0355     24.8704     
1 1 1 12 2  85 o 16 53.3536 5.71432 65.5112     16.1109  47.5019     13.5116  31.7637    223.319     4.20672     223.319     
1 1 1 12 2  86 o 18 49.431  6.99414 62.6678     17.6974  40.2246     15.8158  22.722     241.549     9.04396     61.5494     
1 1 1 12 2  87 o 1  38.0403 8.72084 22.9362     30.7985  35.1385     13.4365  11.1009    85.1877     18.419      265.188     
1 1 1 12 2  88 o 4  43.0696 11.2483 126.435     51.1933  2.82886     14.5425  26.2936    319.088     10.2175     319.088     
1 1 1 12 2  89 o 7  27.6297 8.07377 21.3867     21.0089  1.66813     15.5967  10.4235    121.918     3.22032     301.918     
1 1 1 12 2  90 o 15 24.9048 8.15173 -102.452    53.0586  8.12231     15.0362  6.80582    38.2541     0.44343     218.254     
1 1 1 12 2  91 f 0  37.0888 11.4341 22.1692     64.6294  42.7784     30.275   4.1574     304.31      0           0           
1 1 1 12 2  92 o 8  39.218  15.4457 0           0        47.9956     31.537   3.42198    351.377     1.58208     351.377     
1 1 1 12 2  93 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 3  0  o 12 25.6235 2.79631 12.4346     3.33651  12.4346     3.33651  2.72925    360         5.58928     360         
1 1 1 12 3  1  f 0  490.846 4.30721 4249.26     107.882  4291.47     103.961  351.8      288.166     0           0           
1 1 1 12 3  2  o 17 370.774 3.45999 2417.99     65.4563  2454.71     63.0814  239.666    194.456     27.9741     14.4557     
1 1 1 12 3  3  o 15 1011.12 8.3828  18125.3     424.756  18151.8     424.782  772.185    90.8708     93.7473     90.8708     
1 1 1 12 3  4  o 18 455.617 4.27657 3650.67     97.6403  3708.03     97.648   425.688    62.5678     232.297     62.5677     
1 1 1 12 3  5  o 9  638.098 6.10718 7295.61     190.538  7143.13     199.824  451.58     34.5272     2.60365     214.528     
1 1 1 12 3  6  o 19 318.216 3.9264  1859.32     64.4773  1731.13     60.77    154.344    137.323     124.248     317.323     
1 1 1 12 3  7  o 17 695.293 7.0872  8610.54     246.944  8535.56     246.945  482.516    150.004     24.8145     330.004     
1 1 1 12 3  8  o 16 587.838 6.32401 6217.9      180.645  6036.19     191.599  379.649    89.8953     73.5864     269.895     
1 1 1 12 3  9  o 17 355.334 4.02267 2271.26     69.6945  2204.41     73.4533  278.395    10.8323     80.0842     10.8323     
1 1 1 12 3  10 o 8  658.166 6.96349 7767.22     236.425  7595.53     222.865  618.569    49.8329     310.262     49.8329     
1 1 1 12 3  11 o 17 393.789 4.65693 2890.7      82.9714  2609.8      99.1164  229.555    7.29495     86.9559     187.295     
1 1 1 12 3  12 o 17 326.716 3.80591 1871.91     60.6669  1911.6      63.9482  267.359    202.935     107.337     202.935     
1 1 1 12 3  13 o 9  1383.46 12.3565 34041.1     816.682  33938.3     894.778  1051.04    162.584     117.98      162.584     
1 1 1 12 3  14 o 8  501.029 4.71802 4441.1      115.854  4457.38     121.025  401.534    283.206     104.16      283.206     
1 1 1 12 3  15 o 9  953.126 8.62332 16214       411.858  16013.8     411.917  637.268    221.288     86.4378     41.2884     
1 1 1 12 3  16 o 7  678.685 6.13917 8242.27     204.159  8089.59     213.251  428.477    199.08      105.989     19.0798     
1 1 1 12 3  17 o 12 212.688 2.64297 801.17      26.964   801.984     29.3284  134.699    322.117     57.0236     322.117     
1 1 1 12 3  18 f 0  366.332 3.61953 2372        63.6163  2384.46     69.1792  377.254    326.717     0           0           
1 1 1 12 3  19 o 13 571.232 5.21385 5808.01     142.866  5760        155.332  415.089    282.959     27.2032     282.959     
1 1 1 12 3  20 o 17 991.447 8.57841 17614.6     407.868  17260.3     443.437  759.645    202.642     110.061     202.642     
1 1 1 12 3  21 o 9  527.803 4.86439 4912.35     123.197  4963.25     133.961  355.849    160.514     28.0135     340.514     
1 1 1 12 3  22 o 11 543.272 4.94869 5240.37     128.969  5222.75     140.238  478.489    351.824     202.34      351.824     
1 1 1 12 3  23 o 16 199.382 2.58969 723.279     24.7247  685.824     26.909   74.4122    339.945     99.5783     159.945     
1 1 1 12 3  24 o 16 265.377 3.00598 1260.73     38.2449  1235.32     41.601   142.898    173.614     61.5611     353.614     
1 1 1 12 3  25 o 1  876.883 7.81667 13741.5     320.102  13537.5     365.062  595.595    39.543      45.4246     219.543     
1 1 1 12 3  26 o 3  1463.46 12.9724 38470.1     906.53   37676.3     993.276  1166.83    91.9934     263.799     91.9934     
1 1 1 12 3  27 o 17 993.962 8.70063 17339.6     404.32   17725.6     461.175  820.76     199.353     244.316     199.353     
1 1 1 12 3  28 o 19 226.091 2.77409 961.605     29.9603  851.751     32.6005  114.773    308.755     44.2187     128.755     
1 1 1 12 3  29 o 1  616.762 5.54701 6891.16     163.956  6599.79     178.275  412.677    244.767     31.8829     64.7673     
1 1 1 12 3  30 o 7  451.784 4.28954 3713.84     92.8399  3523.55     100.962  393.581    354.768     176.864     354.768     
1 1 1 12 3  31 o 18 374.147 3.63084 2478.19     65.1543  2484.17     70.8887  209.093    359.844     91.0236     179.844     
1 1 1 12 3  32 o 11 272.33  3.12289 1389.86     41.5669  1241.08     43.4438  236.573    302.514     151.892     302.514     
1 1 1 12 3  33 o 11 688.301 5.90325 8441.99     199.457  8365.7      207.668  539.045    225.202     122.409     225.202     
1 1 1 12 3  34 o 5  286.757 3.07704 1483.18     43.2681  1431.95     45.1078  184.235    140.589     13.7923     320.589     
1 1 1 12 3  35 o 6  507.241 4.5579  4539.29     108.697  4585.84     122.672  338.799    271.922     21.708      91.9219     
1 1 1 12 3  36 o 1  430.433 3.87383 3304.26     81.968   3265.47     85.1049  260.634    328.929     69.3831     148.929     
1 1 1 12 3  37 o 10 444.76  4.02254 3501.51     86.1322  3513.64     93.0599  354.957    277.148     102.52      277.148     
1 1 1 12 3  38 o 18 160.217 2.32116 453.928     17.8916  455.958     19.3566  103.083    310.447     60.6421     310.447     
1 1 1 12 3  39 o 8  117.038 2.18034 242.399     12.2592  243.471     13.2767  20.1705    341.858     98.2017     161.858     
1 1 1 12 3  40 o 11 383.835 3.64155 2595.26     68.6257  2630.02     71.4568  296.884    125.35      74.1889     125.35      
1 1 1 12 3  41 o 2  207.876 2.67301 763.833     26.6599  768.218     28.9902  149.538    128.667     34.6231     128.667     
1 1 1 12 3  42 o 8  492.541 4.70916 4358.98     110.79   4252.36     121.301  372.685    34.8008     75.3196     34.8008     
1 1 1 12 3  43 o 5  369.168 3.51769 2415.48     62.8099  2418.69     67.2743  293.868    182.09      92.1586     182.09      
1 1 1 12 3  44 o 6  267.38  2.86619 1237.44     37.6039  1298.07     39.2125  144.05     187.999     68.651      7.99903     
1 1 1 12 3  45 o 8  185.306 2.56412 586.419     23.7937  631.518     23.8054  80.8219    116.14      80.5372     296.14      
1 1 1 12 3  46 o 6  115.234 2.43313 234.689     14.0333  236.548     14.037   68.5442    197.097     7.02838     197.097     
1 1 1 12 3  47 o 8  321.009 3.44494 1799.97     55.4132  1856.19     55.4152  223.555    47.6086     16.9348     47.6087     
1 1 1 12 3  48 o 15 196.49  2.54696 673.145     25.5678  696.017     24.5592  119.643    172.313     17.3745     352.313     
1 1 1 12 3  49 o 1  417.062 4.01414 3041.46     83.8877  3133.79     83.8952  262.603    55.2407     34.5916     235.241     
1 1 1 12 3  50 o 13 298.914 3.41664 1568.63     52.3957  1602.02     49.9043  165.486    345.382     66.5524     165.382     
1 1 1 12 3  51 o 5  145.585 2.35309 370.627     17.5225  380.99      16.7928  50.1492    122.686     85.5884     302.686     
1 1 1 12 3  52 o 10 318.637 3.33115 1820.3      54.3703  1782.78     52.0088  224.013    101.206     27.1499     101.206     
1 1 1 12 3  53 o 7  48.8918 3.12073 44.8041     8.08433  40.7495     7.04413  13.2651    163.342     59.8037     163.342     
1 1 1 12 3  54 o 3  355.59  3.80551 2286.21     66.4443  2204        69.0927  241.144    215.561     13.4119     215.561     
1 1 1 12 3  55 o 3  169.99  2.81273 511.283     25.0156  513.907     22.8527  114.611    196.478     15.294      196.478     
1 1 1 12 3  56 o 5  126.388 2.60609 278.621     16.8721  288.568     16.0779  81.4711    220.177     12.3944     220.177     
1 1 1 12 3  57 o 17 217.732 2.95488 828.981     30.5775  853.608     33.8653  197.477    232.9       120.739     232.9       
1 1 1 12 3  58 o 5  252.387 3.55425 1127.46     47.6543  1135.42     42.059   222.243    314.281     120.79      314.281     
1 1 1 12 3  59 o 3  124.714 2.75313 278.686     15.8801  273.932     18.376   53.967     176.398     48.3464     356.398     
1 1 1 12 3  60 o 15 252.536 3.1309  1124.39     38.6493  1141        40.5864  176.122    310.503     26.0984     310.503     
1 1 1 12 3  61 o 7  86.985  2.79275 138.053     11.6124  131.257     12.6184  32.6149    221.596     39.2035     41.5956     
1 1 1 12 3  62 o 19 168.048 2.76127 511.848     23.4333  491.409     23.0739  100.255    100.494     12.7576     280.494     
1 1 1 12 3  63 o 5  222.944 3.15043 886.306     34.4037  881.33      35.9713  163.53     2.56184     42.7202     2.56184     
1 1 1 12 3  64 o 3  129.918 2.78463 288.473     18.7172  312.325     17.4011  66.7133    165.503     29.0263     345.503     
1 1 1 12 3  65 o 18 93.7155 2.91504 150.99      14.1922  162.17      13.0399  43.3831    104.783     27.1639     284.783     
1 1 1 12 3  66 o 4  83.1614 2.92214 114.533     12.4481  132.589     11.7128  33.112     357.053     33.5587     177.053     
1 1 1 12 3  67 o 3  128.256 2.81373 292.774     19.197   293.491     16.8473  64.6971    257.102     29.8411     77.1023     
1 1 1 12 3  68 o 8  88.9252 2.91597 135.377     13.4299  147.141     12.4053  46.9383    244.789     12.4881     64.7889     
1 1 1 12 3  69 o 4  259.453 3.57526 1189.11     47.6752  1218.82     45.2281  174.533    33.7488     22.1515     33.7488     
1 1 1 12 3  70 o 1  17.387  4.86359 4.42471     6.99193  1.8622      5.56198  3.32012    219.595     10.6942     219.595     
1 1 1 12 3  71 o 3  29.5986 4.99557 11.3896     7.93101  21.5146     7.03778  6.82621    178.259     8.96228     358.259     
1 1 1 12 3  72 o 6  19.8925 4.97462 9.84407     7.29132  2.89809     5.34397  6.20195    163.672     26.7754     163.672     
1 1 1 12 3  73 o 10 25.1952 5.20368 12.3745     7.72508  11.3019     6.25064  1.76089    206.754     16.5138     26.7544     
1 1 1 12 3  74 o 1  94.9111 3.09275 163.114     14.6081  160.667     14.7316  61.5192    147.478     8.0016      147.478     
1 1 1 12 3  75 o 4  57.2359 3.50907 72.6265     11.0248  47.5782     8.89966  39.6817    168.694     14.6416     168.694     
1 1 1 12 3  76 o 1  92.8125 2.80747 175.102     14.1556  135.462     11.93    46.0536    293.677     20.2149     113.677     
1 1 1 12 3  77 o 16 120.871 3.15005 266.728     19.5468  259.56      18.5471  81.0148    74.409      15.6691     74.4089     
1 1 1 12 3  78 o 15 72.3994 4.04078 83.0844     14.7528  109.589     13.9419  50.4294    328.045     15.8668     328.045     
1 1 1 12 3  79 o 12 73.312  3.7614  97.3311     13.4146  98.9842     14.0328  31.021     349.104     25.3432     169.104     
1 1 1 12 3  80 o 8  70.8687 3.85007 89.8618     13.2848  94.5113     13.8549  42.6559    15.2646     1.75026     15.2647     
1 1 1 12 3  81 o 15 51.973  5.13453 45.3011     13.7939  58.0042     11.5216  24.175     304.299     11.7148     124.299     
1 1 1 12 3  82 o 15 61.9593 4.48258 73.7618     14.9904  70.4288     12.3466  46.5535    191.123     22.4559     191.123     
1 1 1 12 3  83 o 5  38.499  6.87565 30.5793     15.3664  30.6473     11.3166  14.6751    33.6929     12.8859     213.693     
1 1 1 12 3  84 o 2  50.2762 6.69434 54.6979     19.2078  48.6344     13.0276  34.8039    52.7629     15.3256     52.7629     
1 1 1 12 3  85 o 2  45.8778 6.55435 48.4057     16.9909  38.2678     12.109   24.8096    337.783     0.150943    157.782     
1 1 1 12 3  86 o 12 83.5368 9.46478 210.057     54.1412  115.27      17.9567  53.0462    37.8763     10.6279     37.8763     
1 1 1 12 3  87 o 15 27.0341 7.71567 5.15362     21.6174  13.4711     12.3123  6.49224    96.8854     1.65491     96.8854     
1 1 1 12 3  88 o 7  28.3023 7.66651 17.8425     15.3644  11.1173     15.2722  11.2484    81.2889     3.5446      81.2889     
1 1 1 12 3  89 o 8  33.3214 7.97068 12.4136     16.3778  35.0859     17.0995  17.528     280.731     4.52897     280.731     
1 1 1 12 3  90 o 8  33.5879 8.82615 35.669      21.6544  16.4771     18.5789  10.9052    183.659     12.295      3.6588      
1 1 1 12 3  91 o 11 27.5611 8.2531  13.0119     21.5785  12.3318     17.8938  5.22896    318.968     0.689023    318.968     
1 1 1 12 3  92 o 14 30.5038 13.6738 0           0        17.47       30.5623  1.79939    273.549     0.29175     93.5495     
1 1 1 12 3  93 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 4  0  o 14 32.2349 3.22221 19.4843     4.90586  19.4843     4.90586  110.473    180         230.285     180         
1 1 1 12 4  1  o 17 611.074 5.8743  6617.05     184.121  6622.85     175.556  339.023    19.045      193.041     199.045     
1 1 1 12 4  2  o 8  710.375 7.09238 9103.2      252.462  8795.32     252.457  585.459    288.962     159.463     288.962     
1 1 1 12 4  3  o 3  81.523  2.52588 114.72      9.72133  121.311     10.8613  70.2458    310.449     197.095     310.449     
1 1 1 12 4  4  o 18 533.614 5.63732 5039.52     142.136  5055.94     158.924  509.894    197.224     277.851     197.224     
1 1 1 12 4  5  o 16 578.366 6.29268 5879.5      165.631  5981.92     197.977  464.249    204.369     111.587     204.369     
1 1 1 12 4  6  o 18 964.561 9.89299 16698.6     492.211  16322.6     464.065  751.169    38.7013     118.782     38.7013     
1 1 1 12 4  7  o 3  1462.11 14.8231 38459.8     1053.21  37557.8     1117.2   1225.76    297.506     346.529     297.506     
1 1 1 12 4  8  o 8  591.805 6.1715  6208.09     172.552  6210.15     192.948  540.788    335.344     249.71      335.344     
1 1 1 12 4  9  o 12 922.404 9.20978 15229.9     425.697  14959.8     425.731  704.969    229.333     88.9386     229.333     
1 1 1 12 4  10 o 4  309.833 3.7445  1666.16     61.1896  1736.65     54.7624  247.147    144.658     90.5829     144.658     
1 1 1 12 4  11 o 9  544.053 5.63269 5288.82     140.843  5205.17     165.14   408.316    319.207     49.9561     319.207     
1 1 1 12 4  12 o 5  935.846 8.51049 15872.9     380.129  15199.6     416.384  768.127    10.1709     198.6       10.1709     
1 1 1 12 4  13 o 7  337.777 3.51783 2071.03     58.1996  1973.32     60.7793  288.376    359.937     131.216     359.937     
1 1 1 12 4  14 o 16 660.696 6.01627 7817.65     194.778  7659.74     203.424  683.245    1.53281     440.943     1.53281     
1 1 1 12 4  15 o 13 398.037 3.93879 2853.81     76.8078  2762.16     80.2204  182.331    60.2402     191.654     240.24      
1 1 1 12 4  16 o 18 596.829 5.50126 6374.49     160.89   6254.24     168.034  416.492    324.727     10.7997     144.727     
1 1 1 12 4  17 o 9  212.56  2.67014 798.769     27.2321  802.48      29.6096  119.101    348.028     23.2712     168.028     
1 1 1 12 4  18 o 10 1379.76 11.4849 33897.1     777.992  33709.2     809.851  1071.13    127.665     169.895     127.665     
1 1 1 12 4  19 o 16 627.678 5.60832 6988.66     176.402  6979.81     176.423  485.239    46.0789     84.9103     46.0789     
1 1 1 12 4  20 o 10 591.042 5.12718 6235.66     145.859  6148.91     157.557  383.212    352.518     66.9314     172.518     
1 1 1 12 4  21 o 17 437.683 3.99689 3447.53     84.1665  3343.11     90.9205  150.585    250.104     311.985     70.1042     
1 1 1 12 4  22 o 6  567.8   4.96131 5777.45     135.565  5652.33     146.44   356.557    331.501     84.0782     151.501     
1 1 1 12 4  23 o 12 990.608 8.32921 17455       405.102  17363.1     421.668  648.616    351.501     107.228     171.501     
1 1 1 12 4  24 o 18 327.838 3.32943 1890.48     51.3134  1918.97     57.9337  107.336    30.9677     233.59      210.968     
1 1 1 12 4  25 o 19 821.677 6.87002 11941.2     271.78   12006.4     293.636  586.872    168.078     16.5067     168.078     
1 1 1 12 4  26 o 18 562.254 4.9068  5603.26     132.814  5604.85     143.497  405.553    233.371     30.3664     233.371     
1 1 1 12 4  27 o 12 439.476 4.02657 3443.02     85.1638  3403.61     92.0235  361.04     87.0771     127.412     87.0771     
1 1 1 12 4  28 o 12 218.199 2.64994 844.611     28.3563  842.819     29.583   84.9452    145.202     105.17      325.202     
1 1 1 12 4  29 o 4  438.321 4.02143 3404.52     84.8451  3406.5      91.6942  411.448    137.804     235.779     137.804     
1 1 1 12 4  30 o 1  519.855 4.69854 4784.53     114.8    4798.02     129.586  297.392    207.747     126.866     27.7474     
1 1 1 12 4  31 o 4  320.275 3.27803 1834.93     49.2831  1801.26     55.686   131.444    191.012     173.106     11.0118     
1 1 1 12 4  32 o 13 619.773 5.54055 6852.06     164.681  6773.93     179.101  442.535    20.3735     23.1148     20.3735     
1 1 1 12 4  33 o 13 514.027 4.60335 4663.84     111.227  4706.67     125.566  355.412    43.2783     0.390004    223.278     
1 1 1 12 4  34 o 6  518.88  4.78655 4819.81     119.081  4729.99     129.523  338.506    180.229     40.9873     0.228679    
1 1 1 12 4  35 o 11 622.02  5.31208 6714.41     155.454  7015.07     175.493  467.011    139.162     72.1365     139.162     
1 1 1 12 4  36 o 13 296.571 3.13242 1573.82     43.5928  1544.5      49.2865  199.947    176.692     0.946401    176.692     
1 1 1 12 4  37 o 12 88.4666 2.28746 131.312     9.37068  146.683     10.8816  8.1789     329.444     57.2068     149.444     
1 1 1 12 4  38 o 16 383.743 3.67155 2559.51     66.2478  2663.45     74.8547  274.915    228.601     26.7154     228.602     
1 1 1 12 4  39 o 18 179.656 2.48421 555.003     21.3486  589.459     23.3834  90.1098    238.788     50.3697     58.7878     
1 1 1 12 4  40 o 15 237.021 2.87847 1009.43     33.3803  982.575     34.9571  129.168    305.017     56.1212     125.017     
1 1 1 12 4  41 o 9  397.437 4.02405 2817.12     70.8061  2787.09     88.4179  259.026    77.322      22.1486     257.322     
1 1 1 12 4  42 o 10 475.18  4.73083 3965.44     104.337  4050.45     120.551  413.199    143.402     181.81      143.402     
1 1 1 12 4  43 o 19 350.046 3.60332 2129.61     58.9686  2217.62     67.3246  261.025    5.99413     50.7757     5.99413     
1 1 1 12 4  44 o 12 183.411 2.55512 571.155     22.8939  622.131     24.0802  87.5259    19.134      64.3364     199.134     
1 1 1 12 4  45 o 14 153.546 2.41413 403.332     18.129   432.842     19.0271  69.6931    258.878     58.39       78.8776     
1 1 1 12 4  46 o 8  75.1036 2.31864 89.3337     7.80518  111.655     9.63309  18.4058    102.402     4.39378     282.402     
1 1 1 12 4  47 o 4  296.007 3.22231 1530.73     46.7179  1577.77     48.8824  210.996    259.177     26.3641     259.177     
1 1 1 12 4  48 f 0  273.906 3.0029  1329.21     42.9031  1332.03     39.4598  163.823    158.843     0           0           
1 1 1 12 4  49 o 19 149.123 2.37919 397.273     18.1971  391.282     17.3588  81.9808    0.382464    24.9666     180.382     
1 1 1 12 4  50 o 6  275.869 3.16738 1353.41     45.739   1346.76     41.7573  181.375    159.389     2.4458      339.389     
1 1 1 12 4  51 o 3  183.279 2.46073 594.578     23.0537  596.697     22.1385  96.504     350.771     44.3081     170.771     
1 1 1 12 4  52 o 3  227.1   2.69539 901.66      31.2851  927.821     30.0315  143.087    110.876     10.2363     290.876     
1 1 1 12 4  53 o 18 334.508 3.35037 1963.75     56.1726  2007.75     56.1503  201.5      172.203     39.6013     352.203     
1 1 1 12 4  54 f 0  395.729 4.22542 2779.58     87.8334  2784.26     79.5465  238.077    99.8        0           0           
1 1 1 12 4  55 o 12 92.862  2.55113 164.562     12.299   142.196     11.4012  32.1244    328.736     43.0165     148.736     
1 1 1 12 4  56 o 3  247.24  2.87617 1102.47     37.2986  1066.86     33.9428  184.812    214.259     49.509      214.259     
1 1 1 12 4  57 o 1  93.1496 2.78829 151.88      12.8146  156.615     13.1593  33.6903    354.96      42.9504     174.96      
1 1 1 12 4  58 o 17 125.719 3.05029 274.369     21.9267  287.552     15.7915  78.9723    166.84      3.06414     166.84      
1 1 1 12 4  59 o 8  87.5154 3.035   130.98      13.1565  141.771     13.3757  32.3137    5.20587     40.7266     185.206     
1 1 1 12 4  60 o 1  215.096 3.1866  830.077     32.4866  813.977     36.0795  132.902    38.9228     11.5033     218.923     
1 1 1 12 4  61 o 10 42.2124 4.14138 31.3178     8.33118  33.3679     8.72061  2.95555    285.196     15.8853     105.196     
1 1 1 12 4  62 o 7  64.3787 3.27237 74.1701     10.3869  73.9945     10.5861  30.1643    191.422     4.58466     11.4222     
1 1 1 12 4  63 o 16 50.1491 3.8922  45.6473     9.86434  45.0594     9.3738   7.06591    163.507     37.4199     343.507     
1 1 1 12 4  64 f 0  111.827 2.86005 214.548     16.4115  230.937     15.5291  57.3206    247.504     0           0           
1 1 1 12 4  65 o 2  28.6766 4.97055 20.4705     7.6017   10.5045     6.85699  1.30088    128.547     6.52319     128.547     
1 1 1 12 4  66 o 4  76.0592 2.94818 111.088     11.6171  95.8389     10.772   39.3942    83.1812     9.41133     263.181     
1 1 1 12 4  67 o 19 113.128 2.60809 224.253     15.2671  231.751     14.2258  92.2307    99.2067     50.2673     99.2067     
1 1 1 12 4  68 o 3  86.5894 2.75219 137.831     12.3928  129.874     11.4327  57.0357    267.214     11.5796     267.214     
1 1 1 12 4  69 o 13 106.287 2.71788 206.723     15.1538  196.501     13.7458  60.5643    217.366     10.1185     37.3655     
1 1 1 12 4  70 o 4  103.025 2.85215 190.358     14.9715  189.022     14.4194  82.7699    247.312     39.8049     247.312     
1 1 1 12 4  71 o 13 113.144 2.7714  229.314     16.0726  228.324     15.3001  74.1381    89.2938     8.60128     89.2938     
1 1 1 12 4  72 o 19 68.9929 3.16504 86.3649     11.2753  84.8795     10.4837  51.6291    227.648     22.8764     227.648     
1 1 1 12 4  73 o 17 85.2502 2.99824 136.572     13.3114  124.58      12.2331  58.3065    336.146     13.7942     336.146     
1 1 1 12 4  74 o 19 46.2848 3.93748 46.6914     9.45544  32.4722     8.3614   29.9311    38.2727     11.4115     38.2727     
1 1 1 12 4  75 o 15 24.9064 5.55599 9.69619     9.12214  12.5142     6.69885  2.27565    277.651     16.8774     97.6511     
1 1 1 12 4  76 o 9  53.3149 3.68473 57.3491     10.4711  46.6101     8.98651  35.3746    45.6384     10.7477     45.6383     
1 1 1 12 4  77 o 8  88.1159 3.31491 140.135     15.913   140.57      13.1019  58.2021    301.093     10.8311     301.093     
1 1 1 12 4  78 o 4  115.057 3.17941 239.144     19.7521  238.85      16.7053  84.0449    114.658     29.3742     114.658     
1 1 1 12 4  79 f 0  41.6124 5.75675 26.5198     13.1176  40.7798     9.517    38.6557    112.886     0           0           
1 1 1 12 4  80 o 15 30.4366 6.64962 12.489      13.963   21.9045     9.69678  12.2712    185.798     6.23986     5.79825     
1 1 1 12 4  81 o 9  37.3776 6.13387 24.2985     12.1265  31.4968     10.529   12.0711    200.629     17.6835     20.6288     
1 1 1 12 4  82 o 15 65.4645 4.28329 71.08       14.3703  89.7528     12.9787  42.6961    347.728     9.43332     347.728     
1 1 1 12 4  83 o 3  23.1146 6.36616 -0.185763   12.246   12.5809     10.3645  5.11604    128.114     9.06339     308.114     
1 1 1 12 4  84 o 10 19.0972 5.72794 -4.97981    9.51389  6.63135     10.211   1.20929    56.099      8.06682     236.099     
1 1 1 12 4  85 o 13 57.2599 4.88069 62.868      13.2896  63.2028     14.1386  29.4707    180.263     5.86865     0.263032    
1 1 1 12 4  86 o 11 49.4575 6.73234 59.1183     17.1064  42.5323     15.0934  23.3036    223.44      8.35435     43.4396     
1 1 1 12 4  87 o 2  65.2917 5.89756 78.8646     19.6474  90.2674     17.6649  44.837     270.276     16.0666     270.276     
1 1 1 12 4  88 o 1  18.8838 6.00009 -20.0524    14.226   4.14484     11.7162  0.844476   62.5231     0.978648    242.523     
1 1 1 12 4  89 f 0  29.7385 7.73197 28.7497     16.1059  2.45268     17.3256  14.4708    222.531     0           0           
1 1 1 12 4  90 o 4  20.8709 6.87639 1.48697     19.1716  -16.987     15.7248  2.77263    72.813      5.62614     252.813     
1 1 1 12 4  91 o 11 32.1869 8.88884 25.4957     22.1992  24.4629     19.3647  12.1963    207.714     3.82456     27.714      
1 1 1 12 4  92 o 11 31.4259 11.1667 81.4383     122.63   -3.81042    30.3711  8.70314    319.477     1.47067     139.477     
1 1 1 12 4  93 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 5  0  o 7  445.293 5.6781  3517.53     126.617  3517.53     126.617  469.563    2.83753e-06 294.58      2.83753e-06 
1 1 1 12 5  1  o 2  698.401 8.0457  8586.27     281.575  8715.58     281.609  611.74     70.8927     229.405     70.8927     
1 1 1 12 5  2  o 10 383.314 4.54426 2553        81.7344  2655.76     92.6974  316.258    136.497     109.872     136.497     
1 1 1 12 5  3  o 18 668.622 7.22357 7966.03     242.041  7888.56     242.041  395.115    185.969     166.08      5.96868     
1 1 1 12 5  4  o 8  546.822 5.31742 5334.22     142.182  5266.32     149.119  361.368    127.184     53.0437     307.184     
1 1 1 12 5  5  o 7  225.077 2.9227  916.684     33.7589  878.923     32.1779  148.017    141.758     72.3409     141.758     
1 1 1 12 5  6  o 12 246.763 3.06817 1075.08     35.1307  1083        40.5769  133.452    66.6073     54.3114     246.607     
1 1 1 12 5  7  o 7  1050.96 9.03466 19385.7     455.746  19803.3     495.48   730.219    93.2857     51.1386     273.286     
1 1 1 12 5  8  o 1  950.057 8.19353 15840.4     373.626  16177.7     406.211  634.386    79.0014     95.8546     259.001     
1 1 1 12 5  9  o 12 564.405 5.34705 5519.01     144.309  5775.58     158.11   458.988    111.76      120.986     111.76      
1 1 1 12 5  10 o 17 791.178 7.54744 10874.6     299.163  11328.5     299.245  549.368    226.711     33.1824     46.711      
1 1 1 12 5  11 o 10 216.921 2.93983 832.482     31.9476  835.17      31.969   138.84     135.376     23.9891     135.376     
1 1 1 12 5  12 o 15 415.213 4.29246 3036.42     82.7136  3074.61     95.5378  335.233    199.534     96.9537     199.534     
1 1 1 12 5  13 o 7  838.368 7.76704 12438.7     318.442  12491.4     334.053  613.66     97.5964     29.0669     97.5963     
1 1 1 12 5  14 o 19 213.498 2.79701 796.808     28.5397  818.691     31.2824  25.9231    227.685     340.616     227.685     
1 1 1 12 5  15 o 11 366.408 3.80658 2379.5      66.6355  2379.08     73.0129  166.648    188.816     177.456     8.81598     
1 1 1 12 5  16 o 11 532.581 5.18267 5083.53     124.989  4972.43     150.214  334.833    119.557     82.8175     299.557     
1 1 1 12 5  17 o 3  1203.86 10.3028 26055.7     594.79   25395.3     646.527  793.385    338.159     136.567     158.159     
1 1 1 12 5  18 o 5  928.052 8.0511  15486.8     358.301  15068.9     389.459  701.204    225.965     79.6663     225.965     
1 1 1 12 5  19 o 2  369.81  3.82272 2476.84     70.8461  2371.18     70.8199  332.821    310.905     172.616     310.905     
1 1 1 12 5  20 o 17 647.973 5.78963 7522.01     179.926  7365.78     195.576  373.861    211.51      169.302     31.51       
1 1 1 12 5  21 o 18 957.693 8.1536  16399.2     366.92   16142.3     413.918  692.735    36.8497     24.6721     36.8497     
1 1 1 12 5  22 o 9  1146.55 9.68856 23632.9     521.808  23036.7     588.625  877.193    185.211     124.593     185.211     
1 1 1 12 5  23 o 4  409.974 3.90234 3024.11     75.1419  2934.1      84.7611  313.575    45.7691     68.7033     45.7691     
1 1 1 12 5  24 o 12 506.349 4.41244 4557.99     109.854  4531.2      114.028  284.285    194.321     137.383     14.3206     
1 1 1 12 5  25 o 13 504.809 4.39141 4545.92     108.992  4488.29     113.128  408.492    170.688     122.28      170.688     
1 1 1 12 5  26 o 7  183.865 2.40489 615.281     21.7098  583.062     22.5654  44.31      91.8955     134.298     271.896     
1 1 1 12 5  27 o 7  908.9   7.39124 14771.5     330.286  14542.8     342.807  746.809    73.7584     214.782     73.7584     
1 1 1 12 5  28 o 2  369.68  3.55247 2441.13     65.802   2403.41     65.8224  266.698    335.599     32.8943     335.599     
1 1 1 12 5  29 o 7  362     3.42188 2331.75     60.8976  2313.56     63.2256  139.334    30.5714     219.742     210.571     
1 1 1 12 5  30 o 7  562.898 4.77003 5592.23     132.028  5644.15     137.063  411.761    44.7034     40.3917     44.7034     
1 1 1 12 5  31 o 17 364.775 3.44199 2370.47     61.72    2346.7      64.0867  252.465    310.776     6.6968      310.776     
1 1 1 12 5  32 o 1  723.886 5.96616 9335.9      212.346  9258.56     220.409  465.836    246.5       80.5525     66.5002     
1 1 1 12 5  33 o 10 430.41  3.95487 3340.68     81.8677  3228.74     88.4821  292.523    346.661     8.32727     166.661     
1 1 1 12 5  34 o 19 322.439 3.34019 1853.44     51.6291  1832.66     56.1938  219.665    342.074     1.78944     342.074     
1 1 1 12 5  35 o 16 92.3432 2.2957  162.42      10.0416  140.601     11.0344  9.43876    177.335     59.4979     357.335     
1 1 1 12 5  36 o 17 282.983 2.94687 1410.98     40.1203  1428.1      43.4152  259.138    222.46      147.401     222.46      
1 1 1 12 5  37 o 7  650.878 5.63875 7555.37     180.168  7485.65     187.571  516.956    5.54805     133.164     5.54805     
1 1 1 12 5  38 o 19 257.971 2.78031 1161.39     34.4982  1198.18     37.3703  188.787    333.974     35.4395     333.974     
1 1 1 12 5  39 o 17 51.328  2.69159 45.3011     6.74422  48.6483     7.00432  37.7555    273.368     107.442     273.368     
1 1 1 12 5  40 o 3  317.051 3.24374 1770.13     48.3135  1794.86     54.6129  178.687    212.251     72.0197     32.2508     
1 1 1 12 5  41 o 19 541.223 4.89277 5160.18     127.057  5240.02     138.2    384.771    312.292     28.0581     312.292     
1 1 1 12 5  42 o 6  431.425 4.00683 3277.68     84.848   3326.99     88.3978  319.781    4.40159     52.4276     4.40159     
1 1 1 12 5  43 o 13 120.475 2.29435 260.759     13.9924  254.2       13.6871  37.5325    316.91      73.3464     136.91      
1 1 1 12 5  44 o 3  159.196 2.39186 425.513     19.3144  473.681     18.7761  122.021    162.817     47.4267     162.817     
1 1 1 12 5  45 o 14 366.041 3.49055 2291.46     60.0714  2463.87     67.968   231.48     99.5392     33.1406     279.539     
1 1 1 12 5  46 o 4  191.229 2.44259 626.165     22.463   670.888     24.3591  159.679    348.668     74.3506     348.668     
1 1 1 12 5  47 o 8  120.378 2.19565 247.3       12.6709  267.007     13.8028  82.0357    227.343     27.5584     227.343     
1 1 1 12 5  48 o 4  334.418 3.34758 1952.49     54.2773  2016.02     57.9157  224.875    342.227     1.45488     342.227     
1 1 1 12 5  49 o 18 445.876 4.3954  3490.52     95.809   3571.4      100.605  331.208    133.246     63.2771     133.246     
1 1 1 12 5  50 o 17 152.676 2.46792 417.153     17.9354  409.527     19.7671  107.909    59.4605     26.347      59.4605     
1 1 1 12 5  51 o 14 34.1658 4.05946 17.9666     6.78565  24.8682     6.48197  42.602     276.436     108.363     276.436     
1 1 1 12 5  52 o 8  43.6059 3.57886 30.2522     7.20245  38.3983     8.1463   21.6541    115.5       73.1376     115.5       
1 1 1 12 5  53 o 5  261.235 3.21826 1191.99     40.9191  1230.1      43.3404  174.6      294.829     6.44809     294.829     
1 1 1 12 5  54 o 11 158.197 2.994   450.849     23.5189  437.903     23.8998  90.5978    35.0661     19.464      215.066     
1 1 1 12 5  55 o 2  147.38  2.80875 393.497     19.9756  377.861     21.415   45.8309    127.811     96.9034     307.811     
1 1 1 12 5  56 o 11 309.968 3.60823 1718.32     56.139   1694.65     55.959   199.272    8.29799     8.35193     188.298     
1 1 1 12 5  57 o 14 169.521 2.87103 502.92      23.9177  517.229     24.864   127.765    298.443     40.9344     298.443     
1 1 1 12 5  58 o 17 167.34  2.96113 518.582     26.6003  476.519     23.0298  90.7268    267.602     33.628      87.6015     
1 1 1 12 5  59 o 11 318.98  4.0282  1812.78     64.3631  1808.1      64.4219  226.061    87.3745     36.0515     87.3745     
1 1 1 12 5  60 o 18 172.835 2.76846 544.457     22.7568  516.701     25.0716  113.129    273.736     5.43227     273.736     
1 1 1 12 5  61 o 13 83.5257 2.63856 131.267     11.0739  117.22      10.9394  8.5059     78.0875     85.8556     258.087     
1 1 1 12 5  62 o 19 72.9184 3.55993 92.931      12.3741  97.3036     13.48    22.5893    287.393     40.9169     107.393     
1 1 1 12 5  63 o 6  161.814 2.87548 476.426     23.8699  455.446     22.7316  92.0785    209.667     21.4639     29.6668     
1 1 1 12 5  64 o 19 17.0963 5.00474 0.379652    6.56941  2.48621     7.44044  22.0248    312.802     51.482      312.802     
1 1 1 12 5  65 o 18 69.7076 3.18214 92.1438     11.0067  81.8849     11.0714  44.3612    151.511     20.3136     151.511     
1 1 1 12 5  66 o 14 182.242 2.77872 602.543     26.0889  580.183     24.6667  142.749    0.732413    56.5215     0.732413    
1 1 1 12 5  67 o 7  62.907  3.15985 73.1025     10.1109  68.8167     9.68398  24.9523    325.514     22.0978     145.514     
1 1 1 12 5  68 o 12 168     2.90004 512.015     25.2404  494.609     23.5863  113.482    129.858     15.8206     129.858     
1 1 1 12 5  69 o 5  76.1107 3.0304  107.076     11.5878  100.481     11.4315  54.5778    64.932      18.0472     64.932      
1 1 1 12 5  70 o 11 38.69   4.60372 29.631      9.52325  25.926      7.69097  2.4461     39.7818     39.2825     219.782     
1 1 1 12 5  71 o 17 85.6123 3.10656 120.895     13.7875  142.607     12.5711  58.2474    262.822     12.508      262.822     
1 1 1 12 5  72 o 7  98.229  3.1062  174.443     16.4405  172.068     13.9736  57.9408    47.6017     4.72813     227.602     
1 1 1 12 5  73 o 3  105.29  2.91169 196.005     16.0116  201.788     14.5974  65.1861    236.46      1.21399     236.46      
1 1 1 12 5  74 o 1  50.4981 4.01977 48.1174     10.9544  45.3727     8.97278  31.2068    225.585     5.64206     225.585     
1 1 1 12 5  75 o 11 90.7977 3.28286 149.862     15.9931  147.653     13.7037  60.6207    159.009     11.5307     159.009     
1 1 1 12 5  76 o 9  24.4728 5.48642 9.68772     8.406    12.0474     6.8697   4.58293    159.398     7.64986     339.398     
1 1 1 12 5  77 o 14 31.1298 5.34473 20.9315     9.03807  16.531      7.49039  13.914     93.099      0.94531     93.099      
1 1 1 12 5  78 o 15 44.6117 4.29335 39.3633     10.1614  34.8233     8.53594  32.88      277.629     21.7641     277.629     
1 1 1 12 5  79 o 15 48.8569 4.4635  45.9925     12.0283  43.3459     9.14274  27.5747    0.737998    0.965542    180.738     
1 1 1 12 5  80 o 9  20.2268 5.28584 7.0834      7.42942  5.80571     6.74868  3.98835    283.632     28.1949     283.632     
1 1 1 12 5  81 o 3  19.3404 5.23054 3.27759     7.38339  6.98418     6.94843  2.66348    244.406     6.7767      64.4061     
1 1 1 12 5  82 o 1  88.1661 3.67109 144.022     15.7135  142.635     16.5647  43.9641    237.167     16.6292     57.167      
1 1 1 12 5  83 o 17 26.248  6.46802 13.8363     10.255   12.2487     10.6626  9.19132    341.201     2.75996     161.201     
1 1 1 12 5  84 o 5  51.4329 5.28017 62.2887     12.6406  41.7226     13.1479  25.8601    19.4441     6.25505     199.444     
1 1 1 12 5  85 o 1  36.8132 7.02555 36.9935     14.8266  21.2058     12.0189  20.5582    300.985     7.69595     300.985     
1 1 1 12 5  86 o 8  20.6093 6.35769 -5.66324    13.5026  4.62598     11.8979  2.67459    87.9814     3.09304     267.981     
1 1 1 12 5  87 o 10 36.6345 7.33524 15.0779     16.9081  40.6492     14.1537  18.3718    79.0237     1.52357     259.024     
1 1 1 12 5  88 o 5  32.99   7.6547  19.1572     16.2841  27.4539     13.7316  15.6419    304.792     1.41913     124.792     
1 1 1 12 5  89 o 14 24.9727 7.28733 17.9437     15.5351  -7.16442    16.594   2.60208    30.1564     19.1041     210.156     
1 1 1 12 5  90 o 7  41.3688 8.92532 27.103      22.834   58.9786     21.0083  23.1058    55.302      5.41838     55.302      
1 1 1 12 5  91 o 17 25.2588 7.89366 11.2514     21.2006  2.70517     17.9654  4.08834    72.5532     2.37162     252.553     
1 1 1 12 5  92 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 6  0  o 8  961.768 8.5622  16406.1     412.535  16406.1     412.535  980.781    180         567.875     180         
1 1 1 12 6  1  o 16 680.616 6.42144 8167.99     213.767  8257.75     224.211  457.973    84.0834     58.404      264.083     
1 1 1 12 6  2  o 15 1246.94 11.6146 27363.2     760.82   27849.1     688.242  903.868    30.7875     7.87521     30.7873     
1 1 1 12 6  3  o 15 1057.72 9.68814 19881       525.645  19820.5     501.171  801.165    342.801     78.4457     342.801     
1 1 1 12 6  4  o 19 1079.01 10.0692 20552.7     544.462  20768       544.481  826.567    236.931     98.6187     236.931     
1 1 1 12 6  5  f 0  763.712 7.32825 10352.1     294.181  10333.2     266.083  533.132    260.698     0           0           
1 1 1 12 6  6  o 3  231.453 3.11836 953.316     37.1124  945.304     35.2103  127.478    163.314     42.6775     343.314     
1 1 1 12 6  7  o 8  632.221 6.00898 7081.27     185.8    7090.57     194.865  472.267    296.841     43.5297     296.841     
1 1 1 12 6  8  o 4  637.962 5.78293 7226.48     188.868  7203.41     180.829  499.273    342.747     90.1374     342.747     
1 1 1 12 6  9  o 14 1161.45 10.3561 23745.2     574.907  24138.3     629.803  929.474    14.6856     187.543     14.6856     
1 1 1 12 6  10 o 17 569.392 5.77834 5652.51     169.051  5843.03     160.424  340.416    253.089     129.74      73.0889     
1 1 1 12 6  11 o 12 469.164 4.66394 3895.01     112.225  3907.73     107.019  257.715    286.534     148.139     106.534     
1 1 1 12 6  12 o 12 759.604 6.88829 10269.9     249.952  10192.7     273.841  457.527    256.237     172.45      76.2371     
1 1 1 12 6  13 o 6  380.646 3.81845 2576.16     71.2266  2559.48     74.4072  199.305    203.932     133.798     23.9316     
1 1 1 12 6  14 o 5  603.604 5.64054 6329.22     170.564  6589.83     170.628  495.456    122.422     136.266     122.422     
1 1 1 12 6  15 o 4  707.439 6.48911 8782.62     219.404  8965.44     240.426  499.461    345.142     8.85142     165.142     
1 1 1 12 6  16 o 14 834.973 7.56709 12362       301.859  12368       330.76   501.667    0.623455    189.822     180.623     
1 1 1 12 6  17 o 8  871.565 8.21413 13316.4     358.703  13634.8     358.81   577.783    126.295     88.5851     306.295     
1 1 1 12 6  18 o 6  681.602 6.59443 8085.34     213.815  8392.04     236.48   596.316    26.1628     230.119     26.1628     
1 1 1 12 6  19 f 0  136.897 2.5713  336.942     16.6576  327.537     18.5238  4.26631    24.343      0           0           
1 1 1 12 6  20 o 3  92.6081 2.57734 152.008     11.5835  152.411     12.283   47.8987    171.268     166.579     171.268     
1 1 1 12 6  21 o 11 616.46  5.58386 6636.17     168.732  6839.66     176.279  495.15     252.158     125.22      252.158     
1 1 1 12 6  22 o 10 810.223 7.18879 11508.9     285.49   11779.9     298.271  508.741    3.18329     130.732     183.183     
1 1 1 12 6  23 o 1  650.475 6.05167 7427.78     188.161  7578.46     206.139  497.75     190.36      82.8542     190.36      
1 1 1 12 6  24 o 12 769.833 6.91399 10486.8     248.757  10537.7     283.656  648.861    327.2       214.397     327.2       
1 1 1 12 6  25 o 9  400.797 4.01428 2841.42     75.1881  2853.26     85.7456  289.769    327.019     31.9764     327.019     
1 1 1 12 6  26 o 15 309.283 3.34465 1656.54     48.3932  1734.59     55.1996  195.943    291.424     22.2337     111.424     
1 1 1 12 6  27 o 12 437.24  4.2884  3324.12     87.7068  3454.73     100.034  272.122    135.439     61.5048     315.439     
1 1 1 12 6  28 o 6  394.534 3.97937 2723.3      73.4129  2795.57     83.7313  268.735    129.923     5.05859     309.923     
1 1 1 12 6  29 o 2  224.571 2.75478 897.627     29.6709  889.969     32.2688  179.766    153.746     99.7065     153.746     
1 1 1 12 6  30 o 11 190.063 2.58164 636.586     23.5337  643.829     25.6129  115.419    199.892     3.91955     19.8922     
1 1 1 12 6  31 f 0  598.682 5.56844 6329.64     155.817  6387.37     177.693  389.458    97.341      0           0           
1 1 1 12 6  32 o 11 179.04  2.40539 562.528     21.122   573.706     22.0401  55.9829    77.7321     120.893     257.732     
1 1 1 12 6  33 o 13 700.389 6.08211 8628.24     217.598  8785.84     209.186  468.522    214.661     41.7787     34.6607     
1 1 1 12 6  34 o 14 402.091 3.77834 2871.16     76.0988  2862.3      76.1713  297.535    114.148     41.8226     114.148     
1 1 1 12 6  35 o 10 364.558 3.50149 2345.96     63.9332  2366.89     64.0071  325.878    244.468     156.519     244.468     
1 1 1 12 6  36 o 17 135.523 2.31613 320.475     15.9501  330.615     15.4972  71.7583    151.133     32.9159     151.133     
1 1 1 12 6  37 o 14 581.561 5.10138 5851.3      145.634  6156.55     151.74   426.979    167.226     49.1845     167.226     
1 1 1 12 6  38 o 9  375.861 3.63978 2468.29     67.1296  2542.91     69.9893  291.403    109.272     70.7611     109.272     
1 1 1 12 6  39 o 15 420.384 3.94213 3132.52     81.341   3137.4      84.7262  265.898    226.305     44.4192     46.3052     
1 1 1 12 6  40 o 19 279.044 3.06478 1369.6      40.9986  1391.81     44.6661  182.696    70.0053     9.30384     250.005     
1 1 1 12 6  41 o 4  563.917 4.95024 5620.05     137.044  5672.42     142.712  432.408    204.501     90.7682     204.501     
1 1 1 12 6  42 o 9  229.991 2.59362 916.531     29.2736  959.276     30.5173  117.492    318.901     72.9304     138.901     
1 1 1 12 6  43 o 19 513.311 4.4656  4588.22     110.375  4767.37     119.337  406.937    15.1731     112.3       15.1731     
1 1 1 12 6  44 o 14 363.409 3.57695 2247.27     65.0179  2440.71     65.1922  245.986    346.408     1.79885     166.408     
1 1 1 12 6  45 o 9  267.396 2.86551 1243.53     36.8204  1292.64     39.9628  229.279    102.543     102.881     102.543     
1 1 1 12 6  46 o 17 393.493 3.64355 2686.43     71.7648  2809.22     71.9099  260.864    179.089     11.1411     359.089     
1 1 1 12 6  47 o 4  276.62  2.89679 1336.05     40.0752  1378.34     40.2338  218.977    205.005     69.9609     205.005     
1 1 1 12 6  48 o 11 219.477 2.57611 830.188     27.2288  878.525     29.4425  126.416    206.91      37.3326     26.9104     
1 1 1 12 6  49 o 16 406.545 3.72356 2797.88     75.9179  3072.67     75.6702  285.185    311.295     24.1382     311.295     
1 1 1 12 6  50 o 18 216.783 2.84352 828.783     30.1786  838.364     31.5958  183.343    35.233      87.3288     35.233      
1 1 1 12 6  51 o 2  19.4372 4.4762  10.1217     5.35917  1.17294     5.61072  25.1786    354.844     54.2175     354.844     
1 1 1 12 6  52 o 19 352.692 3.90633 2224.04     69.0826  2193.77     69.0031  294.823    291.869     122.472     291.869     
1 1 1 12 6  53 o 13 110.768 2.5946  208.368     14.2324  227.559     14.5236  23.6304    18.9817     90.817      198.982     
1 1 1 12 6  54 o 1  26.2755 4.46423 21.738      7.14562  4.78373     5.39437  11.5208    248.997     27.5172     248.997     
1 1 1 12 6  55 o 10 282.962 3.94761 1488.81     55.2757  1358.08     56.5276  208.551    203.326     46.0548     203.326     
1 1 1 12 6  56 o 4  483.554 4.96407 4168.97     120.268  4158.99     120.319  347.916    122.5       56.2492     122.5       
1 1 1 12 6  57 o 1  149.582 2.79301 405.562     21.4347  389.36      20.4042  98.3498    279.755     6.62766     279.755     
1 1 1 12 6  58 f 0  155.995 2.77274 429.615     22.6999  434.704     20.5639  83.2592    236.933     0           0           
1 1 1 12 6  59 o 15 307.04  3.74101 1674.15     61.9253  1680.28     52.8174  250.708    284.424     101.473     284.424     
1 1 1 12 6  60 o 17 128.675 2.60574 300.093     17.2219  288.478     16.3505  98.3188    347.551     37.7235     347.551     
1 1 1 12 6  61 o 7  182.858 2.63594 597.366     24.7392  590.574     23.5629  130.308    182.587     26.8116     182.587     
1 1 1 12 6  62 f 0  148.513 2.53476 410.369     19.9184  373.756     17.8206  99.8665    108.705     0           0           
1 1 1 12 6  63 o 1  63.5472 3.26524 65.3427     10.78    79.5853     9.63372  27.3929    349.679     16.3132     169.679     
1 1 1 12 6  64 f 0  27.1358 4.77023 22.3112     8.03435  6.29819     5.61488  14.8803    278.883     0           0           
1 1 1 12 6  65 o 12 38.5692 4.4064  31.7129     8.46914  23.254      7.92369  1.16363    100.067     1.56873     280.067     
1 1 1 12 6  66 o 12 62.8275 3.51388 63.0486     10.6114  79.3145     11.2875  36.8963    98.274      15.0018     98.274      
1 1 1 12 6  67 o 13 202.681 3.30527 754.864     31.3642  713.32      35.4784  155.395    43.0725     54.4732     43.0725     
1 1 1 12 6  68 o 14 90.1454 3.04    148.557     13.9095  142.272     13.4792  59.3579    288.119     8.22381     288.119     
1 1 1 12 6  69 o 13 87.207  3.16256 149.36      14.5847  123.913     12.9785  66.1745    106.435     26.3353     106.435     
1 1 1 12 6  70 o 15 63.5816 3.67993 75.0104     12.756   71.2046     10.4144  20.0936    153.997     37.1041     333.997     
1 1 1 12 6  71 o 13 54.1356 3.98539 52.2953     11.3483  54.5364     9.84827  35.9391    318.033     10.7998     318.033     
1 1 1 12 6  72 o 16 17.341  4.94191 -1.62225    7.21673  5.2771      6.54817  12.6785    335.28      39.8308     335.28      
1 1 1 12 6  73 o 18 53.396  4.03263 42.05       10.6811  63.3618     9.93323  37.2622    30.4734     14.9117     30.4734     
1 1 1 12 6  74 o 14 83.6299 3.04577 132.775     13.6308  119.24      11.8173  67.3937    15.2256     35.0258     15.2256     
1 1 1 12 6  75 o 17 55.9242 3.59387 60.7876     10.7059  53.2207     9.2283   38.1293    94.1941     12.2735     94.1941     
1 1 1 12 6  76 o 6  19.0059 5.14218 8.80105     7.79219  -0.0926886  6.42771  0.704893   192.606     12.8019     192.606     
1 1 1 12 6  77 o 14 17.0569 4.55534 -8.93577    6.73531  9.08042     6.37807  7.35247    141.352     29.7955     141.352     
1 1 1 12 6  78 o 12 69.7157 3.17879 93.6674     11.2634  82.8921     10.8204  37.7591    189.342     7.80575     9.34163     
1 1 1 12 6  79 o 11 54.7686 3.80828 61.5758     11.0105  49.4526     9.63477  29.2103    253.345     5.74723     73.3455     
1 1 1 12 6  80 o 18 16.4784 4.90983 1.07695     7.25661  1.393       6.57992  3.01588    181.455     19.507      181.455     
1 1 1 12 6  81 o 19 46.4467 4.67654 39.4089     10.635   42.895      10.4935  20.658     119.496     12.007      299.496     
1 1 1 12 6  82 o 12 37.7049 6.00512 36.9899     10.6266  20.7182     11.8762  9.43021    61.8492     23.4615     241.849     
1 1 1 12 6  83 o 9  35.8603 5.90395 14.6476     9.88236  39.0655     11.7926  19.1185    225.405     1.85193     225.405     
1 1 1 12 6  84 o 14 30.4551 6.74771 18.1975     11.2769  20.0727     11.6344  12.576     43.086      1.79385     223.086     
1 1 1 12 6  85 o 19 76.935  4.3637  112.637     16.9484  110.861     16.417   42.5259    10.3196     4.22583     190.32      
1 1 1 12 6  86 o 16 38.467  6.89397 24.6147     12.8451  38.1797     14.0465  17.0557    217.737     7.49576     37.7368     
1 1 1 12 6  87 o 5  26.6723 7.15223 23.7182     15.4295  -0.659947   12.7979  9.54511    224.179     5.44936     44.1787     
1 1 1 12 6  88 o 3  34.0532 7.836   28.629      16.4852  23.4862     14.1784  18.5387    139.987     4.92603     139.987     
1 1 1 12 6  89 o 14 27.1189 8.01816 18.0183     20.072   6.32163     16.3804  8.72041    203.169     5.43532     23.1686     
1 1 1 12 6  90 o 15 24.0729 7.59591 -3.29482    20.2036  8.20878     17.7539  1.69151    275.609     0.723707    95.6087     
1 1 1 12 6  91 o 18 24.1485 7.64092 14.5177     20.6815  -8.26423    17.8123  2.83069    322.72      3.41777     142.72      
1 1 1 12 6  92 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 7  0  o 18 415.4   3.98658 3059.45     82.9558  3059.45     82.9558  204.495    180         193.479     1.18135e-05 
1 1 1 12 7  1  o 8  280.473 3.06449 1372.59     43.0636  1415.57     43.0758  236.417    210.741     172.854     210.741     
1 1 1 12 7  2  o 15 392.993 3.99172 2726.03     78.6087  2748.26     78.6201  269.294    168.555     10.6095     348.555     
1 1 1 12 7  3  o 5  373.552 3.68736 2459.57     69.027   2486.34     69.028   283.459    325.494     50.1714     325.494     
1 1 1 12 7  4  o 14 917.97  8.04726 14886.5     378.127  15006       362.03   632.621    44.5323     57.2939     224.532     
1 1 1 12 7  5  o 18 874.069 8.25806 13462.2     361.717  13641.5     361.73   634.509    120.32      11.2738     120.32      
1 1 1 12 7  6  o 17 406.126 4.28349 2952.23     87.1814  2894.44     87.1728  264.208    62.6349     41.5011     242.635     
1 1 1 12 7  7  o 10 516.221 5.16409 4747.35     133.599  4700.05     133.589  296.419    207.625     142.137     27.6249     
1 1 1 12 7  8  o 3  353.169 3.68582 2188.51     65.227   2232.5      65.2374  295.972    99.7044     111.163     99.7044     
1 1 1 12 7  9  o 13 715.851 6.85092 9007.33     245.757  9166.57     245.772  463.391    249.117     99.4534     69.1165     
1 1 1 12 7  10 f 0  450.648 4.65618 3576.41     110.244  3622.84     99.7307  306.286    162.717     0           0           
1 1 1 12 7  11 o 1  1225.37 11.1074 26836.9     665.517  26486.2     698.037  905.132    127.728     45.5195     127.728     
1 1 1 12 7  12 o 1  397.868 4.23939 2792.54     88.6303  2818.76     80.174   329.329    326.831     110.256     326.831     
1 1 1 12 7  13 o 19 663.243 6.10238 7796.05     202.824  7802.21     202.836  470.476    116.755     4.32388     296.755     
1 1 1 12 7  14 o 12 496.645 4.65278 4343.27     113.261  4400.74     118.319  418.596    281.645     142.225     281.645     
1 1 1 12 7  15 o 6  943.933 8.07773 15720.6     382.094  15891.4     382.123  734.396    191.174     117.974     191.174     
1 1 1 12 7  16 o 6  351.034 3.59378 2238.86     64.6056  2129.51     61.8458  155.69     262.01      175.506     82.0101     
1 1 1 12 7  17 o 9  941.181 8.03966 15650.3     379.183  15779.4     379.217  695.334    314.362     46.091      314.362     
1 1 1 12 7  18 o 5  310.92  3.24776 1689.72     50.5976  1736.81     50.6052  172.461    28.2328     75.773      208.233     
1 1 1 12 7  19 o 6  557.373 5.18593 5527.03     135.028  5487.94     153.99   518.384    93.1712     261.982     93.1712     
1 1 1 12 7  20 o 12 492.475 4.67747 4292.96     107.634  4305.5      122.77   315.411    163.702     57.7027     343.702     
1 1 1 12 7  21 f 0  271.521 3.08282 1279.12     39.139   1334.2      44.6766  201.782    40.1519     0           0           
1 1 1 12 7  22 o 9  308.069 3.40411 1714.82     50.0484  1649.53     54.8436  94.71      156.771     231.982     336.771     
1 1 1 12 7  23 o 6  603.292 5.52349 6375.68     155.814  6532.1      177.702  366.731    340.322     116.647     160.322     
1 1 1 12 7  24 o 2  624.91  5.71065 6876.67     166.82   6973.89     190.247  464.19     98.7502     49.6043     98.7502     
1 1 1 12 7  25 o 16 89.7826 2.41828 142.125     10.6093  143.987     11.1095  19.3562    135.756     92.8215     135.756     
1 1 1 12 7  26 o 16 332.587 3.42355 1924.02     54.6592  1997.5      59.4381  238.576    99.2867     25.9932     99.2867     
1 1 1 12 7  27 o 19 354.38  3.59107 2210.43     61.0706  2241.82     66.4041  199.884    179.46      89.2221     359.46      
1 1 1 12 7  28 o 6  387.6   3.7442  2613.81     68.2831  2713.1      77.0529  285.41     143.888     36.1741     143.888     
1 1 1 12 7  29 o 19 231.101 2.72412 936.259     29.5974  956.918     33.4238  163.389    211.39      26.7975     211.39      
1 1 1 12 7  30 o 8  295.573 3.12542 1530.91     43.4398  1566.3      49.0398  126.931    25.2679     152.044     205.268     
1 1 1 12 7  31 o 9  343.138 3.51507 2077.84     55.1969  2096.96     65.3144  259.74     344.516     50.1005     344.516     
1 1 1 12 7  32 o 6  268.544 3.01947 1278.53     37.0885  1278.15     43.8957  251.906    316.974     157.728     316.974     
1 1 1 12 7  33 o 13 246.112 2.91067 1034.84     32.8366  1113.28     38.8913  143.284    74.7779     45.2197     254.778     
1 1 1 12 7  34 o 16 630.681 5.72746 7043.79     165.284  7078.84     195.557  412.416    237.792     55.5978     57.7923     
1 1 1 12 7  35 o 2  606.19  5.63748 6469.54     159.755  6579        182.202  458.951    52.7879     74.6087     52.7878     
1 1 1 12 7  36 o 10 164.26  2.52937 453.677     19.4309  503.515     22.2208  79.0199    119.988     51.8405     299.988     
1 1 1 12 7  37 o 8  813.664 7.33603 11562.9     279.186  11994.1     318.425  689.606    348.042     248.562     348.042     
1 1 1 12 7  38 o 19 254.774 3.12048 1135.44     38.8711  1166.58     40.8091  130.863    216.323     81.7724     36.3231     
1 1 1 12 7  39 o 10 328.553 3.67092 1899.13     55.8931  1930.46     64.7358  171.916    142.835     104.933     322.835     
1 1 1 12 7  40 o 12 132.294 2.38596 307.629     15       313.102     16.594   70.2865    102.587     43.1574     102.587     
1 1 1 12 7  41 o 5  395.316 3.74884 2696.84     75.6089  2849.09     72.7798  261.98     26.7806     17.1194     206.781     
1 1 1 12 7  42 o 3  258.999 2.80697 1164.23     36.349   1214.92     36.508   206.508    68.8029     65.8906     68.8029     
1 1 1 12 7  43 o 3  425.624 3.93987 3103.39     85.5259  3328.31     82.3271  325.94     183.92      70.5823     183.92      
1 1 1 12 7  44 f 0  172.687 2.44122 502.955     20.5502  555.099     21.7053  105.947    271.46      0           0           
1 1 1 12 7  45 o 6  503.953 4.51748 4344.36     111.714  4679.27     116.475  330.406    227.347     26.533      47.3465     
1 1 1 12 7  46 o 12 387.355 3.7261  2556.83     72.2262  2771.14     72.3527  287.735    77.6148     51.3032     77.6148     
1 1 1 12 7  47 o 7  246.837 2.81984 1040.8      34.7976  1121.16     34.934   174.098    344.124     20.1735     344.124     
1 1 1 12 7  48 o 8  196.971 2.75267 653.834     27.6912  723.231     26.5291  123.669    66.9467     10.759      246.947     
1 1 1 12 7  49 o 14 258.549 2.90602 1116.52     36.7258  1257.1      38.5679  184.277    145.799     25.9101     145.799     
1 1 1 12 7  50 o 7  177.177 2.63592 552.625     23.35    560.882     23.4587  82.9377    333.552     65.1804     153.552     
1 1 1 12 7  51 f 0  267.423 3.21819 1173.55     43.4857  1368.24     42.5005  143.232    211.77      0           0           
1 1 1 12 7  52 o 19 343.757 3.49944 2057.77     63.8758  2138.04     56.2919  219.092    184.377     19.6176     4.37679     
1 1 1 12 7  53 o 5  283.835 3.02568 1420.88     45.6637  1438.32     40.2027  171.864    238.152     31.7759     58.1516     
1 1 1 12 7  54 o 3  147.494 2.73969 390.967     22.1073  381.334     18.227   86.9273    2.59665     13.3567     182.597     
1 1 1 12 7  55 o 2  150.097 2.79831 418.54      22.0306  382.058     20.0413  104.59     62.6206     19.3769     62.6205     
1 1 1 12 7  56 o 3  46.7086 3.84622 32.0046     8.82831  47.3815     8.41587  5.18991    33.005      54.3068     33.005      
1 1 1 12 7  57 o 12 184.993 2.81916 603.141     26.074   612.033     26.1973  122.337    3.81477     5.08802     3.81476     
1 1 1 12 7  58 o 2  58.4755 3.47671 56.2486     10.7807  66.4125     9.11494  8.1207     317.221     48.8837     137.221     
1 1 1 12 7  59 o 16 48.4289 3.84477 40.803      8.77753  43.7661     9.5649   0.875895   218.396     52.3223     218.396     
1 1 1 12 7  60 o 15 113.248 3.05529 232.68      17.319   224.038     17.2925  38.6777    308.022     66.0016     128.022     
1 1 1 12 7  61 o 9  147.491 2.95227 397.378     21.4274  377.012     22.1352  99.9948    352.863     12.8833     352.863     
1 1 1 12 7  62 o 3  169.243 2.96547 517.184     25.1961  502.383     25.0842  111.846    280.398     7.46412     280.398     
1 1 1 12 7  63 o 4  161.4   3.08246 477.942     24.9706  450.722     24.8358  118.548    227.906     32.5472     227.906     
1 1 1 12 7  64 o 14 218.663 3.13629 866.61      36.4251  837.924     32.2445  158.063    280.325     36.5019     280.325     
1 1 1 12 7  65 o 6  48.9062 3.70276 55.3222     10.5116  32.6553     7.43115  14.52      301.252     19.6914     121.252     
1 1 1 12 7  66 o 11 20.5252 5.22533 9.91688     8.40242  3.49006     5.40358  1.67615    18.2004     5.09881     18.2004     
1 1 1 12 7  67 o 5  118.535 2.53342 256.02      16.3508  244.97      13.6424  92.5817    224.15      37.8473     224.15      
1 1 1 12 7  68 o 4  42.934  4.48987 37.059      9.97259  30.9311     8.77938  16.7836    354.892     14.6188     174.892     
1 1 1 12 7  69 o 17 139.271 3.08905 341.779     22.3232  352.909     20.6786  87.927     204.052     0.833606    204.052     
1 1 1 12 7  70 o 14 79.1474 3.13345 110.918     13.9473  114.204     10.4894  46.9359    202.511     2.9177      22.5106     
1 1 1 12 7  71 o 5  102.936 2.99944 188.492     16.8794  191.831     13.8064  70.2232    107.282     13.4133     107.282     
1 1 1 12 7  72 o 12 54.4507 3.6121  58.5033     10.4071  49.4874     9.09039  34.2195    109.332     5.5544      109.332     
1 1 1 12 7  73 o 16 158.526 2.71096 458.907     21.6567  441.143     21.4148  129.974    316.745     63.6571     316.745     
1 1 1 12 7  74 o 7  125.696 2.70545 281.794     17.1112  284.781     16.9314  86.9194    270.524     19.124      270.524     
1 1 1 12 7  75 o 13 17.8351 4.98565 5.94119     6.74633  0.0864534   6.81332  4.1501     21.1845     21.0185     21.1845     
1 1 1 12 7  76 o 16 36.4839 4.57269 24.6954     8.11509  25.4753     7.99113  21.1966    148.296     5.87282     148.296     
1 1 1 12 7  77 o 3  72.9472 3.21736 95.4642     11.5076  97.5862     11.8984  43.8307    83.0271     0.0824733   83.0275     
1 1 1 12 7  78 o 14 69.9206 3.46483 85.1194     11.136   93.5162     12.9842  44.8937    300.678     6.46618     300.678     
1 1 1 12 7  79 o 1  40.2973 4.86985 29.3396     8.80198  32.9451     10.1651  28.3524    107.455     14.9866     107.455     
1 1 1 12 7  80 o 8  44.1356 4.59146 31.8177     9.1736   42.7074     10.5199  19.1188    210.242     12.5069     30.2421     
1 1 1 12 7  81 o 6  62.0419 4.98149 93.2322     12.4326  55.8836     15.6482  34.5956    26.8406     3.40617     206.841     
1 1 1 12 7  82 o 16 35.3594 6.54383 26.0366     9.98521  25.4414     13.6607  17.4042    140.92      1.99287     320.92      
1 1 1 12 7  83 o 15 51.6698 5.2549  43.2971     11.1186  61.8431     15.4093  34.7972    225.94      12.5415     225.94      
1 1 1 12 7  84 o 4  43.6662 6.62428 47.7172     13.299   31.6852     14.9121  21.0048    288.464     5.8847      108.464     
1 1 1 12 7  85 o 17 38.4468 7.32509 23.5964     14.0159  40.3243     15.3721  14.1699    198.574     13.6536     18.5745     
1 1 1 12 7  86 o 12 21.6707 6.52662 -2.33505    11.497   8.39178     13.6387  3.38739    5.88531     0.607183    185.885     
1 1 1 12 7  87 o 17 50.8777 6.52189 53.1124     15.218   54.5937     16.7924  29.0082    102.044     1.31936     102.044     
1 1 1 12 7  88 o 15 27.112  7.13476 6.12017     12.6636  22.0558     14.2058  10.4164    118.552     0.522342    118.552     
1 1 1 12 7  89 o 5  43.3697 7.75475 42.6824     17.2163  44.9027     16.5339  26.3874    16.3504     9.08925     16.3504     
1 1 1 12 7  90 o 19 33.93   8.96709 43.7266     22.4519  15.0455     20.4583  13.0526    49.5101     5.10392     229.51      
1 1 1 12 7  91 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 8  0  o 7  274.532 3.00534 1336.43     41.3249  1336.43     41.3249  185.445    360         27.2909     180         
1 1 1 12 8  1  o 14 872.824 7.54766 13479.3     330.137  13543.6     330.144  602.771    75.2911     53.0414     255.291     
1 1 1 12 8  2  o 19 327.538 3.4409  1894.8      55.2386  1907.62     57.7022  176.204    62.3311     102.828     242.331     
1 1 1 12 8  3  o 16 485.707 4.58731 4146.84     114.033  4216.14     109.186  355.728    43.8271     23.3967     43.8272     
1 1 1 12 8  4  o 5  506.663 4.65683 4582.66     118.242  4517.62     118.236  354.13     339.482     11.5577     159.481     
1 1 1 12 8  5  o 4  499.24  4.70148 4424        120.163  4411.55     115.041  229.55     268.292     253.456     88.2916     
1 1 1 12 8  6  o 3  511.111 4.88664 4646.59     125.164  4614.48     125.166  286.267    260.605     155.829     80.6046     
1 1 1 12 8  7  o 11 669.921 6.03483 8011.42     206.992  7902.52     198.175  576.49     259.32      196.912     259.32      
1 1 1 12 8  8  o 16 855.236 7.53246 12960.3     315.748  12984.8     329.786  695.378    212.247     162.28      212.247     
1 1 1 12 8  9  o 16 614.193 5.69423 6658.39     175.262  6717.1      175.27   451.555    328.969     27.3127     328.968     
1 1 1 12 8  10 o 8  418.637 4.35592 3073.99     91.3767  3138.75     91.3875  273.837    7.25714     39.2755     187.257     
1 1 1 12 8  11 o 6  89.1456 2.38353 147.889     10.6029  134.316     10.6349  164.484    145.347     432.469     145.347     
1 1 1 12 8  12 o 2  495.78  4.97278 4358.58     123.55   4355.62     123.553  283.862    100.843     134.517     280.843     
1 1 1 12 8  13 o 18 714.896 6.8169  8999.02     244.211  9128.13     244.23   516.983    243.361     13.2932     243.361     
1 1 1 12 8  14 o 3  591.113 5.50276 6159.75     163.001  6229.74     163.014  408.255    73.232      22.3303     253.232     
1 1 1 12 8  15 o 5  743.401 6.60132 9704        240.553  9897.56     251.282  465.234    289.289     131.312     109.289     
1 1 1 12 8  16 o 11 885.34  7.90378 13884.8     350.664  13927.7     350.687  687.147    214.424     109.386     214.424     
1 1 1 12 8  17 o 15 648.126 5.84521 7425.86     193.92   7470.84     185.672  413.622    169.34      93.0591     349.34      
1 1 1 12 8  18 o 15 98.0105 2.29102 168.023     11.2233  172.807     11.2501  4.92749    15.1523     24.1806     15.1523     
1 1 1 12 8  19 o 14 207.909 2.75595 781.198     28.727   750.984     28.6947  54.7243    295.303     31.9815     295.303     
1 1 1 12 8  20 o 7  740.703 6.61181 9825.31     250.755  9637.92     240.071  544.253    326.466     36.9858     326.466     
1 1 1 12 8  21 o 11 271.092 3.07066 1344.84     42.6345  1260.71     40.805   147.816    269.008     65.5938     89.0081     
1 1 1 12 8  22 o 4  230.235 2.77301 947.268     31.9964  931.575     31.9922  94.935     345.575     113.312     165.575     
1 1 1 12 8  23 o 9  386.947 3.97076 2704.01     73.3459  2604.72     80.342   271.541    131.957     8.59157     131.957     
1 1 1 12 8  24 o 7  665.093 6.14272 7857.7      195.175  7836.37     213.852  434.108    242.878     73.0094     62.8781     
1 1 1 12 8  25 o 10 770.672 6.82354 10641.4     257.657  10439.6     269.16   520.391    204.614     51.5145     24.6139     
1 1 1 12 8  26 o 11 677.073 6.21482 8230.03     210.861  8038.75     210.867  470.419    270.575     16.0123     90.5747     
1 1 1 12 8  27 o 8  377.546 3.79652 2578.08     70.2103  2476.42     73.3343  333.045    341.686     148.84      341.686     
1 1 1 12 8  28 o 15 357.564 3.58332 2224.55     61.5035  2308.91     66.8862  103.652    344.361     291.995     164.361     
1 1 1 12 8  29 o 14 388.398 3.80216 2632.19     70.887   2717.36     77.0798  290.377    130.89      42.8994     130.89      
1 1 1 12 8  30 o 15 307.191 3.26301 1657.05     48.1024  1688.77     52.3115  173.969    69.5944     74.9451     249.594     
1 1 1 12 8  31 o 10 233.189 2.82386 951.352     31.6042  976.472     34.3693  172.725    323.287     36.775      323.287     
1 1 1 12 8  32 o 5  480.848 4.40774 4056.89     99.6852  4146.01     112.487  381.128    88.3778     92.6841     88.3778     
1 1 1 12 8  33 o 2  351.925 3.4968  2205.46     57.827   2186.75     65.2578  281.714    101.005     80.4748     101.005     
1 1 1 12 8  34 o 14 388.818 3.75884 2657.31     68.7297  2705.15     77.5614  295.61     3.90722     55.0455     3.90722     
1 1 1 12 8  35 o 16 716.272 6.20228 9070.94     208.883  9160.62     235.695  486.712    207.427     26.9176     27.4268     
1 1 1 12 8  36 o 2  446.918 4.16801 3547.07     87.5547  3540.34     98.7953  438.868    155.767     266.052     155.767     
1 1 1 12 8  37 o 3  119.033 2.44421 252.716     14.2282  250.045     14.89    42.1994    20.8678     54.7527     200.868     
1 1 1 12 8  38 o 13 331.935 3.43108 1953.12     52.0705  1955.2      61.6776  245.582    267.798     38.5502     267.798     
1 1 1 12 8  39 o 12 105.757 2.37429 203.02      12.2798  193.966     12.8315  39.1716    339.381     43.0239     159.381     
1 1 1 12 8  40 o 12 73.4476 2.35222 101.147     8.03973  90.6509     9.1159   13.3791    214.431     30.2531     34.4313     
1 1 1 12 8  41 o 17 130.753 2.44097 290.364     14.9346  316.528     17.0262  99.2942    154.876     47.4158     154.876     
1 1 1 12 8  42 o 17 107.024 2.37562 197.769     12.1781  208.84      13.2724  64.5118    145.305     7.31128     145.305     
1 1 1 12 8  43 o 6  329.455 3.56453 1888.65     53.2759  1963.36     64.1185  259.272    3.0581      71.2777     3.0581      
1 1 1 12 8  44 o 9  62.9734 2.87234 65.9497     8.42968  75.4547     9.61331  6.10638    146.205     37.4186     326.205     
1 1 1 12 8  45 o 12 171.966 2.88158 503.467     20.7378  546.33      28.5656  66.2943    27.9941     94.983      207.994     
1 1 1 12 8  46 o 5  235.795 2.94554 952.622     31.5032  1020.35     37.9976  138.516    260.314     38.2106     80.3143     
1 1 1 12 8  47 o 15 93.5062 2.71093 137.176     11.7203  174.605     13.6536  22.9252    94.4197     65.9152     274.42      
1 1 1 12 8  48 o 4  208.292 2.54438 730.132     25.8449  809.682     27.2749  122.905    30.6271     29.3028     210.627     
1 1 1 12 8  49 o 13 409.097 3.70536 2877.26     75.8354  3066.5      76.0445  331.302    136.735     112.694     136.735     
1 1 1 12 8  50 o 12 40.5212 3.25028 24.9987     6.30226  34.4088     6.55359  29.9056    330.975     90.8868     330.975     
1 1 1 12 8  51 o 12 189.963 2.50661 603.261     24.1062  677.828     23.5201  175.409    43.2455     113.543     43.2455     
1 1 1 12 8  52 o 14 99.6176 2.43103 176.969     12.8515  175.458     11.3431  41.4841    258.458     36.2445     78.4579     
1 1 1 12 8  53 o 1  175.231 2.41591 552.538     21.4503  536.791     20.9814  128.194    118.262     31.446      118.262     
1 1 1 12 8  54 o 13 134.845 2.53996 317.44      17.0615  328.267     17.2351  75.5571    314.993     20.2145     134.993     
1 1 1 12 8  55 o 17 220.401 2.98966 917.529     32.112   809.06      33.7122  138.151    63.9568     13.0483     243.957     
1 1 1 12 8  56 o 8  249.606 3.26738 1142.8      42.4567  1071.56     39.294   167.212    137.107     6.28457     137.107     
1 1 1 12 8  57 o 9  286.659 3.49719 1471.58     48.8459  1450.75     51.5741  206.551    172.874     36.3975     172.874     
1 1 1 12 8  58 o 4  53.5722 3.776   51.7687     10.4195  51.4021     9.56749  3.70295    170.607     0.37233     170.607     
1 1 1 12 8  59 o 2  199.256 2.94401 713.449     29.366   697.96      29.4257  151.049    33.9515     44.6061     33.9515     
1 1 1 12 8  60 o 8  196.173 3.00053 690.579     30.2768  678.221     28.7111  122.78     117.639     8.32969     297.639     
1 1 1 12 8  61 o 17 53.8121 3.79961 56.7974     10.7837  47.7131     9.45041  6.38548    30.9323     48.3443     210.932     
1 1 1 12 8  62 o 1  179.881 2.77998 566.515     25.6804  584.864     24.398   114.685    159.276     1.59248     339.276     
1 1 1 12 8  63 o 6  105.941 2.82218 197.516     15.8281  202.678     14.0009  56.6815    89.848      18.5835     269.848     
1 1 1 12 8  64 o 2  77.3102 3.21536 104.352     13.5772  109.646     11.0097  48.4387    328.055     7.71115     328.055     
1 1 1 12 8  65 o 16 79.3154 3.24122 105.018     13.9753  120.589     11.2808  62.1924    70.9447     37.5932     70.9447     
1 1 1 12 8  66 o 1  108.981 3.03569 202.327     17.72    222.51      15.1071  76.191     65.3484     16.5801     65.3484     
1 1 1 12 8  67 o 2  90.8383 3.06174 141.13      15.112   154.491     12.389   66.0385    73.2899     19.7822     73.2899     
1 1 1 12 8  68 o 9  59.0606 3.59376 66.1776     11.7824  59.9852     9.2232   15.6653    123.879     40.8197     303.879     
1 1 1 12 8  69 o 14 96.4525 2.62081 168.386     13.584   164.286     11.6503  59.2621    28.8502     1.38825     208.85      
1 1 1 12 8  70 o 7  102.487 2.69806 208.714     14.7257  168.42      12.9544  61.4807    41.4226     4.5073      221.423     
1 1 1 12 8  71 o 14 96.7887 2.61503 196.772     12.9193  141.013     12.2376  61.0962    265.254     2.57895     265.254     
1 1 1 12 8  72 o 9  57.4895 3.26737 69.198      9.6846   51.1154     8.91303  37.0255    51.3363     6.66698     51.3363     
1 1 1 12 8  73 o 6  85.7616 2.49331 141.418     10.5453  122.425     10.7783  54.8312    140.295     4.958       140.295     
1 1 1 12 8  74 o 1  21.3445 5.40086 8.25808     7.16467  6.45323     7.52377  0.269446   300.598     17.5354     300.598     
1 1 1 12 8  75 o 19 96.8815 2.96738 169.306     14.223   168.906     14.5207  55.2832    259.813     7.99483     79.8129     
1 1 1 12 8  76 o 16 19.7077 5.39578 4.59251     7.58345  5.53494     7.60795  0.42897    169.21      15.056      349.21      
1 1 1 12 8  77 o 14 26.6803 5.36039 19.6295     7.79039  7.02708     8.27872  9.70835    80.1577     6.33849     260.158     
1 1 1 12 8  78 o 7  60.0267 3.4977  76.4604     10.3445  56.4366     10.3048  24.2144    9.22667     23.3621     189.227     
1 1 1 12 8  79 o 17 17.7406 4.92024 -11.1006    6.79305  10.9921     8.38655  1.43531    53.1847     18.0354     53.1847     
1 1 1 12 8  80 f 0  70.484  3.98095 96.6331     12.6308  88.3192     14.9759  24.3138    180.47      0           0           
1 1 1 12 8  81 o 8  66.33   4.68502 84.8246     12.6463  82.4037     17.4335  34.7718    238.8       8.60208     58.7995     
1 1 1 12 8  82 o 19 52.8231 5.65484 62.401      11.6526  47.9113     15.9688  32.4495    116.282     5.14127     116.282     
1 1 1 12 8  83 o 18 40.9322 6.82943 43.7967     13.1424  26.7427     14.976   17.0969    73.0873     10.5823     253.087     
1 1 1 12 8  84 o 8  37.3495 6.68863 44.7479     13.021   12.7359     15.0415  20.3835    67.654      2.07739     67.654      
1 1 1 12 8  85 o 17 30.9211 7.46747 22.6355     13.6935  16.8438     14.3387  11.1317    11.8957     9.87864     191.896     
1 1 1 12 8  86 o 14 31.6658 7.7391  25.5029     15.3903  17.376      14.7079  9.23579    345.338     14.9772     165.338     
1 1 1 12 8  87 o 19 28.6701 6.93021 0.427685    12.8915  30.2373     14.3472  13.1086    354.467     3.50628     354.467     
1 1 1 12 8  88 o 7  29.8183 7.30411 8.70339     13.3757  29.4579     14.8142  12.6783    7.81169     2.13805     7.81169     
1 1 1 12 8  89 o 16 33.2346 7.9613  23.0084     16.0338  30.1027     15.7996  13.2259    236.108     5.25604     236.108     
1 1 1 12 8  90 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 9  0  o 16 627.803 5.57203 6988.64     175.244  6988.64     175.244  531.376    360         150.472     360         
1 1 1 12 9  1  o 9  140.658 2.35221 363.697     16.5688  337.705     16.5751  36.9274    107.094     246.896     107.094     
1 1 1 12 9  2  o 6  336.837 3.40666 2016.37     57.5056  2005.06     57.5051  252.158    75.496      44.5727     75.496      
1 1 1 12 9  3  o 9  211.014 2.69926 800.223     27.904   777.929     29.1486  137.531    120.316     44.8692     120.316     
1 1 1 12 9  4  o 9  289.357 3.26783 1511.2      49.5349  1456.62     45.2063  211.513    330.436     39.4179     330.436     
1 1 1 12 9  5  o 15 599.368 5.48575 6400.97     168.339  6336.55     161.165  454.771    109.455     54.4232     109.455     
1 1 1 12 9  6  o 18 585.144 5.52498 6071.37     154.472  6068.88     169.218  505.665    8.19078     180.844     8.19078     
1 1 1 12 9  7  o 8  550     4.98209 5337.31     137.316  5387.35     137.322  521.952    13.9051     270.561     13.9051     
1 1 1 12 9  8  o 16 407.165 4.10864 2966.14     87.6049  2910.67     79.9583  322.609    57.6339     80.7853     57.6339     
1 1 1 12 9  9  o 18 671.659 6.04209 8031.66     198.891  7966.32     207.724  466.794    36.9321     27.4954     216.932     
1 1 1 12 9  10 o 15 719.362 6.42593 9066.59     226.599  9287.13     236.699  436.718    148.661     158.316     328.661     
1 1 1 12 9  11 o 16 598.691 5.46371 6319.57     167.423  6389.84     160.311  443.504    78.6629     35.7784     78.6629     
1 1 1 12 9  12 o 15 433.687 4.20224 3327.94     89.3236  3339.58     93.3016  378.081    359.336     158.756     359.336     
1 1 1 12 9  13 o 13 461.416 4.74872 3727.04     115.079  3821.5      104.11   277.401    64.4939     94.6743     244.494     
1 1 1 12 9  14 o 4  416.646 4.15883 3079.49     86.8378  3074.4      86.8337  205.656    209.916     172.998     29.9161     
1 1 1 12 9  15 f 0  207.186 2.83378 772.209     30.129   749.289     28.7163  162.842    18.3621     0           0           
1 1 1 12 9  16 f 0  444.317 4.34184 3499.19     96.6768  3499.71     96.6792  142.068    153.19      0           0           
1 1 1 12 9  17 o 18 292.708 3.35844 1499.71     48.0688  1537.36     50.455   214.829    233.815     44.3615     233.815     
1 1 1 12 9  18 o 6  334.254 3.55605 1964.18     59.5617  1996.32     59.5691  240.782    89.3183     27.5074     89.3183     
1 1 1 12 9  19 o 8  457.519 4.46072 3672.37     102.266  3749.54     102.278  360.382    62.883      82.0395     62.883      
1 1 1 12 9  20 o 13 1181.39 10.2243 24786.4     591.999  24823.3     618.373  938.432    58.3652     185.768     58.3652     
1 1 1 12 9  21 o 15 627.374 5.56096 7002.56     174.835  6958.59     174.841  386.658    6.98272     117.936     186.983     
1 1 1 12 9  22 o 9  386.142 3.70759 2679.74     70.2737  2606.66     73.1402  312.42     137.578     91.1928     137.578     
1 1 1 12 9  23 o 9  560.1   4.9495  5532.25     136.128  5594.33     141.698  352.929    29.7346     87.1052     209.735     
1 1 1 12 9  24 o 18 175.748 2.45996 549.373     21.2008  545.408     22.1179  94.9353    323.118     28.7962     143.118     
1 1 1 12 9  25 o 2  403.315 4.14902 2887.18     85.8423  2881.03     81.832   225.817    43.1951     113.861     223.195     
1 1 1 12 9  26 o 6  771.903 6.70956 10615.1     259.544  10540.7     259.55   566.383    221.68      38.254      221.68      
1 1 1 12 9  27 o 14 218.644 2.68005 855.161     29.365   839.478     29.3646  28.9457    242.4       241.565     62.3997     
1 1 1 12 9  28 o 8  321.344 3.48509 1794.31     56.0809  1867.5      56.1507  123.465    89.9372     200.771     269.937     
1 1 1 12 9  29 o 4  371.331 3.8374  2449.02     71.4071  2441.06     71.4128  297.496    302.729     80.7185     302.729     
1 1 1 12 9  30 o 18 82.9666 2.52069 131.704     10.4117  113.114     10.4507  7.82819    182.355     44.539      2.35537     
1 1 1 12 9  31 o 3  339.426 3.68924 2056.31     64.2443  2029.83     61.2458  206.739    52.5144     57.0806     232.514     
1 1 1 12 9  32 o 15 138.836 2.39077 348.382     16.2492  335.21      16.9778  45.6899    324.204     84.167      144.204     
1 1 1 12 9  33 o 1  319.415 3.34384 1814.32     53.5405  1804.02     53.5105  225.091    260.57      11.5592     260.57      
1 1 1 12 9  34 o 17 435.09  4.11883 3350.34     89.8124  3366.6      89.8026  363.213    80.8931     124.405     80.8931     
1 1 1 12 9  35 o 14 495.946 4.48341 4350.72     109.184  4379.47     113.645  312.207    349.977     65.8481     169.977     
1 1 1 12 9  36 o 8  313.074 3.12277 1707.92     48.0824  1768.51     49.9104  180.629    183.07      68.653      3.07047     
1 1 1 12 9  37 o 13 93.7478 2.38037 148.597     10.8825  163.575     11.4483  23.2492    80.9851     54.7993     260.985     
1 1 1 12 9  38 o 1  365.722 3.62461 2365.01     66.4338  2380.44     66.4284  271.142    28.9334     39.2937     28.9334     
1 1 1 12 9  39 o 10 270.417 3.05371 1269        39.6391  1324.94     43.1143  169.889    227.139     29.2609     47.1393     
1 1 1 12 9  40 o 17 140.207 2.48178 322.914     16.2825  375.329     18.6035  72.4768    206.974     37.452      26.9736     
1 1 1 12 9  41 o 19 179.391 2.66246 572.377     23.9292  568.871     23.9417  144.034    30.5079     54.6425     30.5079     
1 1 1 12 9  42 o 12 179.615 2.56902 552.87      22.134   591.533     24.1194  126.938    116.244     17.8746     116.244     
1 1 1 12 9  43 o 19 377.933 3.84527 2495.23     71.2249  2575.49     74.4341  318.235    279.034     121.514     279.034     
1 1 1 12 9  44 o 2  310.038 3.48477 1667.54     51.6187  1744.29     56.6447  206.386    287.116     7.9661      107.116     
1 1 1 12 9  45 o 4  239.192 2.96705 984.273     33.1868  1045.91     37.9063  172.706    270.607     25.9004     270.607     
1 1 1 12 9  46 o 7  151.58  2.51576 395.591     17.7525  419.473     20.44    102.323    228.975     11.9035     228.975     
1 1 1 12 9  47 o 4  149.451 2.49147 376.595     17.7122  416.072     19.6195  128.004    266.682     88.5313     266.682     
1 1 1 12 9  48 o 9  475.192 4.61053 3907.55     104.66   4120.37     114.902  341.884    284.519     40.0423     284.519     
1 1 1 12 9  49 o 5  216.472 2.72458 813.213     28.0716  849.393     31.0226  164.556    25.9757     44.939      25.9757     
1 1 1 12 9  50 o 12 357.435 3.51465 2224.84     58.9837  2311.88     66.8165  238.416    104.047     3.14384     284.047     
1 1 1 12 9  51 o 3  138.678 2.46329 329.751     15.3432  352.897     18.8031  77.7254    218.224     20.75       38.224      
1 1 1 12 9  52 o 13 97.0437 2.57269 152.464     11.8096  182.83      13.1789  61.5505    62.9162     17.3781     62.9162     
1 1 1 12 9  53 f 0  186.628 2.52215 581.75      23.3289  655.241     23.8127  103.993    278.126     0           0           
1 1 1 12 9  54 o 14 282.418 3.11661 1404.52     41.7386  1428.31     46.394   186.453    239.917     1.80033     59.9171     
1 1 1 12 9  55 o 14 293.437 3.2341  1582.32     49.5892  1478.07     45.5382  184.261    347.06      20.4548     167.06      
1 1 1 12 9  56 o 14 177.286 2.60437 598.523     24.9832  518.909     21.3219  116.535    52.3485     2.35085     52.3485     
1 1 1 12 9  57 o 6  54.8431 3.31967 53.7342     9.54053  54.0093     8.4942   8.0841     237.667     80.2053     237.667     
1 1 1 12 9  58 o 5  81.739  3.10023 112.519     13.5598  125.94      11.5046  51.2922    2.55288     8.25657     2.55288     
1 1 1 12 9  59 o 9  189.959 2.90584 630.998     28.9828  652.259     26.2205  127.077    192.482     7.75395     192.482     
1 1 1 12 9  60 o 12 52.2108 3.95628 60.8797     10.95    38.7734     9.31032  15.4826    352.179     23.9321     172.179     
1 1 1 12 9  61 o 6  134.635 3.01086 323.095     20.9397  322.97      19.6162  92.4356    0.788946    14.1266     0.788946    
1 1 1 12 9  62 o 12 32.3244 5.19544 24.892      8.95719  14.6692     7.63685  0.0267621  247.878     2.76461     67.8774     
1 1 1 12 9  63 o 12 91.3871 3.00367 138.497     14.5667  160.242     12.5872  55.4683    327.931     0.217211    147.931     
1 1 1 12 9  64 o 16 57.0048 3.66735 58.3274     10.7802  58.8714     9.91791  30.9689    295.252     2.05823     295.252     
1 1 1 12 9  65 f 0  89.9321 3.04973 155.577     13.3389  134.183     13.9559  63.7749    239.758     0           0           
1 1 1 12 9  66 o 14 74.0542 3.1269  96.5886     11.6668  100.11      11.4274  32.5206    351.039     27.0954     171.039     
1 1 1 12 9  67 o 5  66.722  3.40629 83.556      11.0761  76.8793     11.5087  56.2867    91.2415     37.3516     91.2415     
1 1 1 12 9  68 o 19 64.1901 3.53483 85.8231     10.9662  63.851      11.3231  37.2375    170.332     3.17789     350.332     
1 1 1 12 9  69 o 13 25.2504 5.75415 10.5647     8.2591   12.4987     8.32483  1.75188    292.448     1.95714     112.448     
1 1 1 12 9  70 f 0  43.5349 4.50008 38.0566     9.49526  32.3553     9.50321  36.0879    219.417     0           0           
1 1 1 12 9  71 o 10 19.3073 5.21855 0.473045    7.43801  7.99541     7.22482  0.548897   121.68      8.55635     121.68      
1 1 1 12 9  72 o 19 157.917 2.5057  451.343     19.4587  440.761     20.1832  120.636    286.078     44.2225     286.078     
1 1 1 12 9  73 o 15 52.9676 3.19598 51.8267     8.76909  49.9042     8.03017  36.5101    323.452     12.2533     323.452     
1 1 1 12 9  74 o 17 42.8781 3.99428 39.2301     8.63897  29.1032     8.0275   19.8065    58.3524     9.64723     238.352     
1 1 1 12 9  75 o 7  62.2525 3.28638 71.3789     10.4481  69.4296     9.90763  23.515     48.8841     28.3721     228.884     
1 1 1 12 9  76 o 9  52.582  3.60775 60.4883     8.98864  41.8087     9.38999  23.5057    325.746     15.6898     145.746     
1 1 1 12 9  77 o 2  26.7662 5.89345 15.3231     7.71095  11.6911     10.1816  6.50242    196.131     15.0216     16.1315     
1 1 1 12 9  78 o 1  17.3228 5.26187 1.95555     7.03743  -1.5424     9.56685  1.09479    29.537      5.24951     209.537     
1 1 1 12 9  79 o 19 34.6952 5.76054 24.1435     9.38373  24.0415     10.3088  10.4118    349.871     18.1526     169.871     
1 1 1 12 9  80 o 9  34.1491 6.12084 20.3805     9.6267   27.3792     11.3975  14.437     237.12      8.06598     57.1202     
1 1 1 12 9  81 o 13 25.2522 6.27382 15.6892     9.2474   6.19029     11.5485  7.68357    28.7718     6.06982     208.772     
1 1 1 12 9  82 o 2  30.9613 6.56009 17.9811     9.58552  21.8701     12.3928  13.4514    272.225     3.99381     272.225     
1 1 1 12 9  83 o 16 36.8213 7.38157 25.6371     12.7985  33.1473     15.7123  21.604     197.914     8.4485      197.914     
1 1 1 12 9  84 o 9  25.2235 6.83629 10.6608     12.0465  10.9604     12.1504  5.78572    39.1277     13.1722     219.128     
1 1 1 12 9  85 o 13 35.7268 7.08069 26.8156     13.2932  28.084      13.0845  16.2213    21.5169     5.849       201.517     
1 1 1 12 9  86 o 13 41.5515 6.789   41.7398     14.017   32.3688     13.778   16.6809    266.872     12.8153     86.8724     
1 1 1 12 9  87 o 14 30.284  7.41291 25.8934     13.7186  13.3407     14.7418  8.78378    274.158     13.2699     94.1578     
1 1 1 12 9  88 o 1  35.4738 7.7955  41.2598     16.4008  18.6656     15.9502  17.327     88.5027     0.759705    88.5027     
1 1 1 12 9  89 o 15 21.8394 6.78995 0.656175    14.3185  5.71238     14.4886  1.56027    202.716     3.50539     22.7162     
1 1 1 12 9  90 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 10 0  o 16 151.748 2.42935 408.654     18.4532  408.654     18.4532  53.2482    360         33.9292     180         
1 1 1 12 10 1  o 16 835.304 7.23213 12331.4     302.736  12421.2     302.744  675.268    269.438     147.716     269.438     
1 1 1 12 10 2  o 11 940.486 8.27827 15781.3     398.612  15608.5     381.624  695.115    257.67      32.0317     257.67      
1 1 1 12 10 3  o 10 280.946 3.12399 1397.84     43.0132  1399.74     44.9348  168.307    58.4516     39.598      238.452     
1 1 1 12 10 4  o 12 354.592 3.71383 2235.98     65.9924  2220.94     65.9971  290.897    251.263     101.691     251.263     
1 1 1 12 10 5  o 12 534.194 4.97985 5070.35     136.193  5047.28     130.384  378.579    240.211     2.11433     60.2119     
1 1 1 12 10 6  o 14 335.873 3.49599 1992.96     57.5603  2005.71     60.1086  224.721    8.10309     9.90464     188.103     
1 1 1 12 10 7  o 9  1019.42 8.70355 18443.6     444.641  18444.7     444.644  789.081    206.714     106.958     206.714     
1 1 1 12 10 8  o 16 1167    9.91146 24055.2     579.637  24313.1     579.661  842.624    243.096     1.44252     63.0945     
1 1 1 12 10 9  o 7  436.974 4.23144 3372.28     94.642   3396.93     90.6241  346.327    297.552     84.3919     297.552     
1 1 1 12 10 10 o 16 494.067 4.77565 4275.38     112.797  4379.61     123.562  384.105    41.0001     72.6634     41.0001     
1 1 1 12 10 11 f 0  516.63  5.05728 4733.92     134.016  4730.04     127.783  332.987    210.622     0           0           
1 1 1 12 10 12 o 13 24.2904 4.28243 11.6928     5.19961  10.0542     5.20356  105.309    275.094     216.159     275.094     
1 1 1 12 10 13 o 19 602.478 5.60523 6439.24     169.237  6433.71     169.237  450.913    288.58      44.1543     288.58      
1 1 1 12 10 14 o 4  391.722 3.97509 2711.9      78.0356  2727.93     78.0325  271.418    325.48      2.80588     145.48      
1 1 1 12 10 15 o 7  380.255 3.732   2559.95     71.1148  2565.87     71.1205  378.343    60.4775     252.038     60.4775     
1 1 1 12 10 16 o 3  443.321 4.18192 3508.13     92.9075  3459.86     92.906   401.4      352.397     187.122     352.397     
1 1 1 12 10 17 o 3  456.834 4.27627 3706.97     97.9016  3692.55     97.8988  302.335    10.5542     40.0903     190.554     
1 1 1 12 10 18 o 13 224.553 2.79506 891.271     32.1313  896.016     30.7573  175.822    24.7849     106.27      24.7849     
1 1 1 12 10 19 o 13 39.551  3.35272 30.9433     6.44012  25.4453     6.51597  90.6141    182.071     200.615     182.071     
1 1 1 12 10 20 o 1  896.023 8.03034 14232.4     360.582  14283.8     360.596  710.961    253.278     139.919     253.278     
1 1 1 12 10 21 o 6  456.191 4.46358 3696.25     102.045  3683.98     102.044  386.97     313.518     133.399     313.518     
1 1 1 12 10 22 o 15 384.494 4.00322 2629.37     75.278   2612.76     78.9393  237.722    15.5556     64.3734     195.556     
1 1 1 12 10 23 o 14 268.656 3.12143 1264.38     42.028   1294.41     42.0182  148.488    204.615     72.2554     24.6148     
1 1 1 12 10 24 o 6  365.164 3.78563 2387.81     69.2811  2340.61     69.267   271.427    137.668     33.9907     137.668     
1 1 1 12 10 25 o 17 381.577 3.85938 2587.68     68.8114  2575.61     78.451   218.26     163.653     99.2298     343.653     
1 1 1 12 10 26 o 3  203.773 2.57041 731.567     25.7109  740.381     26.7816  137.852    109.168     8.19885     109.168     
1 1 1 12 10 27 o 19 306.068 3.18462 1666.99     47.8547  1654.46     49.8114  187.606    278.095     49.52       98.0954     
1 1 1 12 10 28 o 17 399.673 3.80618 2826.3      74.6881  2839.11     77.7579  280.048    316.391     0.433676    316.394     
1 1 1 12 10 29 o 18 248.937 2.82935 1126.14     34.5575  1071.28     35.9703  173.588    157.002     9.18819     157.002     
1 1 1 12 10 30 o 13 345.18  3.39249 2108.87     57.4984  2116.62     59.8513  213.539    225.092     53.2055     45.0925     
1 1 1 12 10 31 o 6  298.029 3.09532 1567.48     45.2933  1582.21     47.1561  138.226    188.763     136.601     8.76259     
1 1 1 12 10 32 o 10 39.2344 3.24331 24.4517     5.92686  31.0867     6.57472  61.8174    274.108     147.91      274.108     
1 1 1 12 10 33 o 16 361.595 3.66312 2301.82     64.9144  2336.61     67.8318  266.135    150.339     32.3116     150.339     
1 1 1 12 10 34 o 1  114.835 2.43156 227.597     13.9502  240.441     13.9981  38.0664    306.249     59.8647     126.249     
1 1 1 12 10 35 o 4  120.381 2.53675 264.946     15.7006  249.444     14.876   12.91      200.292     128.134     20.2915     
1 1 1 12 10 36 o 12 538.812 5.51742 5202.33     152.895  5114.51     145.023  419.05     290.125     87.4499     290.125     
1 1 1 12 10 37 o 3  349.262 3.67393 2151.54     64.3135  2176.77     64.2942  197.87     234.782     87.7988     54.7817     
1 1 1 12 10 38 o 6  345.178 3.53368 2079.59     61.1229  2148.19     61.1181  298.255    324.576     121.918     324.576     
1 1 1 12 10 39 o 13 276.328 3.15124 1354.86     44.5816  1353.83     42.6748  216.675    195.68      56.3309     195.68      
1 1 1 12 10 40 o 19 369.149 3.68477 2425.01     68.1734  2411.28     68.1601  314.314    102.865     121.859     102.865     
1 1 1 12 10 41 o 10 369.325 3.88916 2388.22     71.9688  2454.08     71.9858  363.394    128.773     223.617     128.773     
1 1 1 12 10 42 o 3  34.8854 3.6765  17.4923     6.11403  27.1803     6.11357  11.0451    168.253     30.3576     168.253     
1 1 1 12 10 43 o 6  333.43  3.46628 1950.06     57.9209  1995.77     57.9133  221.944    70.8022     11.2186     250.802     
1 1 1 12 10 44 o 10 106.64  2.35067 198.065     12.7772  205.641     12.2998  67.681     340.364     22.1185     340.364     
1 1 1 12 10 45 o 12 331.861 3.58359 1979.24     58.1342  1930.47     60.9855  249.122    250.565     48.2858     250.565     
1 1 1 12 10 46 o 11 424.706 4.14441 3219.87     82.2405  3187.73     93.7386  334.318    22.6834     91.2208     22.6834     
1 1 1 12 10 47 o 2  135.457 2.35785 319.022     15.6451  331.781     16.368   69.7492    135.844     33.4489     315.844     
1 1 1 12 10 48 o 5  162.88  2.44465 463.262     19.5241  477.78      20.3857  100.804    300         9.7526      120         
1 1 1 12 10 49 o 14 283.467 3.12499 1429.8      42.4308  1422.2      46.2609  191.856    197.994     3.86526     197.994     
1 1 1 12 10 50 o 17 118.912 2.53296 241.283     14.2202  261.003     15.9351  82.9608    348.923     23.9027     348.923     
1 1 1 12 10 51 o 2  312.891 3.3454  1726.51     50.1865  1750.33     54.6601  208.209    69.3322     2.6455      249.332     
1 1 1 12 10 52 o 3  106.024 2.41129 186.397     12.4901  213.313     13.0899  60.1442    9.31285     10.5205     189.313     
1 1 1 12 10 53 o 7  66.819  2.69101 71.2599     8.6207   88.1918     9.30907  26.1363    185.308     20.0656     5.30826     
1 1 1 12 10 54 o 7  206.366 2.57093 711.271     25.8481  801.849     27.3246  150.073    264.226     28.6073     264.226     
1 1 1 12 10 55 o 8  316.123 3.39566 1754.87     56.0539  1798.88     51.3674  213.983    214.083     8.0102      214.083     
1 1 1 12 10 56 o 8  94.9809 2.88715 150.477     13.8324  171.014     13.5226  58.954     288.938     1.98689     288.938     
1 1 1 12 10 57 o 18 109.187 3.32373 198.191     17.8318  227.299     18.4277  73.7764    118.125     11.4771     118.125     
1 1 1 12 10 58 o 16 123.713 2.98095 269.269     19.2937  275.756     17.5489  85.4205    210.754     14.1527     210.754     
1 1 1 12 10 59 o 14 136.913 3.0869  326.839     20.8012  341.186     21.5069  92.506     326.288     9.87478     326.288     
1 1 1 12 10 60 o 16 62.9787 3.86333 72.3105     10.7408  70.4113     13.217   34.0221    92.4442     0.083595    272.444     
1 1 1 12 10 61 o 15 116.443 3.18059 217.44      17.6079  268.019     19.4358  94.6054    217.081     45.4932     217.081     
1 1 1 12 10 62 o 9  71.9364 3.35677 85.5792     10.8601  100.26      13.2205  36.6201    13.2884     11.5666     193.288     
1 1 1 12 10 63 o 5  79.0213 3.09503 114.704     11.3076  108.817     12.9933  23.6786    164.366     50.7333     344.366     
1 1 1 12 10 64 o 7  61.4657 3.35679 61.1586     10.1244  75.0656     10.3258  37.2474    216.268     3.24816     216.268     
1 1 1 12 10 65 o 4  28.3185 5.28531 11.9022     7.52183  18.3028     7.85991  2.03093    190.691     23.1998     10.691      
1 1 1 12 10 66 o 19 91.6973 2.84691 147.496     12.6961  153.458     13.4056  72.7697    138.188     31.8144     138.188     
1 1 1 12 10 67 o 11 47.1284 3.92277 47.7129     9.39944  33.958      8.65685  30.7537    316.759     10.7681     316.759     
1 1 1 12 10 68 o 18 151.819 2.75893 420.019     20.9008  404.96      21.0376  118.75     45.0446     45.3892     45.0446     
1 1 1 12 10 69 o 15 18.2806 5.16454 -1.78991    7.97622  6.26722     7.03727  1.89665    352.063     11.1308     352.063     
1 1 1 12 10 70 o 5  68.4539 3.33751 90.2433     11.6887  79.3845     11.0653  48.687     321.835     14.8676     321.835     
1 1 1 12 10 71 f 0  54.7639 3.78128 62.8336     10.5769  47.2519     9.83179  37.989     87.1255     0           0           
1 1 1 12 10 72 o 9  24.0854 5.63238 11.0243     7.99437  9.86457     7.82701  3.46225    16.9413     31.6139     16.9413     
1 1 1 12 10 73 o 1  22.9389 5.62046 9.98607     7.98648  8.16958     7.79401  3.53573    285.204     3.77323     105.204     
1 1 1 12 10 74 o 16 72.0964 3.09937 96.7842     10.6039  91.3456     11.6204  40.3617    185.82      7.16365     5.81961     
1 1 1 12 10 75 o 19 79.0352 2.75382 113.179     11.1991  112.153     10.5404  51.3482    135.662     6.35121     135.662     
1 1 1 12 10 76 o 7  56.2704 3.23699 58.149      9.44359  57.4499     8.63874  32.3558    103.548     2.4653      283.548     
1 1 1 12 10 77 o 13 13.0859 4.13863 1.9474      6.5804   -7.02981    4.71004  1.26629    53.043      6.03093     53.0431     
1 1 1 12 10 78 o 1  52.0232 3.94292 45.9711     9.8792   55.2389     10.3198  29.6394    208.331     1.84803     28.3312     
1 1 1 12 10 79 o 17 18.8973 5.38057 0.131444    8.0695   6.84143     7.98152  2.18541    179.285     5.61969     359.285     
1 1 1 12 10 80 o 13 24.4086 6.10139 17.6056     10.8693  4.07738     8.50181  6.81798    81.7275     7.53477     261.728     
1 1 1 12 10 81 o 5  28.1439 6.5004  17.9726     9.7837   13.4372     11.6832  5.9912     179.383     16.7524     359.383     
1 1 1 12 10 82 o 11 24.378  6.69388 -2.11798    13.4075  16.3226     12.0959  6.26504    351.131     7.29736     171.131     
1 1 1 12 10 83 o 7  39.3958 6.91518 29.5111     14.019   36.1231     13.2812  25.2258    199.074     9.83734     199.074     
1 1 1 12 10 84 o 3  79.1646 4.55592 121.762     18.4022  117.188     17.4337  52.6159    174.301     12.4262     174.301     
1 1 1 12 10 85 o 13 24.7064 6.89264 11.617      12.7518  8.41758     12.4541  7.34354    176.365     1.22688     176.365     
1 1 1 12 10 86 f 0  69.3641 5.02622 87.4231     17.561   102.382     16.6386  28.1654    101.575     0           0           
1 1 1 12 10 87 o 19 26.5347 7.56006 12.9044     13.1918  13.6144     17.9025  6.27181    190.189     11.7966     10.1888     
1 1 1 12 10 88 o 19 38.7429 7.96814 26.0522     17.3256  47.8481     16.9977  19.6164    282.621     1.11728     282.621     
1 1 1 12 10 89 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 11 0  o 18 115.271 2.36285 236.037     13.6236  236.037     13.6236  0.675652   8.42068e-06 92.1023     180         
1 1 1 12 11 1  o 3  876.977 7.91795 13699.8     347.986  13596.1     347.981  679.962    140.985     93.44       140.985     
1 1 1 12 11 2  o 4  330.821 3.48008 1942.98     56.4222  1936.4      58.9372  300.571    210.673     169.509     210.673     
1 1 1 12 11 3  o 17 260.518 2.9602  1208.65     38.6502  1196.93     38.6439  166.517    81.5655     9.40167     261.566     
1 1 1 12 11 4  f 0  478.366 4.64759 4039.35     111.417  4074.09     111.414  284.193    39.8747     0           0           
1 1 1 12 11 5  o 11 244.275 2.97493 1060.76     36.4185  1054.2      36.4172  155.536    32.5493     4.26507     212.549     
1 1 1 12 11 6  o 7  219.31  2.73264 847.239     30.0298  857.465     30.0357  93.3487    231.356     99.9764     51.3562     
1 1 1 12 11 7  o 5  576.393 5.18718 5915.22     149.832  5866.04     149.834  404.552    29.2007     15.2541     209.201     
1 1 1 12 11 8  o 19 690.554 6.0715  8411.47     210.107  8503.63     210.116  513.602    145.971     35.2392     145.971     
1 1 1 12 11 9  f 0  203.571 2.69478 729.393     28.0683  739.43      26.8933  90.683     128.557     0           0           
1 1 1 12 11 10 o 19 580.078 5.46294 5945.23     151.444  5988.79     165.895  457.617    268.654     87.4201     268.654     
1 1 1 12 11 11 o 15 178.945 2.57778 581.481     23.6396  553.619     22.5972  44.3923    102         140.886     282         
1 1 1 12 11 12 o 16 346.323 3.57807 2100.7      63.4154  2151.29     60.7164  302.291    51.7672     132.714     51.7672     
1 1 1 12 11 13 o 15 103.053 2.43698 178.414     12.5513  198.676     12.5568  4.37289    43.4718     33.3311     223.472     
1 1 1 12 11 14 o 16 461.869 4.5115  3780.59     104.424  3783.79     104.424  275.94     176.124     104.977     356.124     
1 1 1 12 11 15 o 18 429.665 4.36568 3245.2      96.189   3301.1      91.7207  333.251    95.5821     60.8303     95.5821     
1 1 1 12 11 16 o 14 316.178 3.27888 1781.22     51.9499  1762.65     51.9565  173.636    286.981     94.3716     106.981     
1 1 1 12 11 17 o 13 303.632 3.20503 1638.73     48.7701  1629.47     48.7666  189.798    212.836     42.1896     32.836      
1 1 1 12 11 18 o 8  309.636 3.24603 1690.75     50.3677  1708.11     50.3698  218.671    330.574     8.40907     330.574     
1 1 1 12 11 19 o 8  467.137 4.37162 3868.99     102.34   3869.88     102.34   318.299    140.856     26.528      320.856     
1 1 1 12 11 20 o 3  386.222 3.77386 2646.32     73.0403  2642.88     73.0473  257.33     179.765     29.5652     359.765     
1 1 1 12 11 21 o 1  395.739 3.83201 2793.98     75.9973  2759.45     75.9944  226.322    125.744     106.794     305.744     
1 1 1 12 11 22 f 0  426.386 4.15129 3222.59     90.6133  3225.29     86.7525  342.547    256.027     0           0           
1 1 1 12 11 23 o 9  540.095 5.00976 5188.23     138.525  5161.95     132.617  292.486    98.9397     183.934     278.94      
1 1 1 12 11 24 o 1  209.427 2.83595 788.057     29.0622  766.907     30.4274  140.88     27.1594     2.50796     27.1595     
1 1 1 12 11 25 o 19 58.6515 2.83047 58.3501     8.16396  64.2456     8.36897  62.4624    152.203     182.467     152.203     
1 1 1 12 11 26 o 6  192.636 2.68253 651.293     25.8906  664.319     25.9009  150.904    329.759     54.6795     329.759     
1 1 1 12 11 27 o 3  136.046 2.57329 332.912     17.5467  323.748     17.5082  69.1283    223.71      26.8492     43.7097     
1 1 1 12 11 28 f 0  111.63  2.39742 219.6       13.0902  222.572     13.6991  41.0045    133.671     0           0           
1 1 1 12 11 29 o 8  284.844 3.1234  1444.07     42.659   1433.18     46.4183  200.761    277.543     9.36538     277.543     
1 1 1 12 11 30 o 5  699.847 6.43263 8691.1      215.098  8721.51     235.675  463.274    98.4668     62.9413     278.467     
1 1 1 12 11 31 o 1  528.359 4.8865  4907.71     126.551  5004.47     132.205  327.711    330.989     88.0336     150.989     
1 1 1 12 11 32 o 4  305.033 3.28259 1642.65     49.074   1657.58     51.2697  223.173    43.4483     26.1895     43.4483     
1 1 1 12 11 33 o 11 147.783 2.38875 395.31      17.688   379.085     17.6885  95.6069    339.993     7.61419     339.993     
1 1 1 12 11 34 o 1  258.523 2.99726 1169.06     39.633   1201.36     37.9844  177.363    57.8232     0.71332     57.8231     
1 1 1 12 11 35 o 7  181.632 2.5858  593.215     23.0026  576.641     24.0414  71.2489    274.314     103.665     94.3141     
1 1 1 12 11 36 o 5  411.892 4.21624 3006.42     84.9216  3016.38     89.095   347.885    106.794     123.411     106.794     
1 1 1 12 11 37 o 12 499.732 4.8123  4444.13     120.514  4427.38     120.521  336.924    80.9167     23.1832     260.917     
1 1 1 12 11 38 o 18 343.812 3.76656 2130.77     63.3023  2064.92     66.3943  198.271    166.702     79.7433     346.702     
1 1 1 12 11 39 o 5  263.435 3.21485 1238.32     39.3292  1223.85     45.3066  160.326    38.1897     40.4788     218.19      
1 1 1 12 11 40 o 1  242.748 3.0811  1054.89     36.5858  1035.71     38.339   126.147    173.769     79.3457     353.769     
1 1 1 12 11 41 o 11 103.655 2.22721 188.131     11.3624  193.213     11.7499  56.6163    159.603     7.63249     339.603     
1 1 1 12 11 42 o 1  125.182 2.2522  273.043     13.8782  283.035     14.3578  76.8445    253.361     2.1491      73.361      
1 1 1 12 11 43 o 6  216.225 2.65876 833.581     28.8153  824.784     28.8045  183.605    52.8216     81.0296     52.8216     
1 1 1 12 11 44 o 7  198.029 2.6593  687.739     26.3737  703.35      26.4063  95.6009    307.27      74.4847     127.27      
1 1 1 12 11 45 o 18 127.902 2.66633 279.063     17.0914  301.971     17.0293  97.2186    340.095     45.3792     340.095     
1 1 1 12 11 46 o 18 343.208 3.47347 2111.12     62.2031  2070.74     57.221   229.631    204.474     7.00848     24.4736     
1 1 1 12 11 47 o 7  270.443 3.01907 1308.42     42.6192  1287.18     39.169   190.628    67.4796     17.4838     67.4796     
1 1 1 12 11 48 o 15 329.288 3.33066 1927.05     56.0493  1922.56     53.8563  213.594    89.63       17.9845     269.63      
1 1 1 12 11 49 o 6  153.687 2.3828  428.643     18.4355  409.332     18.2648  55.1521    284.697     92.068      104.697     
1 1 1 12 11 50 o 17 239.281 3.03575 1015.76     37.3027  1016.97     35.4788  145.016    82.5689     29.9275     262.569     
1 1 1 12 11 51 o 9  84.9397 2.7617  127.194     11.6856  129.452     11.7627  6.34959    13.2732     120.622     13.2732     
1 1 1 12 11 52 o 10 159.878 2.82434 459.453     21.948   448.452     23.2517  91.2435    110.097     27.8014     290.097     
1 1 1 12 11 53 o 14 212.87  3.00087 790.356     31.9281  819.524     32.0922  147.228    351.035     12.4213     351.035     
1 1 1 12 11 54 o 17 207.828 3.19453 778.636     32.2928  756.902     34.1903  150.886    82.0175     27.5473     82.0176     
1 1 1 12 11 55 o 18 231.728 2.97199 952.209     33.4793  956.454     35.5211  165.801    247.586     25.338      247.586     
1 1 1 12 11 56 o 12 130.569 2.58206 298.217     16.031   307.973     17.708   57.1821    110.124     55.1246     290.124     
1 1 1 12 11 57 o 14 42.2406 3.96796 27.1813     7.64705  38.0325     8.6911   0.693711   28.0436     40.1043     208.044     
1 1 1 12 11 58 o 18 84.4133 3.11881 135.553     13.0315  119.102     13.2078  40.0186    212.881     24.5494     32.8815     
1 1 1 12 11 59 o 13 41.4499 4.30677 27.3628     8.47233  35.6866     8.80223  6.62878    231.752     23.5759     51.7516     
1 1 1 12 11 60 o 2  43.2691 4.05972 39.7854     8.51997  28.8153     8.45348  9.00576    255.582     22.2402     75.5823     
1 1 1 12 11 61 o 2  58.2826 3.49019 62.2063     10.1183  60.0194     10.0763  21.7976    60.2701     22.6334     240.27      
1 1 1 12 11 62 o 19 66.0482 3.30563 83.1975     10.851   73.5439     10.8558  45.1385    80.1337     18.8734     80.1337     
1 1 1 12 11 63 o 6  51.6247 3.66269 48.3247     9.07989  48.0708     9.6052   22.5645    357.013     14.3637     177.013     
1 1 1 12 11 64 o 17 85.663  2.90711 134.839     12.0976  127.8       12.7547  61.2176    248.85      15.275      248.85      
1 1 1 12 11 65 o 16 15.205  4.59267 -13.4045    6.6462   5.14171     7.44808  8.12519    96.9377     23.7154     96.9377     
1 1 1 12 11 66 o 4  63.4764 3.41525 62.0612     10.1564  84.2245     11.3629  51.6792    60.1479     29.9404     60.1479     
1 1 1 12 11 67 o 15 59.9557 3.54149 68.1681     9.88645  62.1065     11.0772  36.6436    104.24      0.968134    104.24      
1 1 1 12 11 68 o 1  51.6249 3.86365 49.3481     10.081   48.0057     9.60651  28.5597    297.022     3.98344     117.022     
1 1 1 12 11 69 o 7  26.3042 5.40305 3.7         9.02274  20.0762     7.94417  5.96527    61.013      9.44013     241.013     
1 1 1 12 11 70 o 15 29.4376 5.21176 28.8142     9.14625  4.20268     8.24252  10.4557    235.666     5.34964     55.6656     
1 1 1 12 11 71 o 19 32.2741 5.64634 19.8194     9.52585  20.3887     8.6496   13.7339    219.609     4.29436     39.6094     
1 1 1 12 11 72 o 7  76.2713 3.33062 106.977     12.348   103.822     12.9676  44.0844    167.252     5.5822      347.252     
1 1 1 12 11 73 o 6  16.9244 5.10796 -5.10511    8.33345  3.61355     7.61337  0.807908   27.3792     9.96881     27.3792     
1 1 1 12 11 74 o 18 90.5005 3.0167  158.915     13.9416  137.733     13.3284  37.6923    303.873     36.641      123.873     
1 1 1 12 11 75 o 12 31.6653 5.62731 19.6929     9.15428  19.7907     8.68506  17.7444    345.966     7.51878     345.966     
1 1 1 12 11 76 o 16 13.302  4.3038  -3.222      6.55166  -4.43286    6.33197  0.502591   18.8833     2.69615     18.8833     
1 1 1 12 11 77 o 4  19.3419 5.20828 9.31756     7.25222  -0.872333   7.78348  3.02202    52.8897     4.65686     232.89      
1 1 1 12 11 78 o 3  62.1247 4.02139 62.1252     12.0203  82.9072     12.5908  33.3876    128.55      7.48373     308.55      
1 1 1 12 11 79 o 10 41.6487 5.06489 40.3896     10.0932  27.8376     10.0934  19.8051    302.56      7.77438     122.56      
1 1 1 12 11 80 o 2  49.4071 4.49199 44.6319     10.8857  48.7074     10.8173  34.3478    300.99      13.5291     300.99      
1 1 1 12 11 81 o 13 59.6972 5.23906 70.8935     14.2141  68.2335     16.2758  35.0494    81.1355     0.65938     81.1356     
1 1 1 12 11 82 o 5  32.6419 7.08007 17.2345     13.0724  27.6265     12.8323  14.886     294.527     3.95976     114.527     
1 1 1 12 11 83 o 1  21.6016 6.39699 2.37318     11.7673  6.13696     11.5892  3.07472    158.775     14.0912     338.775     
1 1 1 12 11 84 o 11 22.7024 6.61372 7.60485     12.2127  5.13042     12.114   6.52282    312.063     1.65216     132.063     
1 1 1 12 11 85 o 8  31.2518 6.91162 8.61574     13.0444  32.4739     13.3812  16.51      340.686     5.96653     340.686     
1 1 1 12 11 86 o 9  34.6658 7.42385 28.0974     14.1878  27.4655     13.821   17.4085    13.0687     0.709915    13.0686     
1 1 1 12 11 87 o 3  26.4775 7.48978 8.91179     16.2463  17.6896     14.5288  7.11511    24.5255     2.11573     204.526     
1 1 1 12 11 88 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 12 12 0  o 1  406.007 5.55319 2924.63     112.894  2924.63     112.894  435.217    1.5587e-05  300.098     1.5587e-05  
1 1 1 12 12 1  f 0  489.394 4.7371  4247.41     116.131  4247.41     116.131  310.639    30          0           0           
1 1 1 12 12 2  o 8  194.644 2.61216 672.066     25.4594  672.066     25.4594  125.888    60          24.1812     240         
1 1 1 12 12 3  o 5  271.21  3.15732 1304.51     42.8863  1304.51     42.8863  282.561    90          186.271     90          
1 1 1 12 12 4  o 3  735.906 6.74588 9606.97     248.689  9606.97     248.689  604.507    300         136.469     300         
1 1 1 12 12 5  o 6  302.61  3.32863 1623.95     50.4514  1623.95     50.4514  229.354    150         17.8338     150         
1 1 1 12 12 6  o 2  199.019 2.62718 702.597     26.182   702.597     26.182   48.9718    5.49889e-07 191.594     180         
1 1 1 12 12 7  o 15 1319.43 11.6535 30928.3     770.287  30928.3     770.287  924.993    210         71.2634     30          
1 1 1 12 12 8  o 19 54.4966 2.79076 53.4505     7.52797  53.4505     7.52797  118.308    240         286.599     240         
1 1 1 12 12 9  o 12 738.856 6.46434 9683.83     239.274  9683.83     239.274  676.662    90          278.412     90          
1 1 1 12 12 10 o 15 134.678 2.48569 322.063     16.7507  322.063     16.7507  47.2812    120         4.52609     120         
1 1 1 12 12 11 o 15 257.521 3.06917 1176.21     39.5836  1176.21     39.5836  173.831    330         26.5033     150         
1 1 1 12 12 12 o 14 648.39  5.7334  7456.94     186.233  7456.94     186.233  496.453    180         51.2495     180         
1 1 1 12 12 13 o 19 105.555 2.35015 198.021     12.4039  198.021     12.4039  23.0713    210         32.1419     30          
1 1 1 12 12 14 o 8  231.252 2.79172 948.497     32.332   948.497     32.332   158.432    60          18.3038     240         
1 1 1 12 12 15 o 19 331.535 3.71627 1949.53     61.7095  1949.53     61.7095  85.7321    270         308.949     90          
1 1 1 12 12 16 o 8  936.021 8.34275 15554.6     391.201  15554.6     391.201  696.607    120         38.0289     120         
1 1 1 12 12 17 o 4  379.795 3.74684 2558.04     71.2828  2558.04     71.2828  286.812    330         24.2525     330         
1 1 1 12 12 18 o 15 290.288 3.10558 1494.41     45.1552  1494.41     45.1552  238.547    180         57.606      180         
1 1 1 12 12 19 o 2  174.749 2.51065 541.817     21.9664  541.817     21.9664  155.829    30          82.1282     30          
1 1 1 12 12 20 o 18 620.554 5.51698 6831.72     171.509  6831.72     171.509  618.633    60          342.388     60          
1 1 1 12 12 21 o 4  392.187 3.83747 2727.91     75.3896  2727.91     75.3896  323.363    270         81.809      270         
1 1 1 12 12 22 o 1  17.4497 5.61802 7.8428      5.32432  7.8428      5.32432  60.4276    300         124.695     300         
1 1 1 12 12 23 o 19 120.849 2.31441 259.375     13.9934  259.375     13.9934  2.34686    150         177.442     150         
1 1 1 12 12 24 o 1  319.509 3.45196 1810.74     55.2436  1810.74     55.2436  280.747    360         102.976     360         
1 1 1 12 12 25 o 16 228.328 2.80987 924.802     32.13    924.802     32.13    220.021    30          113.444     30          
1 1 1 12 12 26 o 16 157.47  2.59773 440.178     20.4748  440.178     20.4748  130.321    240         44.0969     240         
1 1 1 12 12 27 o 9  359.401 3.96199 2291.68     71.3206  2291.68     71.3206  258.924    90          4.26031     90          
1 1 1 12 12 28 o 13 153.795 2.66401 419.957     20.5045  419.957     20.5045  132.26     300         70.8388     300         
1 1 1 12 12 29 o 13 236.595 3.18215 993.309     37.6993  993.309     37.6993  148.708    150         39.6355     330         
1 1 1 12 12 30 o 19 431.28  4.95648 3301.75     107.062  3301.75     107.062  183.124    180         247.15      8.65139e-06 
1 1 1 12 12 31 o 3  161.009 2.48516 460.103     20.0307  460.103     20.0307  64.8777    210         98.8144     30          
1 1 1 12 12 32 o 19 805.407 7.63881 11531.1     308.195  11531.1     308.195  571.897    240         2.20424     240         
1 1 1 12 12 33 f 0  132.4   2.55831 311.389     16.9461  311.389     16.9461  31.1211    270         0           0           
1 1 1 12 12 34 o 8  57.5352 2.72007 59.4567     7.76117  59.4567     7.76117  50.7466    120         178.722     120         
1 1 1 12 12 35 o 19 320.02  3.47232 1817.01     55.6579  1817.01     55.6579  244.349    150         37.6139     150         
1 1 1 12 12 36 o 5  187.531 2.54063 624.018     23.857   624.018     23.857   136.661    360         9.50653     360         
1 1 1 12 12 37 o 12 154.662 2.3321  424.534     18.057   424.534     18.057   32.22      210         152.699     30          
1 1 1 12 12 38 o 5  384.622 3.78704 2624.93     72.9635  2624.93     72.9635  279.829    60          20.7843     60          
1 1 1 12 12 39 o 13 311.794 3.34997 1724.88     52.317   1724.88     52.317   194.708    270         46.4924     90          
1 1 1 12 12 40 o 18 217.46  3.13468 839.453     34.1291  839.453     34.1291  207.141    300         110.932     300         
1 1 1 12 12 41 o 4  251.799 3.17841 1125.22     40.0786  1125.22     40.0786  121.116    330         108.248     150         
1 1 1 12 12 42 o 15 97.6252 2.65283 169.696     12.9351  169.696     12.9351  17.4818    180         100.039     8.50379e-06 
1 1 1 12 12 43 o 18 185.861 2.67566 613.14      24.8985  613.14      24.8985  206.407    29.9999     160.053     29.9999     
1 1 1 12 12 44 o 18 232.012 2.99819 955.358     34.834   955.358     34.834   181.372    60          42.0733     60          
1 1 1 12 12 45 o 11 203.011 3.04625 731.743     30.9603  731.743     30.9603  194.574    90          109.273     90          
1 1 1 12 12 46 o 6  49.8404 3.21216 45.136      7.86187  45.136      7.86187  40.1256    120         143.013     120         
1 1 1 12 12 47 o 11 153.763 2.59861 419.878     19.9983  419.878     19.9983  86.6427    330         37.6349     150         
1 1 1 12 12 48 o 18 36.3555 4.69663 25.673      7.71267  25.673      7.71267  5.06946    180         18.7049     180         
1 1 1 12 12 49 o 8  146.247 2.38871 379.794     17.4858  379.794     17.4858  44.4384    30          110.673     210         
1 1 1 12 12 50 o 12 518.541 4.68498 4778.79     121.7    4778.79     121.7    391.517    240         77.4297     240         
1 1 1 12 12 51 o 8  114.204 2.37208 231.853     13.5494  231.853     13.5494  57.3466    90          40.2727     270         
1 1 1 12 12 52 f 0  52.5049 3.01495 49.867      7.80881  49.867      7.80881  55.6688    300         0           0           
1 1 1 12 12 53 o 18 295.035 2.93681 1545.37     43.4026  1545.37     43.4026  181.783    150         34.4878     330         
1 1 1 12 12 54 f 0  218.008 2.65249 843.91      28.9599  843.91      28.9599  103.998    2.15575e-06 0           0           
1 1 1 12 12 55 o 19 340.246 3.44581 2057.34     58.7279  2057.34     58.7279  286.534    30          116.748     30          
1 1 1 12 12 56 o 3  187.257 2.62214 622.985     24.585   622.985     24.585   90.5572    240         69.2561     60          
1 1 1 12 12 57 o 15 168     2.62242 501.676     22.0543  501.676     22.0543  108.397    90          7.12819     270         
1 1 1 12 12 58 o 5  35.3522 5.68918 25.446      8.78469  25.446      8.78469  4.59474    300         47.2582     300         
1 1 1 12 12 59 o 1  39.9876 4.30457 30.3773     8.0341   30.3773     8.0341   1.07212    150         0.630739    330         
1 1 1 12 12 60 o 15 39.4551 5.14762 30.4441     9.15772  30.4441     9.15772  5.75617    7.45085e-06 4.51383     180         
1 1 1 12 12 61 o 15 87.1165 3.39093 136.264     14.7008  136.264     14.7008  77.1925    210         40.2033     210         
1 1 1 12 12 62 o 8  13.2753 5.83558 2.15847     7.80972  2.15847     7.80972  16.4568    240         39.2001     240         
1 1 1 12 12 63 o 11 13.9913 5.91645 3.74465     7.3708   3.74465     7.3708   4.49424    270         12.3248     270         
1 1 1 12 12 64 o 6  102.494 2.86156 187.775     14.6459  187.775     14.6459  68.7552    120         4.05986     120         
1 1 1 12 12 65 o 7  111.483 2.80782 222.026     15.6417  222.026     15.6417  76.312     330         7.98648     330         
1 1 1 12 12 66 o 8  41.3338 4.72955 32.9113     9.02767  32.9113     9.02767  0.430178   360         0.301105    360         
1 1 1 12 12 67 o 2  115.326 2.81046 237.759     16.1991  237.759     16.1991  98.4777    30          48.4197     30          
1 1 1 12 12 68 o 9  101.854 2.81555 185.709     14.3215  185.709     14.3215  76.5948    60          22.4933     60          
1 1 1 12 12 69 o 13 24.9932 7.24044 15.9096     8.94182  15.9096     8.94182  10.8331    90          52.9891     90          
1 1 1 12 12 70 o 17 7.42899 3.79731 -13.9055    7.36489  -13.9055    7.36489  0.203455   120.001     0.448759    120.001     
1 1 1 12 12 71 f 0  63.2152 3.68423 73.037      11.4829  73.037      11.4829  45.4565    330         0           0           
1 1 1 12 12 72 o 3  165.777 3.03955 492.071     25.2136  492.071     25.2136  127.35     360         45.2475     360         
1 1 1 12 12 73 o 15 37.0427 5.73739 28.1653     9.32509  28.1653     9.32509  28.6017    30          12.4226     30          
1 1 1 12 12 74 o 1  12.0959 5.56049 -0.160926   8.09526  -0.160926   8.09526  0.958745   240         3.51388     240         
1 1 1 12 12 75 o 3  22.8595 7.27649 14.1195     8.92647  14.1195     8.92647  8.45922    270         6.74688     90          
1 1 1 12 12 76 o 8  64.1965 3.65213 75.7348     11.569   75.7348     11.569   50.8024    120         21.8114     120         
1 1 1 12 12 77 o 10 23.0756 7.92684 15.0902     10.7414  15.0902     10.7414  4.1451     330         0.35499     330         
1 1 1 12 12 78 o 10 51.9029 4.43069 51.1272     11.079   51.1272     11.079   30.3991    3.91428e-09 3.16735     180         
1 1 1 12 12 79 o 14 40.1533 5.66389 32.9194     10.1173  32.9194     10.1173  31.6668    30          21.6472     30          
1 1 1 12 12 80 o 14 21.133  7.27585 12.6023     9.0567   12.6023     9.0567   3.01708    240         2.7405      60          
1 1 1 12 12 81 o 13 19.5035 7.90936 10.2617     12.2778  10.2617     12.2778  4.35304    90          30.8397     90          
1 1 1 12 12 82 o 11 22.1485 8.33768 14.3336     12.5368  14.3336     12.5368  1.63966    120         22.4825     300         
1 1 1 12 12 83 f 0  14.6159 6.95174 -3.5378     14.5152  -3.5378     14.5152  13.4256    330         0           0           
1 1 1 12 12 84 o 8  20.4232 8.59064 11.2714     15.3846  11.2714     15.3846  0.134701   8.68847e-06 23.0912     8.68839e-06 
1 1 1 12 12 85 o 15 19.4608 8.86086 6.30543     19.9055  6.30543     19.9055  2.44682    210         7.48046     30          
1 1 1 12 12 86 o 11 18.1571 8.08874 6.80976     15.5405  6.80976     15.5405  0.279164   240         3.36196     60          
1 1 1 12 12 87 o 18 34.7104 9.67706 34.2764     16.1686  34.2764     16.1686  10.1532    270         5.63825     270         
1 1 1 12 12 88 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 0  0  o 10 605.421 7.66846 6502.78     232.494  6502.78     232.494  549.098    180         223.688     180         
1 1 1 13 0  1  o 16 55.2264 2.20283 54.5564     6.0519   54.5564     6.0519   67.0162    60          149.943     60          
1 1 1 13 0  2  o 3  353.065 3.55104 2210.3      62.8019  2210.3      62.8019  81.9001    300         69.9954     300         
1 1 1 13 0  3  o 10 109.042 2.88472 211.572     15.7135  211.572     15.7135  33.7637    360         145.343     360         
1 1 1 13 0  4  f 0  222.526 2.96166 878.38      33.0012  878.38      33.0012  112.98     60          0           0           
1 1 1 13 0  5  o 19 430.197 3.96123 3281.3      85.3674  3281.3      85.3674  442.926    120         265.932     120         
1 1 1 13 0  6  o 13 417.439 3.51564 3089.19     73.5223  3089.19     73.5223  422.697    360         244.123     360         
1 1 1 13 0  7  o 10 576.907 5.02509 5901.18     145.232  5901.18     145.232  413.746    240         4.98401     60          
1 1 1 13 0  8  o 5  572.808 4.93077 5817.46     141.495  5817.46     141.495  482.671    300         139.122     300         
1 1 1 13 0  9  o 18 498.72  4.84194 4410.34     120.963  4410.34     120.963  411.947    360         104.879     360         
1 1 1 13 0  10 o 8  133.515 2.52219 316.538     16.8487  316.538     16.8487  0.485799   240         136.612     60          
1 1 1 13 0  11 o 14 489.139 4.55652 4242.14     111.649  4242.14     111.649  524.308    300         344.399     300         
1 1 1 13 0  12 o 13 603.919 5.5318  6467.02     167.356  6467.02     167.356  393.095    360         82.9797     180         
1 1 1 13 0  13 o 10 204.221 2.5504  739.685     26.0834  739.685     26.0834  113.925    240         49.0376     60          
1 1 1 13 0  14 o 19 2134.93 19.9438 81050.9     2132.95  81050.9     2132.95  1730.59    300         392.964     300         
1 1 1 13 0  15 o 14 454.159 4.48843 3657.24     102.111  3657.24     102.111  257.172    360         137.827     180         
1 1 1 13 0  16 o 12 277.269 3.18917 1363.32     44.2874  1363.32     44.2874  35.7543    59.9993     28.8063     59.9993     
1 1 1 13 0  17 o 7  170.078 2.34851 513.13      19.9999  513.13      19.9999  28.2785    300         7.09614     300         
1 1 1 13 0  18 o 3  1081.02 8.93222 20726.3     483.751  20726.3     483.751  767.568    5.5362e-07  12.9707     180         
1 1 1 13 0  19 o 11 441.723 4.03988 3459.28     89.3954  3459.28     89.3954  390.491    60          149.052     60          
1 1 1 13 0  20 f 0  1135.55 9.36758 22871.7     532.92   22871.7     532.92   978.101    300         0           0           
1 1 1 13 0  21 o 15 356.251 3.44337 2250.14     61.4492  2250.14     61.4492  310.531    360         112.678     360         
1 1 1 13 0  22 f 0  1926.45 15.6735 65911.7     1512.7   65911.7     1512.7   1320.9     240         0           0           
1 1 1 13 0  23 o 13 922.05  7.65454 15077       353.589  15077       353.589  661.859    300         10.7358     300         
1 1 1 13 0  24 o 10 973.109 8.05337 16794       392.614  16794       392.614  801.112    360         218.333     360         
1 1 1 13 0  25 o 18 524.396 4.5701  4875.4      120.06   4875.4      120.06   440.665    60          136.578     60          
1 1 1 13 0  26 o 5  268.168 2.88884 1275.16     38.8028  1275.16     38.8028  121.272    300         137.569     120         
1 1 1 13 0  27 o 15 605.131 5.15189 6492.51     156.183  6492.51     156.183  414.826    5.08898e-08 27.2938     180         
1 1 1 13 0  28 o 7  479.849 4.19069 4082.24     100.74   4082.24     100.74   275.265    60          127.968     240         
1 1 1 13 0  29 o 16 840.612 7.00803 12531.8     295.132  12531.8     295.132  637.107    120         87.4746     120         
1 1 1 13 0  30 o 5  262.104 2.73785 1218.1      35.9444  1218.1      35.9444  219.504    180         143.736     180         
1 1 1 13 0  31 o 19 109.853 2.14511 214.318     11.7889  214.318     11.7889  0.179373   240         29.886      60          
1 1 1 13 0  32 o 9  170.309 2.45125 514.596     20.9017  514.596     20.9017  37.3049    120         14.3314     120         
1 1 1 13 0  33 o 13 113.785 2.23635 229.944     12.7299  229.944     12.7299  13.4838    180         57.9662     9.09741e-06 
1 1 1 13 0  34 o 10 803.702 6.70095 11457.8     269.809  11457.8     269.809  737.763    240         350.73      240         
1 1 1 13 0  35 o 6  20.3262 4.96411 9.53614     4.55528  9.53614     4.55528  28.7372    300         59.0922     300         
1 1 1 13 0  36 o 8  92.1349 2.26152 150.964     10.4135  150.964     10.4135  0.964157   8.63224e-06 84.8996     8.63224e-06 
1 1 1 13 0  37 o 5  390.688 3.64686 2706.62     71.3737  2706.62     71.3737  400.566    60          257.574     60          
1 1 1 13 0  38 o 10 255.254 2.76672 1155.44     35.3727  1155.44     35.3727  241.541    120         206.426     120         
1 1 1 13 0  39 o 5  1062.85 8.54167 20061.6     454.831  20061.6     454.831  785.603    180         98.6531     180         
1 1 1 13 0  40 o 6  130.753 2.15547 303.449     14.1066  303.449     14.1066  15.8516    240         147.97      60          
1 1 1 13 0  41 o 16 102.595 2.2688  187.072     11.6391  187.072     11.6391  35.6541    120         40.8721     300         
1 1 1 13 0  42 o 1  104.687 2.28312 194.766     11.9521  194.766     11.9521  23.7129    180         0.597382    180         
1 1 1 13 0  43 o 6  261.22  2.97683 1210.35     38.9463  1210.35     38.9463  241.692    240         124.866     240         
1 1 1 13 0  44 o 12 213.085 2.60835 805.436     27.8347  805.436     27.8347  114.443    120         62.9644     300         
1 1 1 13 0  45 o 12 622.48  5.38022 6876.82     167.78   6876.82     167.78   475.966    2.17642e-06 101.434     2.17642e-06 
1 1 1 13 0  46 o 16 102.933 2.33089 188.348     11.9957  188.348     11.9957  38.5051    60          15.1887     60          
1 1 1 13 0  47 o 6  36.985  3.35893 25.4217     5.94431  25.4217     5.94431  10.2892    300         28.4585     300         
1 1 1 13 0  48 o 14 230.818 2.98425 945.331     34.4935  945.331     34.4935  212.804    180         112.666     180         
1 1 1 13 0  49 o 17 662.537 6.06942 7796.58     201.444  7796.58     201.444  517.99     240         140.11      240         
1 1 1 13 0  50 o 4  97.4484 2.43871 168.941     11.8757  168.941     11.8757  60.7125    300         12.8329     300         
1 1 1 13 0  51 o 6  254.663 3.01029 1150.65     38.3938  1150.65     38.3938  190.807    180         39.1615     180         
1 1 1 13 0  52 o 4  109.165 2.85737 212.119     15.5832  212.119     15.5832  79.3203    60          32.4907     60          
1 1 1 13 0  53 o 17 707.001 6.4876  8885.11     229.773  8885.11     229.773  524.396    300         103.516     300         
1 1 1 13 0  54 o 12 9.85075 4.52703 -0.429764   5.36008  -0.429764   5.36008  9.69138    3.26298e-05 19.7211     3.26298e-05 
1 1 1 13 0  55 o 15 316.856 3.47733 1781.66     55.1865  1781.66     55.1865  195.058    240         31.006      60          
1 1 1 13 0  56 o 6  57.6884 3.12938 60.0417     8.92145  60.0417     8.92145  5.06287    300         27.9679     120         
1 1 1 13 0  57 o 13 146.607 2.71277 381.832     19.9001  381.832     19.9001  108.552    180         23.658      180         
1 1 1 13 0  58 o 10 70.2745 2.89882 88.456      10.1287  88.456      10.1287  27.221     240         21.2461     60          
1 1 1 13 0  59 o 11 46.5286 2.96537 39.3175     6.77894  39.3175     6.77894  0.770064   300         6.70556     120         
1 1 1 13 0  60 o 6  91.6557 2.41698 149.563     11.0667  149.563     11.0667  69.6777    180         24.4796     180         
1 1 1 13 0  61 o 1  173.081 2.70389 532.053     23.4272  532.053     23.4272  118.938    60          12.2239     60          
1 1 1 13 0  62 o 3  35.302  3.59004 23.447      5.97028  23.447      5.97028  0.115762   119.999     0.974539    119.999     
1 1 1 13 0  63 o 4  62.6903 3.55789 71.111      11.007   71.111      11.007   27.2042    180         22.0329     360         
1 1 1 13 0  64 o 3  23.5295 5.80604 12.8792     6.19053  12.8792     6.19053  23.0177    240         61.1264     240         
1 1 1 13 0  65 o 5  13.2456 5.76962 2.4138      7.46675  2.4138      7.46675  19.1121    300         41.5272     300         
1 1 1 13 0  66 o 19 28.3348 6.82246 18.5524     8.68537  18.5524     8.68537  3.76851    180         16.8057     180         
1 1 1 13 0  67 o 2  19.4973 6.90848 10.0341     8.26565  10.0341     8.26565  1.71337    60          4.35422     60          
1 1 1 13 0  68 o 12 13.4518 5.84579 2.61766     7.6235   2.61766     7.6235   16.3348    300         36.0113     300         
1 1 1 13 0  69 o 17 94.1071 3.45275 158.814     16.1828  158.814     16.1828  66.4784    360         13.7737     360         
1 1 1 13 0  70 o 7  98.8565 3.36875 175.1       16.6004  175.1       16.6004  77.5869    60          30.4255     60          
1 1 1 13 0  71 o 19 135.92  3.49518 330.323     23.7359  330.323     23.7359  94.5146    120         18.1729     120         
1 1 1 13 0  72 o 3  199.807 3.56067 713.047     35.6025  713.047     35.6025  137.415    360         24.6547     360         
1 1 1 13 0  73 o 6  43.4851 4.91577 36.3443     9.89287  36.3443     9.89287  20.4835    59.9999     13.4346     59.9999     
1 1 1 13 0  74 o 17 33.752  6.41119 24.4494     9.37013  24.4494     9.37013  16.2419    120         0.743446    120         
1 1 1 13 0  75 o 4  76.9774 3.48042 107.089     13.2988  107.089     13.2988  29.9383    1.52384e-06 35.3376     180         
1 1 1 13 0  76 o 3  18.3082 7.05745 8.72923     9.18428  8.72923     9.18428  3.85058    60          20.2891     60          
1 1 1 13 0  77 o 2  23.6911 7.63371 14.9507     9.83097  14.9507     9.83097  3.98701    300         34.6808     300         
1 1 1 13 0  78 o 10 107.6   3.659   208.694     19.6258  208.694     19.6258  79.7458    180         28.0781     180         
1 1 1 13 0  79 o 12 171.73  3.70943 530.105     31.8562  530.105     31.8562  128.762    60          48.6942     60          
1 1 1 13 0  80 f 0  7.95832 4.05464 -14.1385    8.07648  -14.1385    8.07648  12.2649    300         0           0           
1 1 1 13 0  81 o 15 23.3649 7.62954 14.8411     9.83365  14.8411     9.83365  1.7844     0.000147352 0.111814    0.000147352 
1 1 1 13 0  82 o 13 15.9857 6.8392  5.09166     10.0824  5.09166     10.0824  0.505755   60          10.4682     60          
1 1 1 13 0  83 o 2  16.2418 6.76432 6.10095     9.36969  6.10095     9.36969  0.209656   300         8.98458     300         
1 1 1 13 0  84 o 11 58.7328 4.46604 64.8255     12.7614  64.8255     12.7614  56.5801    360         48.4025     360         
1 1 1 13 0  85 o 3  32.4951 8.8201  27.3625     13.5763  27.3625     13.5763  15.7313    60          5.53154     240         
1 1 1 13 0  86 o 2  17.0638 7.39511 5.74755     12.1232  5.74755     12.1232  2.56938    300         17.0603     300         
1 1 1 13 0  87 o 10 17.0863 7.44192 5.55681     12.4197  5.55681     12.4197  0.230324   8.61212e-06 9.29572     8.61212e-06 
1 1 1 13 0  88 o 17 16.3004 7.70013 -2.86377    17.2665  -2.86377    17.2665  2.12954    240         18.1124     240         
1 1 1 13 0  89 o 19 40.3304 9.7614  41.0906     17.7182  41.0906     17.7182  26.5778    300         6.77116     300         
1 1 1 13 0  90 o 19 22.0892 9.01597 14.0566     16.1079  14.0566     16.1079  2.17026    180         0.206391    360         
1 1 1 13 0  91 o 17 28.2835 11.7903 27.998      28.5122  27.998      28.5122  4.26215    60          1.3412      60          
1 1 1 13 0  92 o 15 26.8095 13.2539 4.62339     65.8591  4.62339     65.8591  4.50413    300         0.998512    120         
1 1 1 13 0  93 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 1  0  o 9  872.745 6.82047 13506.9     298.224  13506.9     298.224  759.495    180         257.306     180         
1 1 1 13 1  1  o 8  725.139 5.8407  9244.05     215.829  9402.54     208.534  576.328    56.7946     121.494     56.7946     
1 1 1 13 1  2  o 14 315.594 3.23896 1822.63     53.373   1708.46     49.0887  174.756    219.858     74.6704     39.8582     
1 1 1 13 1  3  o 18 629     5.41907 6939.01     170.799  7089.66     170.825  586.31     319.178     289.698     319.178     
1 1 1 13 1  4  f 0  408.367 3.73687 2986.58     77.8886  2924.65     75.0582  305.311    42.5066     0           0           
1 1 1 13 1  5  o 8  913.145 7.64686 14728.3     363.064  14853.1     336.161  660.411    236.25      13.3306     236.25      
1 1 1 13 1  6  o 15 429.434 4.03524 3287.12     88.5674  3249.85     85.0986  208.736    208.609     183.512     28.6094     
1 1 1 13 1  7  o 14 675.863 6.72752 8061.36     233.736  8139.03     221.772  449.931    112.619     61.4492     292.619     
1 1 1 13 1  8  o 5  717.396 6.94051 9134.05     249.511  9118.99     249.535  468.351    160.962     85.4818     340.962     
1 1 1 13 1  9  o 15 699.097 6.8487  8553.73     251.463  8779.92     227.475  450.182    78.9312     94.9821     258.931     
1 1 1 13 1  10 o 7  499.949 5.08936 4394.39     133.672  4466.81     120.921  502.364    137.718     323.793     137.718     
1 1 1 13 1  11 o 16 898.37  8.36016 14252       385.183  14379.7     367.283  603.738    288.778     76.9188     108.778     
1 1 1 13 1  12 o 12 447.162 4.5052  3520.26     103.312  3567.65     98.5109  251.918    106.651     121.979     286.651     
1 1 1 13 1  13 o 12 1665.61 15.2611 48650.6     1303.22  50014.1     1242.73  1409.5     189.778     429.136     189.778     
1 1 1 13 1  14 o 6  1464.23 12.2726 38043.4     918.3    38102.6     882.403  1058.85    102.832     18.6322     102.832     
1 1 1 13 1  15 o 10 119.692 2.14608 256.708     12.8481  251.328     12.8752  3.65605    159.055     68.1796     339.055     
1 1 1 13 1  16 o 4  267.163 2.87561 1295.91     39.2724  1234.07     37.7336  67.8863    94.0283     226.039     274.028     
1 1 1 13 1  17 o 14 1196.21 9.63361 25444.8     588.091  25331.8     566.773  975.908    330.892     244.62      330.892     
1 1 1 13 1  18 o 15 844.188 7.08501 12695.3     299.73   12577.7     299.739  624.394    24.2505     49.6364     24.2506     
1 1 1 13 1  19 o 5  1003.87 8.3428  17950.3     419.7    17799.2     419.716  724.537    243.118     20.4999     243.118     
1 1 1 13 1  20 o 15 1101.42 9.09537 21690.8     502.013  21354.7     502.032  819.874    131.909     72.5779     131.909     
1 1 1 13 1  21 o 9  1129.16 9.3121  22806.7     526.92   22439.5     526.942  846.448    175.285     87.5721     175.285     
1 1 1 13 1  22 o 11 490.705 4.38487 4296.38     107.823  4239.17     107.833  224.887    71.3753     238.256     251.375     
1 1 1 13 1  23 o 15 920.969 7.52512 15188.7     340.736  14897.4     353.618  653.505    201.976     3.69275     201.976     
1 1 1 13 1  24 o 11 789.209 6.45407 11058.2     250.463  11029.2     259.959  720.598    269.126     333.499     269.126     
1 1 1 13 1  25 o 18 613.971 5.30561 6672.11     156.849  6692.74     169.421  456.011    359.43      54.7813     359.43      
1 1 1 13 1  26 o 16 1157.69 9.51585 23589.8     530.55   23986.5     573.11   885.452    88.2812     136.62      88.2812     
1 1 1 13 1  27 o 15 565.024 4.91445 5652.13     139.151  5666.4      139.161  432.709    156.032     83.4364     156.032     
1 1 1 13 1  28 o 11 380.341 3.47319 2618.94     64.9253  2509.12     67.3781  126.736    256.952     267.584     76.9523     
1 1 1 13 1  29 o 17 386.43  3.57624 2636.02     67.9633  2657.12     70.5344  250.571    281.874     20.4636     101.874     
1 1 1 13 1  30 o 1  673.814 5.54585 8115.39     183.732  7985.77     190.679  376.798    214.469     186.008     34.4688     
1 1 1 13 1  31 o 18 477.535 4.23944 4045.89     101.449  4038.77     101.461  367.767    193.703     82.4758     193.703     
1 1 1 13 1  32 o 10 671.547 5.6909  7927.62     191.502  8068.48     191.53   369.736    343.569     195.579     163.569     
1 1 1 13 1  33 o 1  319.552 3.17807 1821.71     50.8951  1797.99     50.8908  144.535    4.72304     143.836     184.723     
1 1 1 13 1  34 o 2  500.022 4.39341 4485.13     110.088  4381.04     110.082  295.303    320.126     99.7636     140.126     
1 1 1 13 1  35 o 14 739.249 6.17828 9664.95     228.88   9729.29     228.89   580.071    311.721     135.097     311.721     
1 1 1 13 1  36 o 9  146.334 2.27415 385.179     16.6882  373.843     16.6638  71.334     149.656     25.7397     149.656     
1 1 1 13 1  37 o 17 394.529 3.66256 2789.13     72.4178  2730.22     72.4045  315.892    280.024     96.6724     280.024     
1 1 1 13 1  38 o 15 98.1001 2.21735 173.344     10.8916  168.134     10.8805  20.711     195.109     23.6566     15.1088     
1 1 1 13 1  39 o 12 710.551 5.9368  8989.53     211.413  8937.5      211.389  518.434    333.186     57.5542     333.186     
1 1 1 13 1  40 o 16 211.565 2.54314 774.085     26.9572  812.902     26.9575  116.788    118.786     42.7358     298.786     
1 1 1 13 1  41 o 17 200.118 2.77102 706.613     28.4345  713.257     27.1232  169.925    102.006     112.288     102.006     
1 1 1 13 1  42 o 15 505.069 4.52753 4519.34     116.865  4533.88     112.275  310.589    30.0711     67.7278     210.071     
1 1 1 13 1  43 o 17 286.368 3.28037 1458.71     49.1799  1449.74     44.8884  217.549    29.2489     56.954      29.2488     
1 1 1 13 1  44 o 7  279.781 3.10484 1395.96     44.4732  1380.1      42.5817  171.892    226.656     28.9098     46.6558     
1 1 1 13 1  45 f 0  569.642 4.94609 5693.41     143.936  5830.29     138.319  341.217    149.473     0           0           
1 1 1 13 1  46 o 9  106.036 2.36564 202.901     13.1518  196.163     11.947   56.9345    140.654     3.65951     140.654     
1 1 1 13 1  47 o 14 431.435 4.12932 3312.51     94.9771  3294.55     83.2247  326.415    38.772      71.3159     38.772      
1 1 1 13 1  48 o 15 141.432 2.44256 357.238     17.7655  352.038     16.8529  109.672    43.4207     53.2161     43.4207     
1 1 1 13 1  49 o 12 117.85  2.38899 257.14      14.7686  235.955     13.4269  77.86      156.578     24.6691     156.578     
1 1 1 13 1  50 f 0  395.076 4.06853 2780.32     83.7813  2761.45     77.2102  224.761    33.4053     0           0           
1 1 1 13 1  51 o 5  66.263  2.75876 79.7811     9.15371  76.5116     9.08551  8.82844    180.264     13.1492     0.263848    
1 1 1 13 1  52 o 13 111.387 2.66458 227.168     15.1564  213.495     14.5503  36.0613    50.583      63.436      230.583     
1 1 1 13 1  53 o 4  178.334 2.73994 568.346     23.9044  559.782     25.0466  94.4436    72.8562     39.8763     252.856     
1 1 1 13 1  54 o 1  152.961 2.48023 412.781     18.5792  417.032     19.4394  92.0048    255.939     6.89632     75.9392     
1 1 1 13 1  55 o 15 326.953 3.4127  1913.46     54.6719  1881.11     57.1114  256.706    295.419     85.6674     295.419     
1 1 1 13 1  56 o 1  84.8104 2.78232 120.521     10.8428  135.437     12.7473  33.5555    185.421     21.9995     5.42102     
1 1 1 13 1  57 o 14 179.315 2.69003 560.25      23.5778  580.653     24.7693  85.484     279.081     58.6375     99.0814     
1 1 1 13 1  58 o 4  210.705 2.77035 774.588     29.2534  801.083     29.2462  134.788    319.891     1.20609     139.892     
1 1 1 13 1  59 o 13 95.182  2.66225 159.45      11.6165  162.583     13.6653  64.1628    243.217     27.8436     243.217     
1 1 1 13 1  60 o 16 168.231 2.35011 494.312     18.9698  509.975     20.6435  124.205    143.03      35.911      143.03      
1 1 1 13 1  61 o 11 132.733 2.47005 319.619     16.0885  306.253     16.7181  67.467     244.362     31.744      64.362      
1 1 1 13 1  62 o 9  74.2243 2.79014 105.107     10.0903  91.3823     10.5162  39.1874    236.371     2.08131     56.3708     
1 1 1 13 1  63 o 10 190.41  2.94086 642.107     25.8999  646.569     30.0814  110.466    19.7641     21.5219     199.764     
1 1 1 13 1  64 o 19 83.5271 2.84279 124.594     12.1512  124.004     11.5721  23.2188    273.78      54.6497     93.7798     
1 1 1 13 1  65 o 13 79.2931 3.1494  103.723     11.8574  121.124     13.08    37.076     59.4756     19.1941     239.476     
1 1 1 13 1  66 o 4  100.968 2.92384 181.477     15.041   181.994     14.4787  55.4891    50.31       11.666      230.31      
1 1 1 13 1  67 f 0  90.6574 2.78592 151.464     13.2846  141.745     11.9676  56.5753    308.25      0           0           
1 1 1 13 1  68 o 8  149.393 3.22047 380.705     23.075   416.675     25.1021  98.7087    239.923     12.1236     239.923     
1 1 1 13 1  69 o 12 106.261 2.63889 199.52      14.4203  203.11      13.6212  66.3249    22.1125     3.05831     22.1124     
1 1 1 13 1  70 o 17 38.0079 5.10216 25.4983     8.64234  28.4334     10.0867  6.18223    233.277     28.1073     53.2771     
1 1 1 13 1  71 o 14 105.275 3.12885 177.229     16.0348  220.856     16.8307  60.439     209.838     8.80983     29.8382     
1 1 1 13 1  72 o 16 26.4393 5.4632  5.66671     7.86912  19.7488     8.59182  2.651      7.17513     30.7539     7.17513     
1 1 1 13 1  73 o 3  68.1424 3.6031  86.2988     11.655   81.5902     12.7077  52.5707    46.7834     26.959      46.7834     
1 1 1 13 1  74 o 18 32.8762 5.75537 21.8178     9.30983  19.5792     9.57156  10.6953    248.265     1.85934     248.265     
1 1 1 13 1  75 o 2  146.6   3.33866 377.545     24.424   396.376     24.5606  96.8261    192.71      14.0165     192.71      
1 1 1 13 1  76 o 12 131.586 3.34481 316.91      21.9731  307.333     22.0631  96.1405    253.84      32.3131     253.84      
1 1 1 13 1  77 o 6  39.5724 5.20026 34.4306     10.2575  25.2738     9.591    17.6376    234.506     7.36198     54.5064     
1 1 1 13 1  78 o 4  107.113 3.61549 213.991     20.2151  202.181     18.4852  72.7416    265.641     16.7514     265.641     
1 1 1 13 1  79 o 1  44.8563 5.04523 40.7632     10.8865  35.4159     10.988   27.748     266.771     6.26962     266.771     
1 1 1 13 1  80 o 6  45.1814 5.37192 44.5786     12.1524  33.9878     11.2726  19.6787    74.4017     12.1753     254.402     
1 1 1 13 1  81 o 5  24.2254 6.48804 11.4828     12.1385  7.18874     9.47054  6.37312    326.018     8.61072     146.018     
1 1 1 13 1  82 o 9  13.6266 4.56947 -9.89021    7.95554  -8.16865    8.74573  0.466104   81.1907     2.39647     81.1907     
1 1 1 13 1  83 o 10 67.1647 4.11921 82.2184     13.6082  86.1033     13.8462  35.6444    201.742     6.86849     21.7424     
1 1 1 13 1  84 o 9  29.2177 6.66514 20.2666     11.9653  14.1795     10.3126  11.9245    138.493     3.36345     138.493     
1 1 1 13 1  85 o 5  29.8845 6.96558 23.3448     12.8445  12.8073     11.7696  11.385     333.697     4.63068     153.697     
1 1 1 13 1  86 o 2  45.0107 6.16557 44.2233     13.2562  37.9558     13.5271  27.7201    8.02899     8.48866     8.02899     
1 1 1 13 1  87 o 8  50.1804 7.23379 44.6738     20.1859  61.1615     14.4987  15.4444    5.0652      25.4699     185.065     
1 1 1 13 1  88 f 0  57.9949 7.32406 82.4864     21.3784  59.8596     19.5734  22.0725    120.312     0           0           
1 1 1 13 1  89 o 16 17.6781 5.94777 -12.3821    14.8881  -14.7135    13.9228  0.705885   320.876     1.9816      140.876     
1 1 1 13 1  90 o 15 22.5466 7.00928 -13.7799    16.194   10.8875     16.1715  5.05501    285.24      3.22811     105.24      
1 1 1 13 1  91 o 1  32.4453 9.48126 -7.14952    26.6082  45.8705     28.2431  12.8084    139.523     3.58037     139.523     
1 1 1 13 1  92 o 3  28.3625 9.83361 -3.11917    66.5518  -6.43496    26.3813  4.63175    306.024     0.456661    126.024     
1 1 1 13 1  93 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 2  0  o 2  359.696 3.70551 2294.13     66.7632  2294.13     66.7632  314.661    360         109.656     360         
1 1 1 13 2  1  o 19 693.636 6.42871 8642.8      223.461  8419.85     223.446  355.127    71.8        281.678     251.8       
1 1 1 13 2  2  f 0  860.572 7.6869  13152.8     324.219  13118.1     338.628  538.165    343.658     0           0           
1 1 1 13 2  3  o 7  413.563 4.00581 3103.03     86.7951  2960.29     79.2194  349.685    237.506     135.563     237.506     
1 1 1 13 2  4  o 5  562.212 5.76547 5604.13     158.114  5603.07     166.655  410.007    263.19      25.7557     263.19      
1 1 1 13 2  5  o 6  459.62  4.86663 3757.04     115.02   3731.9      109.112  262.603    19.5154     120.665     199.515     
1 1 1 13 2  6  o 17 854.767 9.14511 13156.6     391.723  12771.7     391.692  629.21     50.7788     34.9859     50.7787     
1 1 1 13 2  7  o 12 596.749 6.41817 6343.64     186.183  6284.07     197.472  392.167    43.0626     62.5705     223.063     
1 1 1 13 2  8  o 10 1559.12 16.9149 43861.7     1276.13  42676.1     1364.21  1174.03    291.911     103.288     291.911     
1 1 1 13 2  9  o 16 364.553 4.45988 2389.16     81.4833  2321.98     81.4622  280.502    18.2979     67.0803     18.2979     
1 1 1 13 2  10 o 11 1192.18 13.5724 25333.9     867.076  25174.9     750.838  837.033    189.446     37.9821     9.44625     
1 1 1 13 2  11 o 6  166.828 2.68384 489.583     21.3044  496.776     23.5317  31.0608    240.422     133.777     60.4215     
1 1 1 13 2  12 f 0  564.299 5.25528 5717.78     151.855  5571.4      145.372  306.671    148.63      0           0           
1 1 1 13 2  13 o 18 642.335 5.87472 7370.87     193.205  7257.61     184.976  533.999    14.937      160.202     14.937      
1 1 1 13 2  14 f 0  570.473 5.24358 5814.83     153.155  5722.38     146.634  413.315    252.951     0           0           
1 1 1 13 2  15 o 2  1383    12.075  34071.8     854.957  33855.1     818.547  1048.4     34.8865     115.32      34.8865     
1 1 1 13 2  16 o 16 289.238 3.07288 1479.11     45.4194  1485.86     43.641   155.599    37.1094     77.9473     217.109     
1 1 1 13 2  17 o 17 132.028 2.13716 329.373     14.1112  289.03      14.1238  21.4144    102.585     69.2256     282.585     
1 1 1 13 2  18 o 18 746.03  6.30892 9749.44     235.835  9986        235.878  532.066    164.339     5.50308     164.339     
1 1 1 13 2  19 o 18 1025.12 8.44989 18402.7     434.025  18881.1     434.118  724.484    27.0133     11.5297     207.013     
1 1 1 13 2  20 o 1  269.252 2.94051 1303.7      38.854   1265.81     40.4542  162.603    338.706     30.876      158.706     
1 1 1 13 2  21 o 3  596.21  5.26261 6247.05     154.064  6355.44     160.397  393.298    327.69      52.7673     147.69      
1 1 1 13 2  22 o 3  505.292 4.54149 4496.59     112.675  4554.26     117.307  361.452    224.86      18.6568     224.86      
1 1 1 13 2  23 o 2  371.567 3.54189 2422.86     65.9361  2470.72     65.965   276.712    354.667     50.5712     354.667     
1 1 1 13 2  24 o 6  441.744 4.03966 3440.24     89.41    3476.82     89.4454  245.263    15.5143     121.547     195.514     
1 1 1 13 2  25 o 10 461.266 4.17069 3760.84     96.3907  3781.33     96.4279  245.234    238.26      149.24      58.2597     
1 1 1 13 2  26 o 19 545.984 4.75077 5295.94     129.968  5272.4      130.009  455.92     271.025     158.725     271.025     
1 1 1 13 2  27 o 1  715.133 5.9247  9057.93     216.197  9078.33     208.384  592.541    318.172     187.855     318.172     
1 1 1 13 2  28 o 2  522.64  4.6195  4825.61     120.972  4858.61     121.012  448.403    243.288     181.193     243.288     
1 1 1 13 2  29 o 19 576.649 4.8837  5932.73     143.718  5857.63     138.524  478.429    333.933     160.591     333.933     
1 1 1 13 2  30 o 13 650.502 5.31331 7566.64     176.386  7439.78     170.021  429.968    61.7975     46.5214     241.798     
1 1 1 13 2  31 o 12 441.819 4.1219  3396.85     93.0131  3524.42     89.3897  348.906    108.209     94.9652     108.209     
1 1 1 13 2  32 f 0  376.609 3.5669  2455.16     67.2913  2573.64     67.3208  342.384    158.854     0           0           
1 1 1 13 2  33 o 2  961.626 7.84835 16487.5     378.193  16352.8     378.243  657.062    64.1387     29.9427     244.139     
1 1 1 13 2  34 o 14 505.375 4.57209 4488.47     113.457  4569.57     118.12   334.962    317.407     28.1394     137.406     
1 1 1 13 2  35 o 16 349.827 3.47413 2186.56     59.6602  2152.37     62.1049  316.399    108.279     166.379     108.279     
1 1 1 13 2  36 o 9  536.307 4.70233 5082.55     121.43   5120.29     131.181  375.661    114.892     11.3707     114.892     
1 1 1 13 2  37 o 18 176.125 2.41136 544.972     20.4465  554.606     22.1016  43.4532    183.311     142.772     3.31074     
1 1 1 13 2  38 o 8  387.974 3.62532 2661.29     67.724   2676.65     73.1602  273.224    94.186      17.3769     94.186      
1 1 1 13 2  39 o 9  316.702 3.25017 1792.18     50.532   1764.43     52.5973  163.486    131.935     102.634     311.935     
1 1 1 13 2  40 f 0  485.564 4.48856 4167.51     109.211  4198.72     109.234  347.204    284.477     0           0           
1 1 1 13 2  41 o 3  283.252 3.10788 1438.24     40.2122  1406.94     47.6218  237.494    34.9533     102.521     34.9533     
1 1 1 13 2  42 o 18 236.436 2.86769 1016.74     33.2331  965.797     34.6559  183.008    234.684     60.7056     234.684     
1 1 1 13 2  43 o 19 154.08  2.33868 417.799     17.6709  423.865     18.4423  107.694    130.562     64.4278     130.562     
1 1 1 13 2  44 o 12 540.275 4.74168 5099.13     120.506  5265.36     136.013  374.839    339.465     14.2577     339.465     
1 1 1 13 2  45 o 18 155.277 2.31308 423.4       17.2747  431.434     18.7078  105.02     309.807     17.376      309.807     
1 1 1 13 2  46 o 14 241.501 2.7317  1018.23     33.0558  1050.12     33.0597  207.609    123.163     98.4623     123.163     
1 1 1 13 2  47 o 16 180.988 2.62331 582.41      23.8075  579.192     23.7798  104.051    69.3059     27.8622     249.306     
1 1 1 13 2  48 o 9  135.255 2.30322 336.556     16.2979  312.31      14.9302  65.8974    132.542     38.4547     312.542     
1 1 1 13 2  49 o 12 210.037 2.79949 792.962     30.8252  771.805     28.0776  173.708    107.871     77.4101     107.871     
1 1 1 13 2  50 o 7  434.265 4.03559 3399.37     91.4807  3296.93     84.1131  306.37     204.368     31.4313     204.368     
1 1 1 13 2  51 o 6  263.063 2.98388 1224.2      41.1092  1230.82     37.4701  181.435    176.177     16.85       176.177     
1 1 1 13 2  52 o 8  87.883  2.26137 146.44      10.4828  128.101     9.41241  30.7057    335.534     8.79561     335.534     
1 1 1 13 2  53 o 18 141.121 2.63079 358.53      18.3541  348.386     18.8118  73.4591    157.874     29.0609     337.874     
1 1 1 13 2  54 o 1  116.423 2.47351 240.452     14.3957  240.71      14.4345  51.1086    3.41226     38.9493     183.412     
1 1 1 13 2  55 o 10 151.276 2.58214 411.901     20.0334  399.905     19.117   117.301    44.1017     51.8484     44.1017     
1 1 1 13 2  56 o 18 95.7356 2.51653 169.269     11.4712  156.427     12.5512  38.2676    25.109      34.2392     205.109     
1 1 1 13 2  57 o 1  331.018 3.60148 1965.68     56.9759  1926.43     62.3315  212.973    81.7872     7.30397     261.787     
1 1 1 13 2  58 o 6  162.802 2.4723  453.658     21.1041  487.034     19.0965  116.109    144.429     27.2795     144.429     
1 1 1 13 2  59 o 16 290.785 3.65327 1520.88     53.1861  1484.7      53.2811  199.692    96.4352     21.3423     96.4352     
1 1 1 13 2  60 o 2  170.671 2.82422 531.559     23.6056  502.965     24.6512  135.418    19.3148     55.6036     19.3148     
1 1 1 13 2  61 o 1  279.243 3.56034 1390.19     49.8683  1383.42     49.7787  182.944    68.0567     4.89915     68.0566     
1 1 1 13 2  62 o 19 126.605 2.82692 276.193     18.4925  294.011     17.2599  103.227    32.9482     53.8506     32.9482     
1 1 1 13 2  63 f 0  82.4927 2.83034 123.292     12.1749  119.162     11.1487  39.9595    202.89      0           0           
1 1 1 13 2  64 o 7  81.3075 2.76125 122.49      11.8622  113.174     10.5749  51.3511    236.133     10.4795     236.133     
1 1 1 13 2  65 o 6  135.838 2.77877 329.034     19.4253  327.859     18.3538  100.574    225.735     33.0891     225.735     
1 1 1 13 2  66 o 14 36.4791 4.17931 22.9446     7.60567  25.8912     7.09627  1.47019    124.897     20.9969     304.897     
1 1 1 13 2  67 o 19 138.963 2.54742 358.856     17.3536  328.81      18.0449  89.0761    106.189     5.74497     106.189     
1 1 1 13 2  68 o 4  16.811  4.6566  1.13086     6.32862  4.33797     5.29439  13.5286    273.282     32.817      273.282     
1 1 1 13 2  69 o 14 159.005 2.90808 462.21      23.1941  440.203     23.104   86.7984    259.649     25.5895     79.6494     
1 1 1 13 2  70 o 12 111.713 2.75778 220.305     16.0131  225.328     14.7762  63.4043    76.3236     11.7595     256.324     
1 1 1 13 2  71 o 2  86.5437 2.87774 146.221     12.9359  122.406     11.9497  54.8123    103.727     4.36922     103.727     
1 1 1 13 2  72 o 12 109.012 3.03012 211.618     18.0633  214.281     14.7841  66.0532    304.836     1.98397     124.836     
1 1 1 13 2  73 o 4  75.5141 3.4597  105.156     13.4824  100.656     12.5605  51.9608    259.307     14.0499     259.307     
1 1 1 13 2  74 o 14 125.743 3.23323 279.504     20.5111  289.207     20.1569  88.2414    12.9179     22.479      12.9179     
1 1 1 13 2  75 o 3  120.487 3.3257  242.511     20.0974  281.315     19.8823  70.8438    341.91      5.6105      161.91      
1 1 1 13 2  76 o 10 45.6448 4.89469 31.0836     10.4812  47.7011     10.908   27.5678    50.0581     5.85477     50.0581     
1 1 1 13 2  77 o 18 46.9108 5.17659 37.7408     12.0577  45.3164     11.3209  7.49143    354.547     39.7067     174.547     
1 1 1 13 2  78 o 1  13.3294 4.44295 -16.4853    7.99404  -3.5807     7.92805  8.39884    165.764     25.0136     165.764     
1 1 1 13 2  79 o 19 39.6931 5.83828 28.5602     11.5336  32.7506     10.9279  14.7479    84.9117     15.1476     264.912     
1 1 1 13 2  80 o 6  29.71   6.15786 17.7843     10.155   16.8468     9.36506  11.446     111.447     7.05933     291.447     
1 1 1 13 2  81 o 16 29.8883 6.24649 19.2379     10.4029  16.2332     9.62753  13.3319    32.1277     2.53832     212.128     
1 1 1 13 2  82 o 6  28.0564 6.60565 17.4853     12.0967  13.3073     9.64746  11.5222    20.8222     2.78368     20.8222     
1 1 1 13 2  83 o 5  22.6042 6.03955 14.1061     10.4821  0.395726    9.27392  0.652133   154.649     23.621      154.649     
1 1 1 13 2  84 o 8  21.2457 6.00786 -1.30735    10.6665  9.98011     9.71633  1.67511    319.578     14.3205     139.578     
1 1 1 13 2  85 o 16 65.1232 4.81695 72.0445     15.1587  90.7111     15.6778  41.6305    69.5238     9.38955     69.5238     
1 1 1 13 2  86 o 3  69.532  4.87349 87.1212     16.8625  98.3216     16.5637  39.086     152.232     1.32409     332.232     
1 1 1 13 2  87 o 7  38.7867 7.46814 31.3225     16.6155  33.1871     13.4039  17.8769    231.363     5.42113     51.3629     
1 1 1 13 2  88 o 6  18.1736 6.043   -10.9824    13.9636  -10.6783    14.2221  1.63076    144.556     6.99117     324.556     
1 1 1 13 2  89 o 18 25.4316 7.48884 10.5447     15.6053  6.27514     16.1231  8.57827    238.208     3.17814     58.2077     
1 1 1 13 2  90 o 11 18.4568 6.29718 -14.8946    19.7004  -17.8177    14.077   0.552592   246.815     1.84655     66.8149     
1 1 1 13 2  91 o 18 34.8146 9.1901  31.2204     23.4879  30.6848     19.7895  14.8876    187.484     6.03142     187.484     
1 1 1 13 2  92 o 2  41.2035 12.5056 98.9189     71.1509  57.7343     33.1738  19.8224    153.394     5.57143     153.394     
1 1 1 13 2  93 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 3  0  o 3  577.648 6.38359 5918.35     184.693  5918.35     184.693  406.481    1.26486e-06 23.0934     180         
1 1 1 13 3  1  o 16 766.516 8.5683  10612.7     317.749  10233.7     339.676  660.967    225.001     228.158     225.001     
1 1 1 13 3  2  o 11 880.588 8.79101 13814.4     387.946  13697.7     387.942  670.206    117.752     77.3842     117.752     
1 1 1 13 3  3  o 6  736.093 7.46546 9434.78     275.345  9784.13     275.369  508.514    297.386     35.7728     117.386     
1 1 1 13 3  4  o 11 589.088 6.1462  6109.91     181.44   6194.73     181.446  395.651    156.673     45.7918     336.673     
1 1 1 13 3  5  o 18 914.342 9.66274 14851.2     442.777  14817.2     442.745  616.747    222.437     79.424      42.4371     
1 1 1 13 3  6  o 6  921.931 8.92683 15172.5     423.218  14983.9     401.49   665.813    283.195     8.62343     283.195     
1 1 1 13 3  7  o 9  761.825 6.6209  10261.2     242.035  10318.9     263.129  698.485    134.498     312.792     134.498     
1 1 1 13 3  8  o 4  1304.88 11.1339 30053       728.049  30398.1     728.092  876.918    101.83      124.973     281.83      
1 1 1 13 3  9  o 14 532.483 5.25231 4997.41     129.801  5054.3      149.901  309.354    89.1136     135.861     269.114     
1 1 1 13 3  10 o 10 739.244 7.4224  9573.01     295.569  9808.87     252.092  609.823    25.673      166.942     25.673      
1 1 1 13 3  11 o 14 1151.03 10.6576 23633.7     568.93   23395.2     656.96   921.947    159.219     192.07      159.219     
1 1 1 13 3  12 o 5  667.706 6.53396 7969.77     207.332  7839.14     229.199  545.297    283.717     143.33      283.717     
1 1 1 13 3  13 o 4  173.416 2.55282 533.518     22.1818  532.264     22.1892  67.9539    97.9571     59.1549     277.957     
1 1 1 13 3  14 o 15 421.381 4.142   3183.38     85.5171  3110.59     89.323   370.014    58.4446     162.521     58.4446     
1 1 1 13 3  15 o 9  357.89  3.59929 2273.69     64.5519  2266.06     64.5569  327.928    41.9029     182.626     41.9029     
1 1 1 13 3  16 o 14 702.535 6.08711 8769.61     218.563  8730.44     209.987  549.209    10.9429     101.504     10.9429     
1 1 1 13 3  17 o 13 469.647 4.41683 3886.68     108.172  3931.94     99.5021  345.285    209.546     34.2627     209.546     
1 1 1 13 3  18 o 19 358.933 3.36055 2267.1      61.546   2299.16     59.3123  337.644    345.99      202.088     345.99      
1 1 1 13 3  19 o 4  906.04  7.34407 14460.8     339.514  14656.1     327.199  753.321    185.532     218.737     185.532     
1 1 1 13 3  20 o 19 445.716 3.90778 3518.56     87.2786  3523.14     87.2952  325.362    1.62558     32.4306     1.62558     
1 1 1 13 3  21 o 9  679.81  5.53189 8213.4      188.447  8171.96     188.474  404.897    40.1418     151.638     220.142     
1 1 1 13 3  22 o 11 303.028 2.91366 1635.17     44.2406  1619.31     44.2523  138.855    192.674     132.284     12.6736     
1 1 1 13 3  23 o 2  1370.91 10.7251 33184.6     736.762  33561       736.903  961.822    157.001     25.4294     337.001     
1 1 1 13 3  24 o 3  830.049 6.80535 12127.9     277.787  12309.9     288.349  607.735    70.0764     44.4179     70.0764     
1 1 1 13 3  25 o 11 416.097 3.85394 3062.35     77.1937  3074.85     83.4253  343.212    219.126     125.253     219.126     
1 1 1 13 3  26 o 16 597.635 5.15782 6256.37     148.441  6408.15     160.406  363.861    241.956     107         61.9556     
1 1 1 13 3  27 f 0  768.755 6.47766 10452.6     239.746  10510.3     259.041  474.562    53.2443     0           0           
1 1 1 13 3  28 o 5  457.894 4.16667 3723.3      91.83    3709.73     99.2377  383.963    45.9565     143.711     45.9565     
1 1 1 13 3  29 o 16 480.623 4.29008 4100.31     99.2435  4089.49     107.252  305.802    118.665     53.2455     298.665     
1 1 1 13 3  30 o 2  463.898 4.2769  3839.14     97.3779  3791        101.41   339.62     17.7254     40.4651     17.7253     
1 1 1 13 3  31 o 8  101.331 2.23412 178.825     10.8194  185.478     11.836   3.63769    139.918     17.0377     319.918     
1 1 1 13 3  32 o 11 500.517 4.46806 4411.11     107.669  4472.71     116.363  346.895    248.51      0.672612    248.51      
1 1 1 13 3  33 o 3  629.217 5.4897  6989.91     162.384  7056.46     183.288  450.114    194.127     24.9731     194.127     
1 1 1 13 3  34 o 15 413.793 3.87001 3047.2      77.062   3024.26     83.2963  294.572    12.3203     21.3452     12.3203     
1 1 1 13 3  35 o 13 425.664 4.05853 3195.32     82.8664  3230.36     90.1686  302.275    343.463     19.9435     343.463     
1 1 1 13 3  36 o 18 387.257 3.6635  2651.37     68.2776  2666.58     73.8248  289.447    356.499     50.0047     356.499     
1 1 1 13 3  37 o 1  134.312 2.26359 313.584     14.2668  325.913     16.1779  52.9393    3.96336     55.3133     183.963     
1 1 1 13 3  38 o 11 198.984 2.51569 715.191     23.4852  688.565     26.5301  123.668    298.281     9.61518     118.281     
1 1 1 13 3  39 o 14 123.539 2.29855 270.179     13.3049  271.044     15.0865  61.399     271.794     6.27982     271.794     
1 1 1 13 3  40 o 19 259.736 3.01003 1182.85     38.312   1209.41     40.0442  100.24     117.891     149.192     297.891     
1 1 1 13 3  41 o 9  506.243 5.21314 4609.54     118.13   4491.63     144.676  302.039    266.216     89.1386     86.2162     
1 1 1 13 3  42 o 5  132.961 2.31187 305.049     15.0973  321.796     15.7138  58.7242    234.65      41.76       54.65       
1 1 1 13 3  43 o 10 174.755 2.45103 521.752     20.524   561.369     22.4128  107.587    77.4375     7.42273     257.438     
1 1 1 13 3  44 o 3  389.012 3.67525 2665.29     67.2163  2703.91     75.8782  314.315    181.441     102.992     181.441     
1 1 1 13 3  45 o 2  40.9274 2.89895 32.9925     5.49523  27.1561     6.09867  7.14327    204.189     22.9179     204.189     
1 1 1 13 3  46 o 19 166.529 2.42158 489.3       19.6014  494.014     20.8046  150.212    29.1076     110.111     29.1076     
1 1 1 13 3  47 o 7  339.001 3.3925  2021.69     59.0509  2055.83     56.1539  210.22     249.713     35.683      69.713      
1 1 1 13 3  48 o 6  284.773 3.05551 1441.36     45.3918  1435.43     41.7508  160.478    29.5869     59.6461     209.587     
1 1 1 13 3  49 o 17 463.687 4.31631 3774.85     100.275  3861.37     100.315  313.791    259.18      3.9186      259.18      
1 1 1 13 3  50 o 16 295.383 3.25705 1542.04     50.3553  1553.95     45.9537  187.916    90.1997     16.6259     270.2       
1 1 1 13 3  51 o 15 149.3   2.38143 403.606     18.2193  386.954     17.4185  90.7151    259.611     5.64596     79.6114     
1 1 1 13 3  52 o 2  439.779 4.00247 3420.11     89.9596  3448.5      86.4105  310.984    275.922     35.9778     275.922     
1 1 1 13 3  53 o 17 178.441 2.58814 572.476     24.1694  556.976     22.0976  120.775    297.912     14.4911     297.912     
1 1 1 13 3  54 o 5  61.6086 2.89874 74.1248     8.67098  61.4415     9.02408  2.14122    350.219     51.4777     170.219     
1 1 1 13 3  55 o 7  195.738 2.64397 703.866     27.5881  655.762     24.2693  95.121     312.742     63.2508     132.742     
1 1 1 13 3  56 o 17 74.4684 2.55354 103.589     9.93897  93.7331     9.06924  22.3542    121.269     32.7166     301.269     
1 1 1 13 3  57 o 19 24.2991 5.30376 5.43592     7.4773   14.7281     7.42628  22.5781    107.134     53.8575     107.134     
1 1 1 13 3  58 f 0  142.219 3.12178 362.104     23.7806  356.878     20.5687  100.998    307.583     0           0           
1 1 1 13 3  59 o 12 69.0477 3.23311 87.1239     10.8468  83.0171     11.3762  27.3944    288.965     20.4429     108.965     
1 1 1 13 3  60 o 16 354.543 4.15595 2285.44     73.8759  2191.25     73.7838  276.71     168.387     92.2899     168.387     
1 1 1 13 3  61 o 5  56.0689 3.5985  61.0951     9.61016  51.8665     10.2598  18.5339    209.384     14.9853     29.384      
1 1 1 13 3  62 o 14 90.797  2.87085 142.18      12.5773  151.479     13.4857  46.0639    211.549     16.9838     31.5486     
1 1 1 13 3  63 o 16 65.1084 3.16187 72.0548     9.83774  79.5709     10.676   24.8496    220.886     23.3243     40.8855     
1 1 1 13 3  64 o 1  76.5977 2.88157 104.513     11.1528  104.787     10.8881  39.7641    39.1031     9.57121     219.103     
1 1 1 13 3  65 o 10 108.091 2.76758 208.698     15.0815  207.551     14.852   48.9311    290.305     36.0497     110.304     
1 1 1 13 3  66 o 1  83.6388 2.90844 126.089     11.4909  123.664     12.7665  16.9333    204.095     68.2966     24.0946     
1 1 1 13 3  67 o 17 118.711 2.58097 250.316     15.4212  251.729     15.2501  45.4813    41.8536     56.797      221.854     
1 1 1 13 3  68 o 13 179.668 2.70486 568.346     24.4359  581.695     24.268   136.826    133.672     48.4024     133.672     
1 1 1 13 3  69 o 14 61.4426 2.98354 71.6666     9.30669  63.8127     8.94867  39.734     175.222     9.44416     175.222     
1 1 1 13 3  70 o 6  52.4323 3.46272 44.6908     9.17935  54.8787     8.64843  31.9374    357.22      5.03918     357.22      
1 1 1 13 3  71 o 15 80.7989 2.86074 121.965     11.8391  111.994     11.2561  57.4603    352.682     17.7113     352.682     
1 1 1 13 3  72 o 13 149.706 2.85421 392.669     22.3456  409.559     20.342   97.3257    137.32      8.78183     137.32      
1 1 1 13 3  73 o 11 27.5221 4.93035 8.12545     7.81223  19.9736     6.59503  5.25828    348.978     13.1799     168.978     
1 1 1 13 3  74 o 19 60.6343 3.6853  63.6623     11.5195  70.0051     10.5592  42.7498    243.839     15.8324     243.839     
1 1 1 13 3  75 o 13 72.5665 4.01143 99.7043     17.979   92.3754     9.95017  36.3844    173.794     14.2972     353.794     
1 1 1 13 3  76 o 7  37.1508 5.2285  32.0305     11.2152  21.0954     7.6598   4.6874     300.802     52.1935     300.802     
1 1 1 13 3  77 o 7  66.6708 4.43072 76.721      16.4991  87.1799     11.8646  35.6474    167.155     7.71038     347.155     
1 1 1 13 3  78 o 7  33.2692 6.598   25.33       12.0122  18.3563     10.987   13.9822    138.287     6.32184     318.287     
1 1 1 13 3  79 o 15 79.6657 4.09003 125.26      17.5748  108.574     14.8759  50.169     234.299     5.44724     234.299     
1 1 1 13 3  80 o 19 46.1748 5.21203 49.9295     12.2858  32.6849     10.903   30.8637    11.7975     10.6022     11.7975     
1 1 1 13 3  81 o 9  38.2413 5.81869 34.5664     11.1124  23.7312     10.6004  15.9203    152.867     10.7028     332.867     
1 1 1 13 3  82 o 16 39.0145 5.96868 25.4041     11.9641  35.6878     10.7473  25.6777    51.6613     15.8502     51.6613     
1 1 1 13 3  83 o 9  58.8772 4.61671 63.8902     13.3363  67.758      13.4419  25.2997    186.892     17.6758     6.89223     
1 1 1 13 3  84 o 8  19.7846 5.8815  4.49913     9.92548  0.806227    9.9508   1.65012    159.241     8.23015     339.241     
1 1 1 13 3  85 o 12 51.5324 5.1408  52.8138     12.9267  50.4849     12.8831  25.4809    221.201     6.67844     41.2009     
1 1 1 13 3  86 o 19 41.9995 7.31144 44.664      16.8454  31.2258     13.8334  21.2174    303.888     2.52837     123.888     
1 1 1 13 3  87 o 16 48.955  7.0539  47.4788     17.8856  52.9198     15.4713  28.772     104.399     3.67721     104.399     
1 1 1 13 3  88 f 0  21.5058 6.66531 -2.72398    14.9793  3.65162     12.8153  16.9538    315.034     0           0           
1 1 1 13 3  89 o 13 55.1734 7.73639 49.2398     19.3238  87.7524     22.0784  32.6423    38.3871     4.44705     38.3871     
1 1 1 13 3  90 o 8  56.1677 8.8575  96.5602     25.8389  58.0001     23.2949  33.7122    341.533     6.64274     341.533     
1 1 1 13 3  91 o 14 49.8276 9.39592 73.6965     25.4746  56.2867     22.4265  32.0498    359.129     14.6234     359.129     
1 1 1 13 3  92 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 4  0  o 6  948.449 9.33968 15958.1     443.728  15958.1     443.728  775.553    180         177.43      180         
1 1 1 13 4  1  o 19 372.924 4.1644  2435.63     79.8171  2494.02     75.7274  249.036    182.752     17.697      2.75205     
1 1 1 13 4  2  o 1  330.43  3.70735 1950.03     61.393   1919.89     61.3859  246.371    160.346     47.2051     160.346     
1 1 1 13 4  3  o 5  660.569 5.98839 7795.91     202.531  7675.3      193.911  580.366    3.46355     222.031     3.46355     
1 1 1 13 4  4  o 16 948.246 8.55338 16015       406.447  15883.4     406.471  735.383    319.688     108.077     319.688     
1 1 1 13 4  5  o 7  908.428 8.41722 14724.9     373.895  14549.9     392.156  642.71     87.3797     19.8907     267.38      
1 1 1 13 4  6  o 12 348.445 3.52387 2155.13     61.529   2148.11     61.5388  142.141    216.364     201.515     36.3638     
1 1 1 13 4  7  o 17 617.326 5.34798 6673.34     162.122  6837.38     168.772  381.159    189.272     118.168     9.27176     
1 1 1 13 4  8  o 5  1201.73 9.86641 25360.8     594.114  25891.4     594.224  678.756    252.056     374.103     72.0558     
1 1 1 13 4  9  o 4  619.709 5.32739 6720.67     165.419  6894.62     165.458  413.052    329.609     56.5208     149.609     
1 1 1 13 4  10 o 5  484.136 4.9282  4134.24     119.552  4174.69     119.583  355.387    294.584     30.0386     294.584     
1 1 1 13 4  11 o 5  291.549 3.29092 1490.94     50.1807  1521.74     45.8385  178.779    5.02873     34.8387     185.029     
1 1 1 13 4  12 o 1  625.732 5.85699 6877.45     175.163  7004.98     191.923  371.361    150.439     148.771     330.439     
1 1 1 13 4  13 o 8  515.672 4.7978  4581.08     121.269  4847.35     126.725  273.146    329.422     184.584     149.422     
1 1 1 13 4  14 o 9  907.067 7.98781 14388.7     355.143  14798.8     371.054  762.008    199.268     227.895     199.268     
1 1 1 13 4  15 o 18 578.823 5.23374 5891.75     145.374  5986.22     158.086  399.599    345.272     20.8212     165.272     
1 1 1 13 4  16 o 12 390.961 4.13709 2739.41     74.9718  2678.75     86.5869  277.354    61.1159     13.4715     61.1158     
1 1 1 13 4  17 o 2  290.439 3.21408 1490.4      43.6184  1499.35     49.7602  172.315    126.314     46.333      306.314     
1 1 1 13 4  18 o 14 572.76  5.35694 5896.52     143.238  5734.81     163.327  475.558    11.5456     146.503     11.5456     
1 1 1 13 4  19 o 17 363.341 3.62452 2336.95     63.1873  2342.3      68.6981  305.483    284.652     123.133     284.652     
1 1 1 13 4  20 o 9  578.218 5.26191 5987.17     145.918  5866.73     158.624  341.428    113.547     132.642     293.547     
1 1 1 13 4  21 o 1  365.416 3.6598  2361.14     64.166   2371.8      69.7693  283.224    265.022     73.8975     265.022     
1 1 1 13 4  22 o 9  584.821 5.20515 6105.88     146.01   6020.48     158.732  359.157    50.8829     103.709     230.883     
1 1 1 13 4  23 o 11 846.471 7.40218 12801.2     300.547  12618.5     326.708  404.351    239.829     391.306     59.8292     
1 1 1 13 4  24 o 7  733.005 6.20511 9436.83     219.038  9619.28     236.65   520.003    240.378     8.19306     240.378     
1 1 1 13 4  25 o 16 1162.02 9.54446 23886.4     534.01   24063.1     576.925  893.91     12.346      142.214     12.346      
1 1 1 13 4  26 o 4  201.936 2.53035 721.444     24.5828  723.801     26.5945  88.9627    11.3151     67.2004     191.315     
1 1 1 13 4  27 f 0  1569.47 12.7422 43687.2     962.885  43973.7     1040.27  992.181    230.285     0           0           
1 1 1 13 4  28 o 8  358.192 3.51992 2249.71     61.8907  2298.53     64.4739  268.174    202.039     52.7468     202.039     
1 1 1 13 4  29 o 12 599.552 5.30116 6420.54     149.317  6328.72     168.515  436.634    328.365     36.4346     328.365     
1 1 1 13 4  30 o 14 440.753 4.11836 3453.42     85.2867  3434.47     96.2813  353.694    171.448     101.264     171.448     
1 1 1 13 4  31 o 4  484.5   4.5012  4178.52     104.58   4146.02     113.77   296.712    12.0131     79.8961     192.013     
1 1 1 13 4  32 o 10 679.99  5.93131 8250.11     189.501  8158.46     213.863  509.99     129.259     70.6372     129.259     
1 1 1 13 4  33 o 7  369.607 3.65287 2418.4      64.7406  2425.35     70.4669  291.601    313.667     79.3864     313.667     
1 1 1 13 4  34 o 19 379.029 3.70081 2592.62     65.8283  2501.98     74.3371  276.808    58.4133     34.5507     58.4133     
1 1 1 13 4  35 o 5  377.746 3.61117 2498.29     64.1281  2561.8      72.4365  205.189    314.607     109.61      134.607     
1 1 1 13 4  36 o 12 115.278 2.36717 236.881     12.9627  234.582     14.3179  40.3651    29.6149     8.05692     29.6149     
1 1 1 13 4  37 o 3  40.8074 3.01635 27.1432     5.4944   32.6702     6.67385  45.3548    268.472     110.173     268.472     
1 1 1 13 4  38 o 17 548.397 4.88453 5293.68     125.933  5380.8      142.177  408.656    108.417     61.3572     108.417     
1 1 1 13 4  39 o 13 205.877 2.65311 732.708     26.6944  770.273     28.0561  147.213    47.9104     30.4789     47.9104     
1 1 1 13 4  40 o 19 200.913 2.73224 703.126     24.2531  728.239     30.5122  103.214    41.8052     56.3652     221.805     
1 1 1 13 4  41 o 11 150.058 2.59372 377.767     18.0356  421.199     20.9798  74.2763    206.246     37.7374     26.2463     
1 1 1 13 4  42 o 15 333.13  3.41284 1935.27     52.0462  2001.5      61.6482  244.954    257.722     40.119      257.722     
1 1 1 13 4  43 o 8  380.989 3.6381  2525.06     65.1933  2625.26     73.6185  287.264    192.311     57.7181     192.311     
1 1 1 13 4  44 o 10 358.113 3.45876 2222.59     58.2619  2327.75     65.803   306.688    16.1281     129.964     16.1281     
1 1 1 13 4  45 o 9  109.945 2.32731 207.815     12.2094  221.26      13.4078  70.655     354.332     23.6367     354.332     
1 1 1 13 4  46 o 18 30.9482 3.69322 12.4598     5.08979  23.2594     5.85573  38.7493    157.708     94.5325     157.708     
1 1 1 13 4  47 o 17 282.383 3.11006 1410.96     42.5463  1417.83     45.436   210.911    107.383     45.2303     107.383     
1 1 1 13 4  48 o 2  246.811 2.82376 1082.28     34.9153  1078.41     34.9372  156.61     204.077     14.2394     24.0774     
1 1 1 13 4  49 o 14 83.2279 2.53899 121.717     10.0934  124.406     11.0249  32.1173    160.11      12.7109     340.11      
1 1 1 13 4  50 o 6  350.286 3.6814  2161.04     67.464   2194.75     61.6025  267.241    284.548     67.6169     284.548     
1 1 1 13 4  51 o 12 317.017 3.30779 1765.56     52.5333  1801.17     52.5648  235.187    159.303     50.0806     159.303     
1 1 1 13 4  52 o 6  212.639 2.84497 759.937     28.986   845.292     31.6661  149.86     277.014     24.026      277.014     
1 1 1 13 4  53 o 1  96.9539 2.53773 156.27      12.4016  177.958     12.1592  53.8627    32.0972     8.55899     32.0972     
1 1 1 13 4  54 o 12 176.702 2.84246 542.488     24.579   565.489     25.7649  109.789    291.464     6.66874     111.464     
1 1 1 13 4  55 o 8  201.041 2.85489 718.952     29.9933  715.303     27.4838  125.558    152.636     8.76295     332.637     
1 1 1 13 4  56 o 11 152.918 2.8491  402.266     20.7871  428.445     22.8421  75.4135    55.3199     44.4085     235.32      
1 1 1 13 4  57 o 16 230.487 3.18968 882.129     35.9902  1006.57     37.6669  148.174    121.578     3.52615     301.578     
1 1 1 13 4  58 o 9  176.646 2.78585 562.52      27.4154  545.344     21.653   90.1576    108.131     47.8956     288.131     
1 1 1 13 4  59 o 2  175.733 3.108   560.769     29.6956  536.984     24.8998  128.011    266.381     31.543      266.381     
1 1 1 13 4  60 o 1  30.9166 5.3853  18.0039     7.92913  17.4969     8.6553   3.11994    52.054      12.4961     52.054      
1 1 1 13 4  61 o 2  129.395 2.83429 291.28      17.3388  304.321     19.3565  95.5176    36.0683     30.883      36.0683     
1 1 1 13 4  62 o 6  70.5234 3.03278 96.4439     10.334   81.4014     10.883   19.4196    325.816     44.4162     145.816     
1 1 1 13 4  63 o 14 117.909 2.6018  238.808     14.9893  255.962     15.7235  58.7346    359.922     30.1096     179.922     
1 1 1 13 4  64 o 8  126.878 2.72041 287.449     16.3897  285.68      18.1154  84.6733    329.514     11.4546     329.514     
1 1 1 13 4  65 o 8  79.9975 2.83343 117.237     11.0054  111.198     11.6093  54.2381    150.191     18.5334     150.191     
1 1 1 13 4  66 o 9  63.2205 2.97011 80.8823     9.18385  62.7469     9.37876  36.1243    329.661     9.98563     329.661     
1 1 1 13 4  67 o 3  76.2531 2.99174 102.889     11.5551  105.084     11.2127  39.2598    196.147     11.8664     16.1473     
1 1 1 13 4  68 o 11 183.309 2.82507 594.055     26.0622  604.123     25.8383  106.165    14.215      19.2089     194.215     
1 1 1 13 4  69 o 4  34.5186 4.51953 27.8685     7.76577  16.9835     7.23564  12.7023    325.741     5.70701     145.741     
1 1 1 13 4  70 o 10 75.5805 2.96321 106.891     11.6771  97.9892     10.6875  28.3065    255.363     36.1517     75.3629     
1 1 1 13 4  71 o 12 14.438  4.42572 -6.19739    7.26656  1.81085     5.28605  14.8872    40.9038     39.5652     40.9038     
1 1 1 13 4  72 o 3  40.736  4.71848 22.3679     9.83486  40.5136     7.66625  8.6024     303.144     29.301      123.144     
1 1 1 13 4  73 o 15 62.8113 3.60424 63.5091     12.2251  80.0214     9.61758  11.4191    132.102     53.2749     312.102     
1 1 1 13 4  74 o 8  94.3232 3.26213 167.353     17.5911  153.559     12.9617  58.7283    52.8917     2.60873     52.8918     
1 1 1 13 4  75 o 2  105.433 2.98679 219.775     17.1436  180.937     14.3904  71.188     7.80246     14.0404     7.80245     
1 1 1 13 4  76 f 0  58.1573 3.83663 72.4308     12.9736  52.0696     9.20353  31.7665    246.405     0           0           
1 1 1 13 4  77 o 7  21.2925 5.28265 5.08849     8.1008   9.24736     6.25859  2.43583    116.715     4.70753     296.715     
1 1 1 13 4  78 o 4  70.0636 3.50235 99.2899     12.1044  80.0434     12.1989  35.9328    293.367     11.8367     113.367     
1 1 1 13 4  79 o 7  31.2735 5.69536 25.3107     10.0963  13.653      8.13101  12.9402    222.319     6.7579      42.3193     
1 1 1 13 4  80 o 1  35.2694 5.6212  27.5731     10.6642  21.6202     8.75792  19.4669    237.413     1.92364     237.413     
1 1 1 13 4  81 o 4  100.654 3.57086 187.906     17.8701  183.881     18.0349  66.1357    18.1173     12.2664     18.1173     
1 1 1 13 4  82 o 15 57.3436 4.61835 63.6062     13.052   61.2117     13.015   36.5129    142.119     7.22843     142.119     
1 1 1 13 4  83 o 5  52.2671 5.55432 62.0519     14.7314  45.765      13.3812  26.382     348.07      6.7623      168.07      
1 1 1 13 4  84 o 6  34.0793 6.34833 32.8136     11.2461  14.8935     11.9017  7.70979    212.613     21.2085     32.6129     
1 1 1 13 4  85 o 16 96.7637 4.17503 175.354     20.4406  175.677     19.8518  57.5934    32.9445     2.19403     32.9443     
1 1 1 13 4  86 o 12 42.6175 7.39181 27.5645     17.3139  50.3391     15.1634  28.2884    62.4698     13.4242     62.4697     
1 1 1 13 4  87 o 15 30.747  7.5542  10.6525     16.4809  25.8523     13.7962  14.8592    297.409     6.15012     297.409     
1 1 1 13 4  88 o 16 20.7675 6.5449  1.19139     14.8908  -2.56428    12.5894  4.06122    108.029     5.32755     288.029     
1 1 1 13 4  89 o 19 30.4551 8.24231 21.065      16.582   18.1524     18.7644  7.67498    170.118     15.3888     350.118     
1 1 1 13 4  90 o 6  31.9012 8.62473 40.5964     22.1675  4.91635     18.9173  12.9977    209.685     1.7957      29.6846     
1 1 1 13 4  91 o 10 30.009  8.68806 27.3236     22.3507  13.3825     19.3762  8.89198    100.162     0.0478371   100.162     
1 1 1 13 4  92 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 5  0  o 14 967.803 8.34869 16611.8     404.781  16611.8     404.781  912.891    5.85384e-06 423.013     5.85384e-06 
1 1 1 13 5  1  o 14 526.117 4.72713 4908.16     127.103  4903.88     122.12   442.115    324.34      141.882     324.34      
1 1 1 13 5  2  o 7  893.092 7.41574 14148.6     331.903  14139.7     331.903  775.576    245.973     268.683     245.973     
1 1 1 13 5  3  o 9  898.997 7.7227  14285.4     347.917  14380.4     347.934  760.67     211.906     229.924     211.906     
1 1 1 13 5  4  o 12 1064.04 9.12401 20219.5     486.516  19953       486.518  856.069    15.5257     179.383     15.5257     
1 1 1 13 5  5  o 10 373.53  3.85751 2498.6      72.2129  2446.88     72.1998  323.996    44.825      140.037     44.825      
1 1 1 13 5  6  o 9  267.055 3.19203 1258.16     41.6968  1269.5      43.7271  104.344    234.375     154.709     54.3749     
1 1 1 13 5  7  o 16 860.85  7.80892 13103.9     321.247  13181.7     351.907  620.563    307.211     4.54429     307.211     
1 1 1 13 5  8  o 10 1356.76 11.5671 32601       753.047  32768.6     818.692  1040.52    179.805     124.32      179.805     
1 1 1 13 5  9  o 9  665.582 5.90729 7754.44     188.727  7953.18     205.19   573.543    177.678     199.85      177.678     
1 1 1 13 5  10 o 6  728.766 6.83723 9320.17     243.727  9514.8      255.645  590.065    51.6072     139.276     51.6072     
1 1 1 13 5  11 o 9  289.279 3.29308 1451.91     49.7974  1514.33     45.4774  227.726    358.319     75.8887     358.319     
1 1 1 13 5  12 o 6  430.461 4.01227 3342.28     84.7593  3226.21     88.2312  223.598    46.9218     159.91      226.922     
1 1 1 13 5  13 o 2  969.008 8.16243 16432.8     388.407  16880.4     404.345  711.788    212.319     33.6949     212.319     
1 1 1 13 5  14 o 5  215.926 2.58559 829.804     27.9709  822.569     27.9857  133.25     231.299     1.78644     231.299     
1 1 1 13 5  15 o 2  784.596 6.84223 10804.8     268.976  11027.7     269.069  530.767    156.169     58.9652     336.169     
1 1 1 13 5  16 o 19 1020.53 8.94432 18490.3     447.297  18467.6     467.345  754.122    218.87      47.7408     218.87      
1 1 1 13 5  17 o 14 283.67  3.14408 1420.12     43.6891  1431.9      45.6879  182.144    141.407     11.7821     321.407     
1 1 1 13 5  18 f 0  387.461 3.91434 2555.78     72.5072  2767.72     79.5312  219.986    99.6129     0           0           
1 1 1 13 5  19 o 15 549.46  5.11088 5463.38     137.529  5241.57     143.694  520.239    156.744     277.933     156.744     
1 1 1 13 5  20 o 2  428.31  4.27647 3266.1      91.7643  3237.04     91.8178  256.088    29.0522     82.8554     209.052     
1 1 1 13 5  21 o 8  320.162 3.3829  1791.71     53.0656  1841.66     55.4879  260.001    288.259     106.013     288.259     
1 1 1 13 5  22 o 10 292.581 3.28723 1501.33     45.9509  1532.93     50.3868  221.057    198.799     70.8714     198.799     
1 1 1 13 5  23 o 10 574.586 5.34461 5874.54     150.49   5832.38     157.206  430.701    12.6188     58.1902     12.6188     
1 1 1 13 5  24 o 11 173.692 2.53669 539.011     21.0346  530.241     23.0618  64.6891    51.8542     12.0981     51.8542     
1 1 1 13 5  25 o 9  611.208 5.63055 6623.91     168.656  6625        176.192  354.565    204.715     150.355     24.7147     
1 1 1 13 5  26 o 11 98.9887 2.42477 170.066     11.9662  177.679     12.0521  13.0948    211.597     92.8792     211.597     
1 1 1 13 5  27 o 5  633.106 5.70625 7075.1      173.344  7142.56     188.498  525.15     27.4495     164.326     27.4495     
1 1 1 13 5  28 o 10 689.616 6.13075 8379.97     202.876  8493.4      220.615  502.532    182.603     36.3042     182.603     
1 1 1 13 5  29 o 15 635.211 5.84697 7155.89     182.011  7159.84     190.156  479.445    205.485     68.8788     205.485     
1 1 1 13 5  30 o 10 288.39  3.16948 1450.5      43.8518  1498.02     47.7327  116.641    323.47      161.152     143.47      
1 1 1 13 5  31 o 6  174.628 2.46483 522.619     20.6002  558.583     22.5439  58.2298    230.869     108.561     50.869      
1 1 1 13 5  32 o 4  190.913 2.56148 658.429     22.8908  633.646     25.9609  111.393    353.681     20.8346     173.681     
1 1 1 13 5  33 o 1  773.62  6.65113 10636.1     241.826  10618.6     272.921  574.306    165.734     66.3886     165.734     
1 1 1 13 5  34 o 4  602.857 5.4437  6410.7      150.144  6488.86     177.776  472.782    247.734     106.691     247.734     
1 1 1 13 5  35 o 1  510.764 4.67183 4609.88     114.465  4646.64     124.526  408.32     69.2083     109.61      69.2083     
1 1 1 13 5  36 o 1  247.731 2.88992 1087.03     34.2863  1088.87     37.4042  153.223    86.1376     25.5607     266.138     
1 1 1 13 5  37 o 19 284.478 3.04806 1428.06     40.7259  1441.56     46.0436  202.939    249.317     22.9319     249.317     
1 1 1 13 5  38 o 10 421.692 4.04424 3129.8      81.8045  3179.37     89.0268  294.986    297.217     11.3869     297.217     
1 1 1 13 5  39 o 4  131.569 2.37079 306.746     14.8416  307.16      16.3695  75.1087    123.93      17.2318     123.93      
1 1 1 13 5  40 o 8  125.281 2.55865 285.233     14.6533  271.799     17.2628  60.9578    59.947      21.8199     239.947     
1 1 1 13 5  41 o 1  623.553 5.50128 6804.59     164.62   7010.81     179.078  481.648    76.2778     105.763     76.2778     
1 1 1 13 5  42 o 17 225.112 2.68628 856.726     28.9545  941.196     31.6715  105.404    96.1524     91.2037     276.152     
1 1 1 13 5  43 f 0  245.488 2.86273 1045.6      33.6622  1091.89     36.7613  138.276    165.305     0           0           
1 1 1 13 5  44 o 17 354.771 3.67154 2119.36     62.1945  2349.93     68.4008  244.621    206.511     7.47124     206.511     
1 1 1 13 5  45 f 0  211.993 2.66817 774.88      27.0984  819.2       29.5922  145.539    261.034     0           0           
1 1 1 13 5  46 o 16 287.193 3.0139  1421.07     40.7017  1505.33     46.0158  263.483    104.708     145.906     104.708     
1 1 1 13 5  47 o 14 283.965 3.04534 1401.43     41.4689  1459.48     45.1875  152.28     352.421     76.7428     172.421     
1 1 1 13 5  48 o 14 274.837 3.07337 1315.31     38.8659  1364.78     45.6366  219.775    20.8194     75.0626     20.8194     
1 1 1 13 5  49 o 4  97.4986 2.46895 152.293     11.1618  186.109     12.9482  49.4621    356.826     6.37698     176.826     
1 1 1 13 5  50 o 5  137.993 2.59538 339.843     17.0513  336.043     18.7616  108.789    163.643     60.6717     163.643     
1 1 1 13 5  51 o 14 197.544 2.73348 683.319     27.1119  701.047     27.0048  107.569    334.318     42.8366     154.318     
1 1 1 13 5  52 o 5  415.174 4.28651 2988.85     89.1522  3136.76     89.1805  313.288    123.315     73.1577     123.315     
1 1 1 13 5  53 o 11 159.339 2.63291 451.335     21.5933  449.331     20.4415  91.297     165.226     20.7226     345.226     
1 1 1 13 5  54 o 7  126.738 2.45687 285.783     16.2337  284.427     14.9209  93.299     266.615     38.0808     266.615     
1 1 1 13 5  55 o 15 318.423 3.5921  1805.56     57.3258  1796.19     57.3158  247.405    10.7952     75.8673     10.7952     
1 1 1 13 5  56 o 5  308.653 3.46407 1693        54.96    1691.49     52.168   187.895    250.422     30.6613     70.4218     
1 1 1 13 5  57 f 0  75.3805 2.78648 108.945     11.417   93.6168     9.57595  20.6507    206.478     0           0           
1 1 1 13 5  58 o 13 48.0741 3.604   44.7954     9.03317  38.4189     8.07676  3.21701    73.8709     38.2387     253.871     
1 1 1 13 5  59 o 4  57.3038 3.44734 56.5362     10.7448  61.1267     8.63168  7.09198    223.257     49.187      43.257      
1 1 1 13 5  60 o 13 216.074 2.87271 820.266     30.3913  838.84      31.8189  158.428    159.508     38.1318     159.508     
1 1 1 13 5  61 o 6  118.723 2.69577 254.665     15.6428  246.738     16.3703  45.7112    305.778     58.6711     125.778     
1 1 1 13 5  62 o 3  81.0004 3.30493 102.028     13.0589  133.389     13.5291  55.4956    198.554     21.1339     198.554     
1 1 1 13 5  63 o 9  38.2365 4.89431 34.1884     8.38425  20.4464     9.33163  3.09597    184.675     7.13024     4.67485     
1 1 1 13 5  64 o 1  92.7272 2.88461 153.442     13.0284  153.259     13.7058  58.3839    227.237     5.32397     227.237     
1 1 1 13 5  65 o 6  19.4379 5.35422 5.22629     6.9367   3.01414     8.18738  1.60039    254.564     4.10963     254.564     
1 1 1 13 5  66 o 9  89.2752 3.15457 136.994     13.5462  148.167     14.5965  19.921     184.925     70.5814     4.92454     
1 1 1 13 5  67 o 6  129.952 3.11051 305.74      19.6797  297.78      20.7441  112.479    226.225     64.8677     226.225     
1 1 1 13 5  68 o 11 117.191 2.92296 243.76      18.2884  247.004     15.8851  73.2937    199.276     0.0727751   19.2764     
1 1 1 13 5  69 f 0  87.1601 3.12273 133.855     14.5847  138.529     12.4767  25.9598    215.94      0           0           
1 1 1 13 5  70 o 19 26.0354 5.02301 4.19662     8.33093  19.2282     6.78299  3.04244    294.56      31.6858     294.56      
1 1 1 13 5  71 o 10 64.4154 3.40869 70.0581     11.4599  79.9455     10.2145  35.3004    125.873     6.55927     305.873     
1 1 1 13 5  72 o 12 38.6291 4.34228 32.6623     8.48644  23.1385     7.70673  17.5938    274.409     5.794       94.4093     
1 1 1 13 5  73 o 18 24.5921 5.70988 8.95741     8.35461  12.5993     8.04543  2.86331    23.5512     13.5975     203.551     
1 1 1 13 5  74 o 13 119.826 2.81614 264.356     17.2447  251.023     16.5325  91.2487    233.98      35.7068     233.98      
1 1 1 13 5  75 o 15 58.3625 3.46805 63.7345     10.6239  60.055      9.46753  37.4645    305.293     6.97878     305.293     
1 1 1 13 5  76 o 18 51.1882 3.76127 50.7232     10.0879  45.3294     8.93516  37.4767    288.147     18.416      288.147     
1 1 1 13 5  77 o 15 17.1935 4.97162 -0.485291   7.71761  4.10099     6.21476  0.733583   334.177     10.5954     334.177     
1 1 1 13 5  78 o 17 45.5454 4.34318 34.9977     10.2387  42.6768     8.70842  20.1287    60.7143     12.5354     240.714     
1 1 1 13 5  79 o 10 23.6717 5.53914 13.8212     8.60116  7.0585      6.85695  5.3908     140.707     0.206893    140.707     
1 1 1 13 5  80 o 12 42.171  4.35534 29.7066     9.13096  37.6892     8.51442  23.5401    316.377     0.33047     136.377     
1 1 1 13 5  81 o 3  31.9411 5.49323 30.9342     8.7072   8.83433     10.4446  14.2514    144.699     4.76367     324.699     
1 1 1 13 5  82 o 16 99.6725 3.67826 181.865     16.5912  184.918     19.8792  67.8949    33.8794     17.6067     33.8794     
1 1 1 13 5  83 o 2  39.9631 6.21286 35.0853     11.6603  30.0386     12.5638  15.4961    162.72      13.0366     342.72      
1 1 1 13 5  84 o 3  42.5756 6.10525 30.9236     12.0465  43.1392     13.1512  25.2101    216.357     5.85814     216.357     
1 1 1 13 5  85 o 9  105.07  4.27132 214.637     23.5697  200.386     21.2154  72.3966    206.881     21.8846     206.881     
1 1 1 13 5  86 o 14 33.4993 7.27544 40.1862     16.1062  5.94617     14.0951  16.8027    47.6095     0.200888    227.609     
1 1 1 13 5  87 o 18 24.2458 6.81303 -11.2268    15.2998  18.0612     13.3117  6.17949    78.4126     0.795944    78.4126     
1 1 1 13 5  88 o 7  23.7472 7.25958 7.97981     15.3512  -0.0918165  16.6986  5.95792    166.607     0.305812    346.607     
1 1 1 13 5  89 o 4  29.2787 8.22812 16.8166     16.5319  18.5876     19.6041  10.8749    289.585     1.89241     289.585     
1 1 1 13 5  90 o 13 34.3235 9.44765 41.4936     26.6525  22.0869     20.0074  14.2588    226.65      4.71844     226.65      
1 1 1 13 5  91 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 6  0  o 1  1037.02 8.8994  19075       462.344  19075       462.344  786.236    180         68.1334     180         
1 1 1 13 6  1  o 18 337.461 3.51639 2003.86     58.1649  2032.45     60.7581  152.873    235.065     165.844     55.0647     
1 1 1 13 6  2  o 11 901.92  7.97755 14384.7     368.295  14471.4     352.639  581.041    105.585     138.294     285.585     
1 1 1 13 6  3  o 17 528.236 4.8298  4919.09     127.851  4972.63     127.857  409.445    108.136     69.3991     108.136     
1 1 1 13 6  4  o 8  466.002 4.35847 3812.79     101.777  3885.04     101.785  244.395    157.416     173.487     337.416     
1 1 1 13 6  5  o 7  207.3   2.69213 755.761     28.5636  767.244     27.3481  97.2408    0.514044    70.746      180.514     
1 1 1 13 6  6  o 10 333.262 3.57321 1982.81     62.3575  1953.75     56.9092  187.693    70.9017     87.2099     250.902     
1 1 1 13 6  7  o 7  1050.69 9.67109 19479       471.643  19703       544.579  790.117    122.226     65.7009     122.226     
1 1 1 13 6  8  o 3  629.245 5.71371 6971.91     176.236  7067        184.078  464.545    0.435136    30.4782     0.435136    
1 1 1 13 6  9  o 1  499.865 4.7998  4499.16     120.232  4359.18     120.219  137.02     122.956     439.891     302.956     
1 1 1 13 6  10 o 6  1011.13 9.45063 18024.5     478.863  18261.6     478.888  632.686    50.4099     190.554     230.41      
1 1 1 13 6  11 o 17 863.446 7.96564 13188.2     336.387  13260.2     352.819  739.672    315.495     242.418     315.495     
1 1 1 13 6  12 o 19 793.466 7.20212 11115.6     286.385  11215.2     286.38   610.577    82.865      85.6929     82.865      
1 1 1 13 6  13 o 16 1264.04 11.0516 28585.4     652.459  28158.9     743.952  904.02     357.064     10.6418     177.064     
1 1 1 13 6  14 o 12 457.39  4.28158 3729.82     98.1392  3686.17     98.1405  300.379    356.837     41.5971     176.837     
1 1 1 13 6  15 o 14 477.061 4.33905 4048.67     101.632  4019.01     105.782  241.443    31.5235     190.755     211.523     
1 1 1 13 6  16 o 8  299.379 3.12341 1583.22     45.9133  1593.45     47.7953  191.182    136.536     18.3676     316.536     
1 1 1 13 6  17 o 17 113.53  2.28987 235.222     12.4538  222.033     13.5148  2.82928    229.834     75.5986     229.834     
1 1 1 13 6  18 o 19 281.188 2.95078 1429.55     39.9178  1373.05     43.1059  76.4693    231.256     229.855     51.2562     
1 1 1 13 6  19 o 11 301.864 3.14453 1638.1      46.5934  1591.76     48.4918  231.002    248.153     72.0099     248.153     
1 1 1 13 6  20 o 1  707.288 6.20871 8981.91     210.558  8761.17     228.939  550.593    1.14974     101.429     1.14974     
1 1 1 13 6  21 o 15 208.564 2.68034 748.924     27.3785  793.085     28.6562  111.774    128.446     20.9705     308.446     
1 1 1 13 6  22 f 0  363.072 3.61739 2388.4      62.9424  2284.9      68.4341  233.634    300.019     0           0           
1 1 1 13 6  23 o 4  814.279 7.04486 11821.2     275.145  11705.4     299.184  604.422    134.906     55.0892     134.906     
1 1 1 13 6  24 o 9  286.433 3.12521 1479.53     42.9116  1428.8      46.6555  238.153    77.6397     111.451     77.6397     
1 1 1 13 6  25 o 19 478.867 4.45405 4025.98     102.361  4105.05     111.307  303.889    78.5381     61.6146     258.538     
1 1 1 13 6  26 o 17 578.159 5.1014  5916.3      144.82   5938.88     150.747  408.498    217.891     4.87327     217.891     
1 1 1 13 6  27 o 14 755.272 6.63299 10008.7     240.445  10237.3     261.441  511.224    285.874     44.0625     105.874     
1 1 1 13 6  28 o 11 953.22  8.23321 15914.6     393.173  16368.3     393.369  721.879    354.845     96.6049     354.845     
1 1 1 13 6  29 o 6  31.7061 3.80138 14.6419     5.60426  22.3787     5.96539  58.1175    28.1584     125.79      28.1584     
1 1 1 13 6  30 o 13 410.179 3.97916 2927.21     78.3198  3039.52     85.2317  331.919    156.245     97.6041     156.245     
1 1 1 13 6  31 o 3  301.477 3.25408 1581.67     47.0561  1640.97     51.246   242.076    255.274     77.2644     255.274     
1 1 1 13 6  32 o 1  53.8553 2.62498 46.7697     6.65758  56.7768     7.42838  50.6958    93.4489     140.438     93.4489     
1 1 1 13 6  33 o 14 714.937 6.37464 8986.13     218.707  9168.64     237.852  560.377    8.90457     120.358     8.90458     
1 1 1 13 6  34 o 18 527.108 4.87958 4838.37     123.442  5022.57     134.291  377.306    45.1856     21.2186     45.1856     
1 1 1 13 6  35 o 15 644.865 5.74726 7229.31     177.894  7540.81     193.511  517.665    263.169     137.67      263.169     
1 1 1 13 6  36 f 0  164.794 2.47634 457.053     19.5125  506.344     21.4022  156.22     358.223     0           0           
1 1 1 13 6  37 o 19 383.162 3.89033 2561.94     69.6538  2646.92     79.5659  309.343    176.846     95.0184     176.846     
1 1 1 13 6  38 o 10 220.066 2.9461  858.046     31.6407  859.289     33.3202  150.839    238.924     12.8683     238.923     
1 1 1 13 6  39 o 14 360.337 3.80104 2294.06     65.3806  2312.71     71.773   249.22     332.676     6.18628     332.676     
1 1 1 13 6  40 o 13 491.985 4.75293 4202.11     111.739  4393.46     122.578  336.594    279.861     3.99902     99.8609     
1 1 1 13 6  41 o 7  120.619 2.43284 258.426     14.1971  257.834     15.1672  54.7104    319.464     38.6522     139.464     
1 1 1 13 6  42 o 19 253.097 2.92686 1114.78     35.4633  1157.31     38.7622  153.063    182.623     36.0745     2.62313     
1 1 1 13 6  43 o 1  302.248 3.21064 1576.64     48.5259  1664.67     48.7144  264.7      102.812     122.257     102.812     
1 1 1 13 6  44 o 9  157.887 2.4739  429.947     18.5798  454.174     20.5621  63.3596    160.69      80.9208     340.69      
1 1 1 13 6  45 o 6  398.967 3.84869 2706.72     73.6738  2946        80.2611  302.859    339.955     64.1143     339.955     
1 1 1 13 6  46 o 17 483.379 4.6599  3993.95     107.661  4310.76     118.136  328.201    316.029     0.861472    136.029     
1 1 1 13 6  47 o 18 411.676 4.18628 2903.92     84.2257  3116.93     88.5244  315.126    162.452     73.9786     162.452     
1 1 1 13 6  48 o 16 52.2861 3.09767 51.8667     7.14204  45.9061     8.72216  6.74719    331.93      48.6087     331.93      
1 1 1 13 6  49 o 19 249.163 3.02845 1023.85     36.7431  1181.7      38.8634  180.539    140.577     31.607      140.577     
1 1 1 13 6  50 o 16 223.322 3.11952 846.733     34.1156  923.859     35.7108  144.184    202.174     5.41954     22.1735     
1 1 1 13 6  51 o 8  264.978 3.30551 1236.78     43.7765  1255.39     44.0121  166.828    74.1693     17.4967     254.169     
1 1 1 13 6  52 o 7  379.304 4.21695 2519.81     82.1122  2593.07     78.0819  276.901    347.185     48.2133     347.185     
1 1 1 13 6  53 o 5  142.996 2.49402 352.484     18.0842  373.257     17.6171  93.4948    101.561     8.15505     101.561     
1 1 1 13 6  54 o 2  202.744 2.88317 729.961     29.2835  728.919     29.3043  148.927    160.649     35.1087     160.649     
1 1 1 13 6  55 o 2  79.5875 2.837   105.634     10.3805  120.003     12.1853  38.7755    320.823     8.43882     140.823     
1 1 1 13 6  56 o 18 291.811 3.35402 1499.15     50.4181  1526.34     47.6104  206.777    359.434     29.4237     359.434     
1 1 1 13 6  57 o 19 244.95  3.02278 1049.44     37.906   1081.94     36.2557  158.604    131.961     3.5743      311.961     
1 1 1 13 6  58 o 17 238.844 3.1233  1020.11     37.4634  1007.32     37.305   159.702    35.659      7.76588     35.6591     
1 1 1 13 6  59 o 11 173.284 2.84607 516.611     24.7027  550.575     24.709   143.175    81.1191     65.635      81.1191     
1 1 1 13 6  60 o 9  85.3393 2.89595 133.81      12.9969  125.729     11.698   46.119     106.895     9.63995     286.895     
1 1 1 13 6  61 o 9  128.419 2.71238 308.455     17.8484  278.66      17.0224  91.8844    72.3525     23.0791     72.3525     
1 1 1 13 6  62 o 16 62.1019 3.20873 74.0921     10.6553  64.1525     9.19204  22.0602    49.3638     26.7875     229.364     
1 1 1 13 6  63 o 5  164.608 2.68375 497.805     22.9577  466.428     21.3253  116.654    73.4391     24.1362     73.4391     
1 1 1 13 6  64 o 7  186.707 2.9668  646.975     30.5505  595.593     24.8733  123.632    65.0687     9.17933     65.0687     
1 1 1 13 6  65 o 7  49.5234 4.32621 45.7503     11.4302  43.5503     9.52785  14.2034    158.975     3.28464     158.975     
1 1 1 13 6  66 o 11 59.6845 3.1507  74.6323     10.9596  54.0563     7.81155  22.5742    0.248388    24.4958     180.248     
1 1 1 13 6  67 o 4  13.8813 4.23849 -0.896259   6.9667   0.426751    3.67191  16.1289    317.279     39.4693     317.279     
1 1 1 13 6  68 o 9  50.1153 3.89893 52.0318     9.76442  39.6703     9.38436  19.128     68.5206     20.7758     248.521     
1 1 1 13 6  69 o 8  154.571 2.85176 427.486     22.1698  426.846     21.9727  106.145    339.016     17.7177     339.016     
1 1 1 13 6  70 o 1  96.2795 2.95121 162.146     13.6581  170.283     14.7522  47.8967    329.147     23.826      149.147     
1 1 1 13 6  71 o 14 69.6781 3.16249 82.256      10.7204  92.825      11.2433  33.7339    271.543     17.2993     91.5426     
1 1 1 13 6  72 o 4  20.2373 5.2356  2.72332     7.43609  8.77558     6.87534  3.88154    171.625     23.5657     171.625     
1 1 1 13 6  73 o 10 43.4843 4.22    36.7869     9.07331  33.1743     8.82497  28.3545    205.181     15.6097     205.181     
1 1 1 13 6  74 o 7  146.358 2.8041  401.996     20.7554  367.106     20.3255  107.487    91.1124     34.301      91.1124     
1 1 1 13 6  75 f 0  34.2589 5.17396 20.1378     8.65441  24.8285     8.58307  32.8491    59.4447     0           0           
1 1 1 13 6  76 o 9  16.3351 4.9089  1.50163     7.46192  -0.292027   6.556    1.90764    15.9142     12.1141     15.9142     
1 1 1 13 6  77 o 7  75.1389 3.22096 102.42      12.636   102.444     11.4752  54.0565    255.765     18.2518     255.765     
1 1 1 13 6  78 o 17 45.8838 4.05019 42.4322     9.24843  36.0438     8.9404   22.4195    63.5286     8.35706     243.529     
1 1 1 13 6  79 o 1  42.9132 4.50394 36.9785     9.88705  32.826      8.90593  24.0396    345.514     0.579732    165.514     
1 1 1 13 6  80 o 15 31.2975 5.37156 19.3338     8.49685  19.4042     8.18199  8.80201    143.961     16.5936     323.961     
1 1 1 13 6  81 o 10 89.5103 4.1453  149.113     15.5742  149.862     20.9292  56.0856    273.745     5.64677     273.745     
1 1 1 13 6  82 o 9  76.7068 4.41762 110.791     14.0027  111.022     19.1363  36.7404    234.659     17.1336     54.659      
1 1 1 13 6  83 o 3  94.2102 4.13569 170.68      16.1557  161.647     21.9454  62.9791    63.3769     15.1265     63.3769     
1 1 1 13 6  84 o 8  21.8472 6.4702  7.91197     11.1637  -1.50797    13.3953  3.56863    150.593     7.54978     330.593     
1 1 1 13 6  85 o 19 23.6827 6.70235 -0.655616   11.4287  14.881      13.5375  6.75277    53.5413     2.00304     233.541     
1 1 1 13 6  86 o 17 25.6016 7.40468 16.7038     15.344   -3.56942    16.7833  9.29029    43.5753     0.0285439   43.5745     
1 1 1 13 6  87 o 11 36.0592 8.39047 34.4717     16.9913  24.8396     18.8072  15.5815    299.612     6.74111     119.612     
1 1 1 13 6  88 o 8  28.58   7.76275 2.48943     16.4617  26.9337     16.9948  11.4798    358.085     1.80731     358.085     
1 1 1 13 6  89 o 19 26.6308 7.8974  0.222689    20.7508  18.4624     16.8599  7.6494     116.795     2.17834     296.795     
1 1 1 13 6  90 o 1  21.3082 7.04347 -7.20146    20.1086  -5.34269    17.2214  1.41301    237.428     5.537       57.4285     
1 1 1 13 6  91 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 7  0  o 14 1373.71 11.6628 33489.8     802.631  33489.8     802.631  991.056    4.1917e-06  12.4233     180         
1 1 1 13 7  1  o 3  544.231 5.06632 5226.34     135.15   5274.19     141.165  453.426    245.015     134.391     245.015     
1 1 1 13 7  2  o 4  769.124 6.8676  10516.9     270.407  10462.8     258.905  440.969    263.204     226.22      83.2043     
1 1 1 13 7  3  o 19 347.029 3.49848 2143.26     60.8426  2125.21     60.8411  192.286    156.492     99.5513     336.492     
1 1 1 13 7  4  o 4  1441.17 12.1949 37011.7     880.749  36781.2     880.749  994.207    263.981     97.9069     83.9813     
1 1 1 13 7  5  o 9  345.023 3.55669 2092.42     62.8023  2126.93     60.138   182.375    197.004     116.491     17.0035     
1 1 1 13 7  6  o 5  215.894 2.72299 831.94      30.0968  819.982     28.8194  94.2485    283.105     92.0357     103.105     
1 1 1 13 7  7  o 4  839.227 7.58313 12437.9     318.916  12545.5     318.929  419.299    5.33298     370.911     185.333     
1 1 1 13 7  8  o 14 412.898 3.97956 3013.5      80.5362  3029.55     84.1243  305.673    322.643     34.8151     322.643     
1 1 1 13 7  9  o 19 225.09  2.7463  904.16      30.9747  891.489     30.9815  107.626    274.68      76.918      94.6803     
1 1 1 13 7  10 o 18 714.47  6.53126 8952.9      233.83   9150.94     233.853  502.581    259.892     17.7967     79.8918     
1 1 1 13 7  11 o 18 479.029 4.64077 4076.33     111.403  4058.46     111.41   360.053    228.42      46.4528     228.42      
1 1 1 13 7  12 o 15 1308.47 11.7512 30412       751.986  30420.7     788.695  909.68     258.645     66.5651     78.6453     
1 1 1 13 7  13 o 13 350.798 3.92822 2162.36     67.2198  2199.79     70.8752  252.121    159.73      25.5436     159.73      
1 1 1 13 7  14 o 12 635.122 5.74466 7110.46     178.835  7193.46     186.809  470.396    218.859     38.3715     218.859     
1 1 1 13 7  15 o 12 708.046 6.33335 8853.17     219.794  8927        229.591  572.142    70.5592     137.525     70.5592     
1 1 1 13 7  16 o 13 639.792 5.77874 7156.61     181.233  7359.79     189.328  362.511    69.9733     185.354     249.973     
1 1 1 13 7  17 o 12 252.92  2.95993 1141.33     36.6762  1125.93     38.3265  94.5998    64.9786     146.269     244.979     
1 1 1 13 7  18 o 4  93.8622 2.39786 154.163     10.725   158.496     11.7841  99.3871    253.633     293.605     253.633     
1 1 1 13 7  19 o 19 279.11  2.9967  1386.26     41.0754  1374.91     42.7328  220.767    334.213     92.3712     334.213     
1 1 1 13 7  20 o 8  798.761 6.78882 11245.6     266.278  11390.1     277.176  723.519    144.792     314.42      144.792     
1 1 1 13 7  21 o 11 247.082 2.79757 1093.08     33.9299  1070.78     35.3196  134.8      336.941     54.356      156.941     
1 1 1 13 7  22 o 4  364.171 3.70853 2376.42     69.1463  2325.13     66.2103  191.471    53.2062     122.154     233.206     
1 1 1 13 7  23 o 18 182.806 2.53718 607.272     23.2492  577.351     23.2272  55.9979    204.45      120.803     24.4502     
1 1 1 13 7  24 o 7  46.0519 3.10224 48.4564     6.60852  28.7236     6.99452  37.6371    218.949     87.3482     218.949     
1 1 1 13 7  25 o 10 692.598 6.07908 8485.97     202.008  8534.81     219.666  579.176    51.839      180.056     51.839      
1 1 1 13 7  26 o 5  485.559 4.50091 4160.25     104.857  4200.93     114.037  317.345    26.68       46.9719     206.68      
1 1 1 13 7  27 o 2  169.889 2.54519 530.93      21.1658  492.471     22.1045  58.427     124.329     101.664     304.329     
1 1 1 13 7  28 o 13 880.7   7.5768  13772.7     320.139  13782.3     348.093  620.903    212.131     4.15106     32.1309     
1 1 1 13 7  29 o 10 515.097 4.98844 4655.71     116.56   4757.79     140.138  344.819    47.5035     32.7665     227.504     
1 1 1 13 7  30 o 7  178.108 2.48096 566.18      21.6913  558.303     22.5814  15.4663    207.413     207.979     27.413      
1 1 1 13 7  31 o 4  527.264 4.72515 4895.22     122.341  4968.6      127.35   496.307    116.14      258.525     116.14      
1 1 1 13 7  32 o 5  375.432 3.71336 2479.62     66.906   2519.29     72.7446  325.396    206.829     134.501     206.829     
1 1 1 13 7  33 o 19 317.835 3.22212 1792.67     50.2877  1789.45     52.3342  243.31     287.883     52.2636     287.883     
1 1 1 13 7  34 o 11 359.936 3.48032 2296.69     60.3105  2298.07     65.1525  231.985    159.929     32.684      339.929     
1 1 1 13 7  35 o 11 329.404 3.14221 1902.88     50.8697  1945.13     52.8703  245.047    48.956      39.8925     48.956      
1 1 1 13 7  36 o 2  113.065 2.17498 227.252     12.0134  226.254     12.6027  21.1341    21.5989     7.27949     21.5989     
1 1 1 13 7  37 o 4  127.55  2.44066 302.002     15.1642  275.516     15.9381  57.9578    105.477     35.0062     285.478     
1 1 1 13 7  38 o 15 596.706 5.39205 6331.55     147.136  6317.57     174.168  466.477    47.944      106.246     47.944      
1 1 1 13 7  39 o 11 137.039 2.41083 347.532     15.6409  318.845     17.316   97.3219    83.3642     40.3061     83.3642     
1 1 1 13 7  40 f 0  175.009 2.55794 527.405     20.8207  558.839     24.0121  161.422    127.563     0           0           
1 1 1 13 7  41 o 16 337.243 3.71703 1984.77     53.6449  2051.39     71.0526  261.906    189.794     63.155      189.794     
1 1 1 13 7  42 o 17 216.419 2.75337 828.092     27.8034  832.987     31.7982  155.301    298.062     21.4592     298.062     
1 1 1 13 7  43 f 0  344.603 3.71109 2104.57     59.3027  2109.98     68.5504  186.053    335.72      0           0           
1 1 1 13 7  44 o 8  120.785 2.66532 251.234     14.2775  266.796     17.8459  82.7895    125.102     25.0415     125.102     
1 1 1 13 7  45 o 6  385.918 3.87644 2584.89     71.4865  2703.11     78.4197  281.2      103.756     38.1383     103.756     
1 1 1 13 7  46 o 14 178.271 2.55422 544.552     22.147   582.898     23.4975  139.353    311.834     49.8859     311.834     
1 1 1 13 7  47 o 5  131.723 2.43855 299.927     15.1716  315.934     16.983   68.1824    284.593     29.6316     104.593     
1 1 1 13 7  48 o 12 297.457 3.1788  1469.38     46.1643  1673.78     48.5834  236.556    242.156     75.9651     242.156     
1 1 1 13 7  49 o 5  582.751 4.98712 5802.45     142.598  6279.55     148.698  460.876    325.102     133.831     325.102     
1 1 1 13 7  50 o 16 51.253  2.95597 46.3365     7.02947  47.4919     8.00085  7.47635    343.506     53.1234     343.506     
1 1 1 13 7  51 o 3  192.519 2.56338 633.762     24.3019  681.433     25.1598  120.502    305.056     10.2841     125.056     
1 1 1 13 7  52 f 0  149.789 2.37148 380.852     17.211   415.364     18.3989  116.574    40.5046     0           0           
1 1 1 13 7  53 o 7  256.3   2.9224  1134.51     34.6297  1197.47     40.357   161.309    328.367     16.242      148.368     
1 1 1 13 7  54 o 7  229.62  3.12582 917.113     34.9639  955.33      36.9766  180.351    211.453     60.2158     211.453     
1 1 1 13 7  55 o 11 180.224 3.36484 639.802     25.9796  517.954     33.2734  123.994    221.761     13.928      221.761     
1 1 1 13 7  56 o 8  107.177 2.4811  211.704     12.9037  196.576     13.6593  54.9159    300.679     24.3752     120.679     
1 1 1 13 7  57 o 14 230.41  3.25949 953.436     37.7684  933.835     37.5043  174.327    280.908     47.7753     280.908     
1 1 1 13 7  58 o 2  214.044 3.34374 820.761     38.1529  808.794     33.4588  141.947    187.941     5.00475     187.941     
1 1 1 13 7  59 o 19 155.14  3.11572 425.686     25.6347  430.979     22.6498  121.067    234.47      44.8212     234.47      
1 1 1 13 7  60 o 11 105.477 2.98349 203.747     17.5744  192.676     13.7626  69.4404    139.008     8.82559     139.008     
1 1 1 13 7  61 o 17 26.9222 5.55311 17.6455     8.84065  9.08833     7.3394   17.2366    11.6235     54.5637     11.6235     
1 1 1 13 7  62 o 19 90.3571 2.89643 154.587     14.3437  136.904     11.8128  72.4494    27.1886     44.028      27.1886     
1 1 1 13 7  63 o 8  165.441 2.90828 494.734     26.0763  480.591     22.0027  109.878    332.416     8.80232     332.416     
1 1 1 13 7  64 o 12 82.7266 2.84472 133.689     13.3321  111.231     10.1859  41.9849    163.245     15.7579     343.245     
1 1 1 13 7  65 o 8  27.9006 5.06665 18.4261     8.2712   11.1358     6.06527  3.63547    253.488     24.844      253.488     
1 1 1 13 7  66 o 7  64.4309 3.06779 79.4952     10.95    69.5594     8.7328   30.0514    248.459     17.4105     68.4586     
1 1 1 13 7  67 o 10 21.0087 5.0142  4.81681     7.44326  9.1639      5.5504   10.2007    117.072     39.2145     117.072     
1 1 1 13 7  68 o 1  46.6797 3.77484 43.8144     9.38957  35.7004     7.97347  27.6241    205.387     4.02821     205.387     
1 1 1 13 7  69 o 8  52.9591 3.4831  60.7959     9.32263  41.6793     8.77241  25.9784    122.123     10.5826     302.123     
1 1 1 13 7  70 o 14 53.985  3.7052  50.2169     10.1892  55.834      9.52458  34.0037    247.585     5.55816     247.585     
1 1 1 13 7  71 o 11 74.994  3.18192 114.287     11.6444  89.1984     11.9676  42.6321    112.687     6.30897     292.687     
1 1 1 13 7  72 o 18 39.6169 4.68443 37.8538     8.85629  21.8852     8.74698  22.3538    249.826     3.96785     249.826     
1 1 1 13 7  73 o 19 22.658  5.5477  8.94579     7.84037  8.62153     7.51051  1.00587    347.036     22.2756     347.036     
1 1 1 13 7  74 o 10 30.3365 5.36855 17.4144     8.24403  17.9885     8.04173  11.4113    10.5631     5.61489     190.563     
1 1 1 13 7  75 o 2  13.1307 4.30385 -4.21915    6.99459  -6.5287     6.48198  0.503499   162.273     1.67477     162.273     
1 1 1 13 7  76 o 11 40.9107 4.837   39.8772     9.3384   24.3496     9.44295  28.5298    331.044     15.0678     331.044     
1 1 1 13 7  77 o 15 20.2828 5.29171 10.466      7.42064  -0.00630197 7.85933  3.1993     147.496     3.70029     327.496     
1 1 1 13 7  78 o 4  62.2151 3.77108 66.4234     10.6376  76.5223     12.6595  21.0755    193.69      32.5487     13.6903     
1 1 1 13 7  79 o 14 20.0928 5.53012 5.49044     7.48154  5.52741     8.53704  2.42472    114.328     11.9171     294.328     
1 1 1 13 7  80 o 7  87.3757 3.35018 141.612     14.4942  138.323     14.7295  53.6091    15.9204     2.63564     15.9204     
1 1 1 13 7  81 o 6  54.2982 5.36647 56.9214     11.4917  57.9659     16.326   37.5142    162.924     13.4054     162.924     
1 1 1 13 7  82 o 5  85.6242 4.11546 123.947     14.8303  151.416     20.2337  55.2973    8.6631      9.54239     8.6631      
1 1 1 13 7  83 o 15 65.9522 4.24011 73.0954     12.7929  91.5635     14.9564  37.1843    259.854     2.14232     79.854      
1 1 1 13 7  84 o 17 21.1003 6.30771 4.40641     11.6758  2.27157     11.2957  3.5737     32.0991     3.80525     212.099     
1 1 1 13 7  85 f 0  23.4198 6.59219 13.8257     12.5163  0.225521    11.5519  7.20937    139.826     0           0           
1 1 1 13 7  86 o 6  23.346  6.6638  0.0731484   11.9009  13.5836     12.9467  4.60075    199.658     12.693      19.6584     
1 1 1 13 7  87 o 12 32.9984 7.43076 23.3821     13.44    25.0413     14.2319  17.7183    267.705     4.60102     267.705     
1 1 1 13 7  88 o 17 23.6836 6.9721  3.78555     12.7749  11.9099     14.7063  5.50007    181.812     6.30301     1.81158     
1 1 1 13 7  89 o 18 16.238  5.49647 -14.3993    12.5349  -10.5136    12.9045  3.91385    355.341     17.5252     355.341     
1 1 1 13 7  90 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 8  0  o 9  1768.06 14.9437 55528.4     1323.66  55528.4     1323.66  1264.69    180         40.2002     9.00796e-06 
1 1 1 13 8  1  o 8  415.469 3.98435 3049.35     82.9535  3069.28     82.9611  257.712    352.042     69.718      172.042     
1 1 1 13 8  2  o 6  600.325 5.50297 6346.32     161.932  6432        169.143  328.249    150.755     204.485     330.755     
1 1 1 13 8  3  o 16 510.797 4.79861 4597.84     125.453  4652.07     120.126  352.079    217.639     21.6587     37.6392     
1 1 1 13 8  4  o 4  994.506 8.5252  17420.1     424.869  17677.2     424.886  737.798    111.984     39.6438     111.984     
1 1 1 13 8  5  o 17 745.525 6.82406 9797.88     254.947  9915.74     254.958  549.329    12.1419     27.7        12.1419     
1 1 1 13 8  6  o 16 838.992 7.55799 12613.5     317.781  12358.9     317.752  568.096    117.152     72.2699     297.152     
1 1 1 13 8  7  o 1  734.612 6.74053 9577.38     259.186  9563.13     236.613  511.696    125.396     31.3107     305.396     
1 1 1 13 8  8  o 18 622.763 5.77489 6858.18     180.233  6894.4      180.226  367.943    67.466      155.571     247.466     
1 1 1 13 8  9  o 18 643.686 5.69041 7371.98     183.56   7320.13     183.559  319.016    164.291     284.852     344.291     
1 1 1 13 8  10 o 16 352.332 3.603   2194.02     62.2255  2206.14     64.987   127.116    101.991     238.669     281.991     
1 1 1 13 8  11 o 18 91.7403 2.35697 151.191     11.0405  147.49      10.5954  29.5225    341.707     109.816     341.707     
1 1 1 13 8  12 o 12 414.381 4.05608 3026.47     82.3816  3060.56     86.0571  351.975    173.709     135.072     173.709     
1 1 1 13 8  13 o 11 254.029 3.04433 1140.85     40.4671  1146.36     36.9561  92.3531    285.887     154.824     105.887     
1 1 1 13 8  14 o 15 699.695 6.39826 8670.09     224.345  8694.84     224.36   513.7      320.539     29.7757     320.539     
1 1 1 13 8  15 o 12 337.264 3.43101 2018.75     57.9843  2013.12     57.9953  213.634    98.5762     33.3596     278.576     
1 1 1 13 8  16 o 9  517.399 5.11296 4763.26     122.708  4729.2      141.689  380.702    351.673     32.4747     351.673     
1 1 1 13 8  17 o 14 246.453 2.91872 1077.82     35.2445  1075.01     36.8329  94.2882    329.107     141.06      149.107     
1 1 1 13 8  18 o 18 630.951 5.71223 7063.7      176.636  7055.82     184.51   432.43     240.909     31.9654     60.9094     
1 1 1 13 8  19 o 3  157.963 2.49959 442.443     19.3534  441.926     20.2112  57.8589    236.06      59.788      56.06       
1 1 1 13 8  20 o 3  602.763 5.53705 6435.59     155.966  6451.12     177.856  544.583    219.18      238.971     219.18      
1 1 1 13 8  21 o 10 499.387 4.67589 4393.7      114.45   4449.96     119.564  352.691    151.202     1.51481     151.201     
1 1 1 13 8  22 o 12 492.039 4.66414 4334.26     112.437  4251.52     117.469  335.949    254.403     21.8006     74.403      
1 1 1 13 8  23 o 9  278.738 2.98613 1401.71     40.8495  1352.6      42.5187  87.6361    311.765     210.799     131.765     
1 1 1 13 8  24 o 17 231.141 2.6567  949.549     30.1509  944.193     31.3805  120.166    123.657     70.4254     303.657     
1 1 1 13 8  25 o 8  378.926 3.68731 2549.61     67.0461  2541.38     72.8639  251.017    291.877     26.5303     111.877     
1 1 1 13 8  26 o 3  841.488 7.26187 12607.6     306.222  12544.1     306.249  670.559    62.836      147.149     62.836      
1 1 1 13 8  27 o 9  294.26  3.15701 1556.86     46.5569  1513.13     46.5463  139.326    357.449     128.722     177.449     
1 1 1 13 8  28 o 9  290.45  3.19396 1498.03     45.451   1492.98     47.5032  300.428    4.79471     238.374     4.79471     
1 1 1 13 8  29 o 7  359.589 3.76037 2327.07     67.7525  2258.8      67.7633  252.887    221.467     6.2896      221.467     
1 1 1 13 8  30 f 0  133.114 2.42056 311.846     15.7463  316.702     16.5176  88.2555    103.954     0           0           
1 1 1 13 8  31 o 3  275.987 3.17234 1365.71     43.8744  1335.24     43.8739  176.383    198.813     25.021      18.8127     
1 1 1 13 8  32 o 18 178.817 2.6061  584.177     22.8064  549.696     23.8422  13.1164    330.037     215.178     150.037     
1 1 1 13 8  33 o 2  629.254 5.58913 6990.89     176.248  7072.79     176.248  512.056    207.297     143.466     207.297     
1 1 1 13 8  34 o 9  131.42  2.26587 308.245     14.6096  304.223     15.2133  12.2082    248.089     7.32178     248.089     
1 1 1 13 8  35 o 13 126.134 2.32673 278.852     14.3968  285.583     14.9926  41.5962    64.4655     70.8379     244.465     
1 1 1 13 8  36 o 15 385.13  3.75409 2619.68     72.4543  2642.75     72.456   309.825    354.641     89.5973     354.641     
1 1 1 13 8  37 o 13 395.258 4.00351 2767.06     75.6035  2777.02     82.8463  277.331    230.665     8.85093     230.665     
1 1 1 13 8  38 o 15 269.035 2.99803 1280.3      40.4204  1286.71     40.4211  188.031    181.403     10.1075     181.403     
1 1 1 13 8  39 o 17 356.374 3.66982 2258.58     61.1097  2247.87     69.6696  235.419    287.814     19.9532     107.814     
1 1 1 13 8  40 o 5  282.684 3.10338 1449.25     44.9351  1385.66     42.9983  225.7      12.0972     66.8081     12.0972     
1 1 1 13 8  41 o 16 188.278 2.61078 605.814     24.5905  651.699     24.6545  125.037    301.277     0.259086    121.276     
1 1 1 13 8  42 o 8  150.701 2.42053 392.658     18.6234  412.784     17.9037  106.265    243.624     20.1399     243.624     
1 1 1 13 8  43 o 3  351.616 3.6129  2151.56     62.1924  2236.87     65.1382  268.906    170.855     58.6854     170.855     
1 1 1 13 8  44 o 11 291.323 3.16614 1469.87     46.0874  1541.76     46.3462  185.374    39.6092     24.1376     219.609     
1 1 1 13 8  45 o 4  338.668 3.37981 2007.34     56.1265  2063.31     58.5974  261.122    183.051     63.5755     183.051     
1 1 1 13 8  46 o 3  525.331 4.69093 4834.5      120.951  4974.67     126.042  409.66     97.8126     103.491     97.8126     
1 1 1 13 8  47 o 3  106.976 2.55742 194.818     12.4111  211.722     14.9399  43.2468    116.576     27.8995     116.576     
1 1 1 13 8  48 f 0  106.271 2.57326 189.938     12.0758  211.401     15.2472  108.879    176.492     0           0           
1 1 1 13 8  49 o 12 110.306 2.41295 198.577     11.9196  234.114     14.7402  45.7093    172.529     44.7537     352.529     
1 1 1 13 8  50 o 15 287.739 3.24115 1400.01     41.3071  1540.58     51.9834  179.23     289.115     26.2553     109.114     
1 1 1 13 8  51 o 8  297.535 3.42201 1493.57     43.4744  1651.94     58.1519  167.524    105.45      62.6844     285.45      
1 1 1 13 8  52 o 10 90.135  2.61809 135.491     10.9033  153.55      12.7076  48.7165    89.8762     3.77399     269.876     
1 1 1 13 8  53 o 12 169.982 2.45212 480.244     20.099   546.027     21.6851  123.903    91.2603     28.0949     91.2603     
1 1 1 13 8  54 o 8  340.139 3.48943 1968.99     59.6535  2144.44     59.2049  253.591    79.8891     54.7305     79.8891     
1 1 1 13 8  55 o 11 304.031 3.51545 1633.75     55.9751  1652.47     51.0025  210.738    216.935     18.4711     216.935     
1 1 1 13 8  56 o 9  143.104 2.56782 351.354     18.0926  376.219     18.7222  95.3289    265.451     7.07715     265.451     
1 1 1 13 8  57 o 10 199.451 2.5355  694.03      26.4338  718.771     24.1547  125.13     56.7668     10.3786     236.767     
1 1 1 13 8  58 o 15 69.9097 3.25225 84.5169     11.7785  90.1462     10.8183  39.8624    174.155     18.9494     174.155     
1 1 1 13 8  59 o 2  140.118 3.03311 351.129     23.0968  347.947     19.2914  78.1789    250.836     23.5655     70.8357     
1 1 1 13 8  60 o 16 132.315 3.02208 310.655     20.6727  313.086     19.3236  81.2439    299.149     6.19881     119.149     
1 1 1 13 8  61 o 17 230.005 3.10803 945.874     35.8273  938.596     35.8218  171.515    201.784     44.9482     201.784     
1 1 1 13 8  62 o 1  52.5799 3.70083 45.1759     9.77885  54.7948     9.32411  10.882     211.202     84.25       211.202     
1 1 1 13 8  63 o 7  160.477 2.73805 467.113     22.3992  450.145     21.6424  130.405    159.286     57.6613     159.286     
1 1 1 13 8  64 o 5  86.8217 2.82175 138.705     12.4812  130.587     12.0093  70.6134    164.847     40.9585     164.847     
1 1 1 13 8  65 o 9  69.9082 3.1107  88.5896     10.7178  86.6236     10.9622  42.6952    119.149     1.57879     119.149     
1 1 1 13 8  66 o 10 112.723 2.59567 223.067     14.8924  230.41      14.3782  86.4814    178.351     31.1807     178.351     
1 1 1 13 8  67 o 3  130.619 2.62274 302.006     17.4255  307.257     16.8652  101.224    270.187     37.6177     270.187     
1 1 1 13 8  68 o 3  47.5639 3.68042 40.6543     8.9936   41.6515     8.23103  18.0769    358.716     19.9086     178.716     
1 1 1 13 8  69 o 8  75.366  2.83447 106.223     10.9348  97.705      10.4009  36.3827    206.794     20.3639     26.7939     
1 1 1 13 8  70 o 2  34.5881 5.03174 18.366      8.46474  27.2289     8.4043   15.9106    177.964     0.392219    357.964     
1 1 1 13 8  71 o 5  36.3767 4.54913 32.2579     7.67398  18.1479     7.99028  10.14      52.4661     20.5129     232.466     
1 1 1 13 8  72 o 6  53.627  3.78486 66.3621     9.77372  40.2982     9.73111  39.471     124.919     18.4339     124.919     
1 1 1 13 8  73 o 17 39.394  4.54624 32.7141     8.58982  25.6014     8.64757  6.95909    343.972     31.9001     163.972     
1 1 1 13 8  74 o 7  43.7125 4.96    38.5338     9.89222  33.6042     10.9611  19.5086    286.049     11.4547     106.049     
1 1 1 13 8  75 o 2  69.7142 4.09844 98.0575     13.1122  81.0394     14.88    41.1561    98.4935     1.9489      278.494     
1 1 1 13 8  76 o 11 45.2989 4.84169 55.7445     10.181   24.7592     9.99494  26.4294    107.224     0.65126     107.224     
1 1 1 13 8  77 o 16 20.7885 5.32118 11.16       7.46609  1.11589     7.77849  4.12714    339.68      7.68067     159.68      
1 1 1 13 8  78 o 3  40.9002 4.81506 35.8651     9.24317  28.4874     9.66763  28.9291    163.362     14.1409     163.362     
1 1 1 13 8  79 o 4  33.7211 5.37145 16.3035     8.83288  29.2244     9.11663  19.6653    335.178     5.4814      335.178     
1 1 1 13 8  80 o 3  42.773  5.23615 47.7155     10.6816  25.3382     10.4991  29.7782    303.476     13.8321     303.476     
1 1 1 13 8  81 o 5  46.257  6.13072 59.8959     11.3189  28.0746     14.9597  19.8596    51.0583     13.086      231.058     
1 1 1 13 8  82 o 5  28.0474 6.66908 16.8111     9.65161  14.0831     12.9196  9.56561    246.176     6.10801     66.1761     
1 1 1 13 8  83 o 12 59.4417 5.37503 60.2924     15.0021  78.6993     16.1738  40.7191    70.4841     13.7141     70.4841     
1 1 1 13 8  84 o 2  80.6251 4.61253 131.959     17.6727  115.652     19.0512  54.3205    190.484     14.2538     190.484     
1 1 1 13 8  85 o 14 18.0469 5.85574 -4.09306    11.4906  -6.89713    12.6324  1.37083    152.952     2.45582     332.952     
1 1 1 13 8  86 o 11 76.2656 4.94173 126.532     17.6625  100.589     19.1501  51.3621    128.714     14.5523     128.714     
1 1 1 13 8  87 o 13 66.8797 5.41264 90.1187     17.4828  89.7359     18.133   45.99      103.119     16.2334     103.119     
1 1 1 13 8  88 o 6  30.394  7.49068 24.0968     13.6615  17.8803     14.711   11.997     286.986     2.37945     106.986     
1 1 1 13 8  89 o 19 22.6277 6.92777 7.24422     14.6082  3.3632      14.3656  2.56798    29.0923     6.29519     209.092     
1 1 1 13 8  90 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 9  0  o 10 423.959 4.06697 3186.98     86.3724  3186.98     86.3724  275.123    5.75924e-06 66.5436     180         
1 1 1 13 9  1  o 7  552.081 5.02034 5384.03     138.895  5422.57     138.9    350.459    134.365     87.3529     314.365     
1 1 1 13 9  2  o 9  856.504 7.58725 12969.2     318.524  13059.2     332.702  552.043    20.27       132.333     200.27      
1 1 1 13 9  3  o 11 235.608 2.92449 985.209     34.5213  982.251     34.5393  65.1003    57.3107     185.447     237.311     
1 1 1 13 9  4  o 1  399.558 3.86247 2803.02     77.3339  2856.19     77.3413  155.981    254.322     252.926     74.3217     
1 1 1 13 9  5  o 6  170.538 2.53769 518.415     22.1669  512.332     21.2034  16.898     145.568     176.898     325.568     
1 1 1 13 9  6  o 9  717.776 6.43283 9174.62     226.288  9099.09     236.344  551.048    265.268     72.766      265.268     
1 1 1 13 9  7  o 15 252.951 2.92206 1147.28     37.8485  1120.58     36.2314  148.417    39.7429     31.4054     219.743     
1 1 1 13 9  8  o 13 404.551 3.98957 2919.24     82.6279  2882.47     79.1208  343.515    68.859      132.053     68.859      
1 1 1 13 9  9  o 2  311.661 3.33868 1716.44     50.9967  1726.46     53.2759  265.485    222.004     130.743     222.004     
1 1 1 13 9  10 o 2  887.656 7.79747 13844       339.283  14118.6     354.403  642.343    306.243     6.98856     306.244     
1 1 1 13 9  11 o 17 471.598 4.49951 3931.2      108.611  3953.89     104.006  333.344    250.527     1.8921      250.527     
1 1 1 13 9  12 o 11 412.563 3.95651 2972.11     81.7842  3062.12     81.8061  368.827    121.557     171.105     121.557     
1 1 1 13 9  13 o 16 205.204 2.70602 761.278     27.2042  731.327     28.4057  120.25     53.0597     3.94856     233.06      
1 1 1 13 9  14 o 7  418.951 4.2869  3098.16     92.1092  3124.7      87.8306  255.42     92.6277     78.4222     272.628     
1 1 1 13 9  15 o 12 245.536 2.92277 1087.67     35.1552  1049.39     36.7196  118.816    200.483     90.8599     20.4827     
1 1 1 13 9  16 o 16 475.573 4.42442 3975.17     105.439  4044.15     105.449  440.027    39.9743     216.151     39.9743     
1 1 1 13 9  17 f 0  327.496 3.35883 1895.93     55.1196  1906.06     55.1318  356.539    169.048     0           0           
1 1 1 13 9  18 o 16 295.985 3.16324 1558.19     46.9184  1547.29     46.9222  229.18     63.3199     59.157      63.3199     
1 1 1 13 9  19 o 18 333.779 3.40885 1998.82     57.0176  1950.8      57.016   218.724    197.601     25.6866     17.6009     
1 1 1 13 9  20 o 4  287.001 3.25065 1437.31     46.7346  1482.85     46.7642  111.273    168.697     176.544     348.697     
1 1 1 13 9  21 o 1  619.137 5.75798 6769.94     170.365  6831.37     186.645  445.493    143.155     9.75525     143.155     
1 1 1 13 9  22 o 1  50.824  2.81827 44.5647     6.93675  47.5867     7.30635  72.336     290.697     179.806     290.697     
1 1 1 13 9  23 o 19 372.683 3.87175 2497.95     68.9039  2427.34     75.4646  254.375    185.278     12.7086     5.27803     
1 1 1 13 9  24 o 16 330.237 3.55192 1932.11     58.7626  1934.7      58.803   286.523    342.962     119.963     342.962     
1 1 1 13 9  25 o 19 460.53  4.33547 3754.65     95.7922  3767.91     104.164  407.058    328.586     168.497     328.586     
1 1 1 13 9  26 o 4  220.413 2.71377 861.355     28.6898  860.862     31.2081  186.224    324.255     88.8643     324.255     
1 1 1 13 9  27 o 10 97.7474 2.31125 176.047     11.0446  163.133     11.5304  15.7878    307.129     148.507     307.129     
1 1 1 13 9  28 o 17 231.707 2.70835 963.75      30.796   939.671     32.069   102.954    282.151     111.8       102.151     
1 1 1 13 9  29 o 4  343.335 3.36503 2077.18     55.6437  2103.1      60.0935  365.602    91.359      270.731     91.359      
1 1 1 13 9  30 o 16 350.89  3.48494 2202.08     60.024   2164.68     62.4889  274.999    186.268     64.0794     186.268     
1 1 1 13 9  31 o 16 92.6884 2.26241 154.398     10.2716  150.528     10.7033  20.8287    324.98      16.2087     144.98      
1 1 1 13 9  32 o 4  351.952 3.55406 2196.08     60.0002  2197.74     65.2626  265.33     233.984     44.0909     233.984     
1 1 1 13 9  33 o 10 754.844 6.70454 10045.3     248.054  10220.7     259.149  568.982    15.4669     77.2994     15.4669     
1 1 1 13 9  34 o 2  468.166 4.92695 3962.22     118.641  3821.41     112.549  302.066    261.283     49.143      81.2829     
1 1 1 13 9  35 f 0  313.962 3.52682 1753.24     54.151   1743.65     56.7914  249.984    146.531     0           0           
1 1 1 13 9  36 o 8  457.156 4.97116 3759.83     120.141  3663.35     107.431  357.556    74.1854     79.9495     74.1855     
1 1 1 13 9  37 o 7  616.064 6.14746 6771.94     184.714  6726.88     194.705  479.535    55.9585     100.26      55.9585     
1 1 1 13 9  38 o 4  145.626 2.58121 379.171     19.3112  373.095     18.3419  123.798    77.4566     72.8841     77.4566     
1 1 1 13 9  39 o 8  520.573 4.97297 4848.76     129.755  4780.14     129.711  376.231    83.9412     30.1723     83.9412     
1 1 1 13 9  40 o 19 339.143 3.48783 2066.56     59.2874  2014.98     59.2632  286.974    260.987     109.49      260.987     
1 1 1 13 9  41 o 6  157.494 2.54599 442.573     20.5375  437.075     19.6469  130.017    237.294     62.1508     237.294     
1 1 1 13 9  42 o 4  181.338 2.49214 585.209     21.6625  580.952     23.5844  142.311    37.6948     48.043      37.6948     
1 1 1 13 9  43 o 17 374.076 3.62959 2462.75     66.6635  2504.43     69.4122  327.02     73.2294     144.285     73.2294     
1 1 1 13 9  44 o 13 17.7687 4.53548 5.76945     4.97708  3.2002      5.50976  23.0881    279.827     49.1161     279.827     
1 1 1 13 9  45 o 12 504.061 4.3625  4455.2      108.1    4572.56     112.3    350.428    27.0915     11.2899     27.0916     
1 1 1 13 9  46 o 1  231.364 2.86464 938.643     30.1939  960.532     36.04    172.288    269.523     36.663      269.523     
1 1 1 13 9  47 o 2  145.221 2.51546 368.464     17.6862  379.606     18.9216  82.5557    11.8581     21.4224     191.858     
1 1 1 13 9  48 o 11 426.582 3.98442 3144.55     83.37    3321.04     86.9992  291.369    111.366     4.53699     111.366     
1 1 1 13 9  49 o 8  287.652 3.13715 1417.09     45.0622  1520.74     45.3522  170.89     345.073     44.6148     165.073     
1 1 1 13 9  50 f 0  298.106 3.16881 1539.12     47.1862  1616.14     47.4791  188.556    277.198     0           0           
1 1 1 13 9  51 o 14 330.565 3.50702 1896.58     59.1371  1985.55     56.9638  226.056    294.767     8.88037     294.767     
1 1 1 13 9  52 o 2  199.66  2.62389 682.565     27.1463  732.645     25.2341  151.82     173.481     41.5875     173.481     
1 1 1 13 9  53 o 19 166.005 2.4728  470.432     20.3702  507.907     20.7636  136.52     311.631     58.7137     311.631     
1 1 1 13 9  54 o 14 191.08  2.64848 614.85      24.5928  682.306     26.1353  114.01     75.3265     23.6984     255.327     
1 1 1 13 9  55 o 8  195.521 2.6753  657.946     26.666   700.024     25.7035  120.467    61.3045     16.1672     241.304     
1 1 1 13 9  56 o 15 77.6426 3.24851 113.197     13.1182  102.076     12.056   38.1223    213.958     15.7784     33.9585     
1 1 1 13 9  57 o 15 124.668 2.86637 266.277     17.7742  286.971     17.9825  50.2158    267.949     60.3733     87.9485     
1 1 1 13 9  58 o 9  117.352 2.90371 248.732     16.8031  241.657     17.2845  74.3305    51.4806     0.0305409   51.481      
1 1 1 13 9  59 o 1  168.894 2.89993 481.594     24.5198  534.337     24.4968  106.087    68.0349     6.8572      248.035     
1 1 1 13 9  60 o 15 94.1007 3.17902 156.334     13.0604  159.9       16.6487  62.79      214.452     10.4673     214.452     
1 1 1 13 9  61 o 4  41.1436 5.0391  37.8371     9.65811  25.2855     10.1074  8.19936    320.004     11.6126     140.004     
1 1 1 13 9  62 f 0  51.126  4.05219 48.5946     9.2192   46.2005     11.0227  57.2663    169.114     0           0           
1 1 1 13 9  63 o 15 18.4207 5.09339 7.50137     7.02452  -3.54543    7.80316  16.4519    183.344     42.5839     183.344     
1 1 1 13 9  64 o 9  117.709 2.80862 250.332     15.5658  244.353     17.4415  68.7994    17.7663     12.0085     197.766     
1 1 1 13 9  65 o 14 28.4574 5.33371 16.9474     7.72762  13.5066     7.7873   13.0875    202.226     58.2311     202.226     
1 1 1 13 9  66 o 6  89.0212 2.91846 138.382     12.7093  145.481     13.2614  75.0425    275.395     40.6762     275.395     
1 1 1 13 9  67 o 10 117.888 2.80689 245.998     15.8004  251.373     17.2973  92.1443    152.264     35.8821     152.264     
1 1 1 13 9  68 o 4  121.015 2.79308 260.816     16.0635  263.68      17.7341  97.6913    247.368     43.4823     247.368     
1 1 1 13 9  69 o 6  32.6156 5.2003  24.8621     8.1949   15.8221     8.52529  4.22942    21.1121     27.6183     201.112     
1 1 1 13 9  70 o 7  15.964  4.82186 -2.26609    7.35126  1.84858     6.50791  6.88799    229.136     23.749      229.136     
1 1 1 13 9  71 o 5  18.7876 5.01381 -0.88178    7.79011  7.87976     6.15463  4.31362    58.0005     23.048      58.0005     
1 1 1 13 9  72 o 16 80.9124 2.95519 125.517     12.881   110.552     11.0118  43.8876    83.4072     11.8547     263.407     
1 1 1 13 9  73 o 3  50.6    3.57412 57.3188     9.3648   37.3066     8.36036  28.2946    139.54      2.94464     319.54      
1 1 1 13 9  74 o 16 62.9815 3.20228 79.752      10.5446  64.5771     9.53072  51.9924    230.184     30.2266     230.184     
1 1 1 13 9  75 o 16 76.4005 2.97526 114.966     11.4861  96.6767     11.167   38.3358    270.044     16.7839     90.0436     
1 1 1 13 9  76 o 11 30.1079 5.38811 18.0762     8.13284  17.4625     8.13949  4.04832    187.608     25.8772     7.60812     
1 1 1 13 9  77 o 10 26.0243 5.56231 18.6559     8.55199  7.37088     7.91037  6.73855    1.13058     13.6841     181.131     
1 1 1 13 9  78 o 2  26.9448 5.9689  13.5367     8.16006  15.0653     9.7748   11.0394    263.436     2.67901     263.436     
1 1 1 13 9  79 o 6  24.2443 6.22456 10.6978     8.69807  10.0776     10.9306  5.80825    196.575     11.4483     16.5747     
1 1 1 13 9  80 o 1  14.5424 4.74267 -1.1108     7.69372  -13.7979    9.25787  4.0495     203.552     17.1517     203.552     
1 1 1 13 9  81 o 5  51.1389 5.03573 53.1797     11.4526  48.4309     13.3853  28.9667    234.056     0.436078    54.0563     
1 1 1 13 9  82 o 16 38.2502 6.54063 24.9969     12.2123  36.3351     12.7768  19.8301    83.1531     1.13247     263.153     
1 1 1 13 9  83 o 12 24.6461 6.63741 16.7506     12.14    1.35847     11.8838  7.04636    265.859     8.62049     85.8586     
1 1 1 13 9  84 o 16 84.9346 4.38145 159.545     18.5583  115.543     18.1219  60.128     344.871     20.5485     344.871     
1 1 1 13 9  85 o 4  34.8052 7.08347 35.3944     13.7368  17.4498     13.3983  10.7154    233.105     16.6626     53.1052     
1 1 1 13 9  86 o 2  60.3609 5.3837  66.977      16.0176  79.3201     15.6371  43.0591    338.136     18.1097     338.136     
1 1 1 13 9  87 o 12 17.1478 5.67544 -5.48601    11.8046  -9.93266    12.6634  0.331632   106.652     7.79084     106.652     
1 1 1 13 9  88 o 19 20.2231 6.43683 1.56178     14.0105  -2.30815    13.4112  1.00463    34.6353     5.32627     214.635     
1 1 1 13 9  89 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 10 0  o 15 556.435 5.28088 5490.72     147.199  5490.72     147.199  519.429    180         228.446     180         
1 1 1 13 10 1  o 17 643.726 5.85532 7426.28     184.695  7270.86     192.896  542.425    21.9048     163.683     21.9048     
1 1 1 13 10 2  o 5  136.353 2.39288 343.689     16.3451  315.748     16.3212  13.1669    322.831     183.553     322.831     
1 1 1 13 10 3  o 17 583.385 5.37714 6034.34     153.746  6034.72     160.59   417.207    295.434     0.378079    115.436     
1 1 1 13 10 4  f 0  420.004 4.12227 3136.4      88.6368  3117.38     84.8656  333.874    21.4823     0           0           
1 1 1 13 10 5  o 13 346.028 3.57745 2116.11     63.3728  2128.26     60.662   171.491    7.95974     141.312     187.96      
1 1 1 13 10 6  o 14 635.601 5.92951 7177.65     180.062  7151.3      197.253  465.174    138.398     18.7389     138.398     
1 1 1 13 10 7  o 6  699.241 6.15367 8672.99     215.633  8670.51     215.639  415.425    325.431     176.436     145.431     
1 1 1 13 10 8  o 16 275.285 3.0368  1332.71     41.8909  1353.41     41.8966  205.619    54.6444     48.6697     54.6444     
1 1 1 13 10 9  o 11 264.735 3.04707 1238.38     41.2867  1245.79     39.5396  150.41     211.286     56.4614     31.2863     
1 1 1 13 10 10 o 10 411.455 4.05906 3009.35     81.8547  2992.64     85.4884  272.917    151.519     34.2533     331.519     
1 1 1 13 10 11 o 11 477.645 4.88691 4050.11     122.68   4040.14     110.995  292.592    353.833     94.7786     173.833     
1 1 1 13 10 12 o 19 421.901 4.21785 3184.03     89.1824  3127.15     89.1698  248.187    284.104     101.356     104.104     
1 1 1 13 10 13 o 8  678.494 6.25659 8130.48     222.149  8203.03     202.794  511.043    153.051     48.8308     153.051     
1 1 1 13 10 14 o 8  163.874 2.58669 478.785     21.242   473.057     21.2433  87.4527    100.11      4.59996     280.11      
1 1 1 13 10 15 o 12 441.594 4.46642 3436.27     96.4659  3478.78     101.189  268.976    301.544     89.1291     121.544     
1 1 1 13 10 16 o 12 888.243 7.63331 14085.8     339.784  13931.8     339.781  746.179    162.732     215.48      162.732     
1 1 1 13 10 17 o 14 201.977 2.62545 719.241     26.568   726.748     26.5805  80.8794    359.699     109.271     179.699     
1 1 1 13 10 18 o 14 119.123 2.34795 259.174     13.9925  244.283     14.0038  27.3161    36.2287     3.15828     216.229     
1 1 1 13 10 19 o 11 447.263 4.22028 3563.82     94.5935  3530.31     94.5938  416.757    356.584     205.548     356.584     
1 1 1 13 10 20 o 12 734.897 6.4162  9603.76     236.295  9569.14     236.305  542.546    46.4181     33.2346     46.4181     
1 1 1 13 10 21 o 1  31.6287 3.82083 16.5696     5.83069  19.9743     5.81935  124.601    69.0938     269.819     69.0938     
1 1 1 13 10 22 o 10 326.388 3.36439 1886.57     55.0265  1890.51     55.0337  201.178    188.162     54.4553     8.16195     
1 1 1 13 10 23 o 7  184.972 2.5234  588.987     23.3639  624.108     23.4051  98.7861    282.649     46.9504     102.649     
1 1 1 13 10 24 o 3  460.718 4.401   3710.15     103.743  3820        99.3536  328.352    258.274     4.89432     258.274     
1 1 1 13 10 25 o 4  293.591 3.33415 1499.38     47.8679  1557.34     50.2463  175.184    347.042     58.6876     167.042     
1 1 1 13 10 26 o 2  418.105 4.18113 3089.47     83.5516  3111.99     91.5092  328.695    67.1643     69.6708     67.1643     
1 1 1 13 10 27 o 11 609.655 5.68116 6608.21     173.569  6591.06     173.577  454.66     94.2115     45.3233     94.2115     
1 1 1 13 10 28 o 11 219.153 2.77787 849.982     29.824   852.882     31.1803  120.904    106.34      56.076      286.34      
1 1 1 13 10 29 o 10 327.269 3.53734 1888.14     55.3154  1910.85     60.6235  225.176    11.4425     4.455       191.443     
1 1 1 13 10 30 o 2  544.32  5.68102 5345.8      141.987  5180.8      166.548  380.518    349.639     5.88508     169.639     
1 1 1 13 10 31 o 16 322.337 3.38316 1841.17     53.4392  1844.18     55.8373  245.4      145.678     45.8957     145.678     
1 1 1 13 10 32 o 6  420.393 4.10819 3127.03     84.651   3144.73     88.4174  388.885    128.439     194.234     128.439     
1 1 1 13 10 33 o 11 414.019 4.07799 3017.79     82.7616  3065.51     86.4453  257.529    208.044     63.6704     28.0443     
1 1 1 13 10 34 o 12 205.601 2.85758 773.982     28.7135  725.491     30.0889  132.088    350.402     12.9569     170.402     
1 1 1 13 10 35 o 12 153.72  2.57908 429.608     19.8532  408.413     19.8728  55.5943    2.83118     94.1712     182.831     
1 1 1 13 10 36 o 5  95.8288 2.64229 167.324     11.9047  158.873     13.339   31.8197    119.442     53.1151     299.442     
1 1 1 13 10 37 o 16 323.715 3.41012 1837.97     54.0864  1880.2      56.5514  196.717    267.056     55.2086     87.0556     
1 1 1 13 10 38 o 18 75.2022 2.68877 104.48      9.81034  96.6746     10.349   16.5143    232.549     0.576951    52.5488     
1 1 1 13 10 39 o 6  241.027 2.95186 1044.57     33.98    1016.25     37.2076  151.157    281.33      26.6653     101.33      
1 1 1 13 10 40 o 9  167.348 2.60459 499.842     21.8663  493.394     21.8199  148.612    284.034     87.152      284.034     
1 1 1 13 10 41 o 8  289.172 3.20839 1518.36     43.2876  1449.11     49.3428  229.56     280.707     65.3278     280.707     
1 1 1 13 10 42 o 19 279.153 2.98394 1381.36     40.9099  1383.31     42.5624  177.525    206.999     25.6044     26.9987     
1 1 1 13 10 43 o 9  498.383 4.72621 4385.35     120.561  4443.59     115.428  374.217    259.604     62.9584     259.604     
1 1 1 13 10 44 o 7  354.77  3.83117 2179.29     69.6197  2290.81     66.4607  260.851    145.952     37.7396     145.952     
1 1 1 13 10 45 o 6  419.208 4.13556 3091.09     88.7269  3152.16     84.9499  325.622    141.667     79.0886     141.667     
1 1 1 13 10 46 o 19 124.891 2.62121 272.653     16.8404  281.167     15.9033  89.27      128.188     28.476      128.188     
1 1 1 13 10 47 o 13 205.569 2.69266 744.97      28.3336  754.274     27.1239  154.523    252.281     37.4163     252.281     
1 1 1 13 10 48 o 5  282.91  3.13088 1421.25     45.4009  1419.76     43.3544  175.111    264.447     31.0276     84.4469     
1 1 1 13 10 49 o 16 384.448 3.68304 2543.21     73.6411  2708.79     67.925   248.442    110.658     23.3332     290.658     
1 1 1 13 10 50 o 12 143.316 2.54949 358.147     19.3298  370.984     17.1649  82.232     203.027     21.4324     23.0268     
1 1 1 13 10 51 o 14 81.9571 2.68232 114.293     10.9412  124.742     11.0198  24.6512    224.963     50.7327     44.963      
1 1 1 13 10 52 f 0  114.446 2.60806 219.096     14.2012  246.719     15.6879  103.983    326.796     0           0           
1 1 1 13 10 53 o 17 156.193 2.54486 412.814     19.605   453.746     20.2258  94.0814    141.243     16.451      321.243     
1 1 1 13 10 54 o 8  125.735 2.44474 251.087     14.5444  312.282     16.236   83.4865    311.469     6.07695     311.469     
1 1 1 13 10 55 o 7  205.396 2.53013 704.608     25.122   795.064     26.9724  129.443    63.1641     12.1797     243.164     
1 1 1 13 10 56 o 8  86.1355 2.69653 132.095     10.9624  132.075     12.2239  60.1497    299.842     19.5815     299.842     
1 1 1 13 10 57 o 15 52.9309 3.67151 50.958      8.73792  49.8529     10.3828  9.51564    270.96      40.2401     90.96       
1 1 1 13 10 58 o 2  40.7079 5.18563 35.7549     9.02191  25.7374     10.9847  0.945833   169.871     42.6793     169.871     
1 1 1 13 10 59 o 9  53.4498 3.84205 44.0566     10.0582  59.6313     10.0151  12.0772    169.17      36.5098     349.17      
1 1 1 13 10 60 f 0  124.186 2.61831 281.043     16.1463  268.354     16.3938  53.9342    352.722     0           0           
1 1 1 13 10 61 o 9  154.011 2.96631 400.915     21.7496  445.893     24.0121  148.916    106.6       105.329     106.6       
1 1 1 13 10 62 o 16 65.3788 3.63558 79.906      10.2765  74.0161     13.0373  35.5463    239.566     5.51667     59.5657     
1 1 1 13 10 63 o 5  117.566 2.88573 241.885     15.5041  251.88      18.3758  89.7916    356.515     30.667      356.515     
1 1 1 13 10 64 o 15 100.406 2.99983 176.129     13.8137  184.696     16.2561  60.8556    114.987     5.98689     294.987     
1 1 1 13 10 65 o 14 43.333  4.16342 35.7139     8.73979  33.1824     8.8578   23.4176    343.36      0.919764    163.36      
1 1 1 13 10 66 o 11 54.9519 3.62209 46.3761     9.66621  63.7909     9.86225  30.2985    283.116     5.24955     103.116     
1 1 1 13 10 67 o 9  28.0597 5.4961  18.0984     8.20077  11.7162     7.98555  7.1829     305.604     7.08093     125.604     
1 1 1 13 10 68 o 19 44.4228 4.14246 40.1612     8.89122  32.7191     8.99575  15.448     186.881     21.5767     6.88122     
1 1 1 13 10 69 o 8  31.4446 5.38289 21.3639     8.62198  16.6031     8.20622  12.7818    116.895     1.28188     296.895     
1 1 1 13 10 70 o 10 94.5825 2.82363 167.557     13.4413  154.011     13.2549  73.7965    91.1124     30.5238     91.1124     
1 1 1 13 10 71 f 0  46.6554 4.08494 41.7694     9.49608  38.5525     9.19539  49.4252    308.569     0           0           
1 1 1 13 10 72 o 3  43.2595 4.39482 37.4746     9.47603  32.3625     9.02039  23.0279    321.51      3.59382     141.51      
1 1 1 13 10 73 o 6  69.6431 3.42726 99.9408     13.3629  77.2109     10.4587  54.0577    8.71909     24.2648     8.71909     
1 1 1 13 10 74 o 15 90.5408 3.01177 148.31      14.9726  148.244     12.116   67.0444    50.5513     22.87       50.5513     
1 1 1 13 10 75 o 14 31.7714 5.16476 25.7312     8.84728  14.1996     7.45061  14.0969    266.93      6.35901     86.9298     
1 1 1 13 10 76 o 12 27.0726 5.31682 8.8546      8.67349  18.9617     7.15414  11.3724    267.532     4.02542     87.5318     
1 1 1 13 10 77 o 6  36.7925 5.0315  24.7954     8.95827  27.9812     8.91752  16.9191    158.415     7.78561     338.415     
1 1 1 13 10 78 o 12 83.75   3.41874 134.994     14.736   123.094     13.8438  53.291     355.051     5.32451     355.051     
1 1 1 13 10 79 o 7  22.2828 5.74194 3.13446     8.98361  12.5069     8.48268  5.30703    30.9396     4.46352     210.94      
1 1 1 13 10 80 o 19 18.4768 5.55395 4.91191     8.56428  -3.69712    10.0744  0.6188     157.624     9.11272     337.624     
1 1 1 13 10 81 o 10 77.3139 4.0355  114.039     14.6596  110.146     16.295   59.6389    11.8846     28.5904     11.8846     
1 1 1 13 10 82 o 19 70.1021 5.23188 96.9814     17.3851  94.2376     18.7462  45.3507    188.7       8.372       188.7       
1 1 1 13 10 83 o 11 56.0913 5.72938 60.2424     16.239   65.2414     14.8845  26.6307    25.2669     12.1179     205.267     
1 1 1 13 10 84 o 7  20.2573 6.23384 -3.8963     12.4385  4.968       11.6926  2.60266    140.969     1.20026     320.969     
1 1 1 13 10 85 o 7  25.2495 6.87383 15.765      12.5374  6.77902     12.4736  9.13659    11.128      1.65814     191.128     
1 1 1 13 10 86 o 14 47.7734 6.54029 64.3345     15.2047  35.8544     14.844   32.0309    231.936     12.9557     231.936     
1 1 1 13 10 87 o 15 25.0664 7.42707 9.5024      16.9088  10.9914     14.5855  5.47377    71.0236     8.24042     251.024     
1 1 1 13 10 88 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 11 0  o 11 157.316 2.71444 439.323     21.3712  439.323     21.3712  15.138     9.28088e-05 5.84201     9.28088e-05 
1 1 1 13 11 1  o 17 199.196 2.74874 700.037     26.1754  706.362     28.6579  35.6656    278.94      196.741     98.9398     
1 1 1 13 11 2  f 0  577.516 5.46507 5844.28     165.085  5985.77     150.736  276.465    156.755     0           0           
1 1 1 13 11 3  o 19 103.283 2.41288 184.239     12.239   194.318     12.7059  37.5249    30.7973     186.264     30.7973     
1 1 1 13 11 4  o 13 800.365 7.46311 11341.4     292.14   11398       306.408  573.644    179.456     10.8596     359.456     
1 1 1 13 11 5  o 17 106.857 2.48065 200.684     13.8701  204.46      12.619   7.46706    207.537     58.765      27.5375     
1 1 1 13 11 6  o 6  375.09  3.78978 2505.85     69.6679  2482.09     72.7582  326.609    314.874     131.493     314.874     
1 1 1 13 11 7  o 18 981.857 8.41544 17118.9     414.079  17122.8     414.083  655.812    99.503      112.094     279.503     
1 1 1 13 11 8  o 5  668.891 6.03887 7973.83     197.966  7900.42     206.752  397.671    334.079     170.345     154.079     
1 1 1 13 11 9  o 15 423.468 4.04917 3183.46     85.9306  3174.72     85.9302  396.729    277.827     199.818     277.827     
1 1 1 13 11 10 o 19 244.369 2.99352 1063.2      36.661   1053.6      36.658   92.0962    117.658     153.678     297.658     
1 1 1 13 11 11 o 14 514.385 4.95657 4671.87     121.844  4712.75     133.48   377.157    165.926     18.0637     165.926     
1 1 1 13 11 12 o 10 381.393 3.82721 2576.42     74.7153  2581.01     71.548   284.638    6.77316     30.69       6.77316     
1 1 1 13 11 13 o 17 301.197 3.19782 1609.19     48.2758  1606.86     48.2614  236.818    4.1714      57.9423     4.1714      
1 1 1 13 11 14 o 8  580.44  5.335   5978.4      151.768  5974.24     158.528  474.522    315.696     117.527     315.696     
1 1 1 13 11 15 o 11 337.377 3.66654 2046.34     63.4761  1989.62     60.5042  156.279    121.444     165.227     301.444     
1 1 1 13 11 16 o 2  438.516 4.24839 3444.57     91.2938  3375.28     95.3378  356.905    345.587     91.9365     345.587     
1 1 1 13 11 17 o 8  542.377 4.92736 5188.78     133.923  5247.31     133.932  475.274    185.529     177.129     185.529     
1 1 1 13 11 18 o 15 317.768 3.32066 1766.37     52.8758  1813.91     52.8782  208.737    180.66      28.1704     0.660271    
1 1 1 13 11 19 o 19 128.976 2.39727 294.321     15.8031  295.735     15.1512  32.0559    158.496     234.606     158.496     
1 1 1 13 11 20 o 15 517.604 4.74439 4750.81     123.064  4754.41     123.069  424.38     236.833     111.653     236.833     
1 1 1 13 11 21 o 19 620.6   5.63906 6863.64     179.169  6808.81     171.535  479.412    14.6307     71.6592     14.6307     
1 1 1 13 11 22 o 11 379.131 3.71669 2579.86     70.6179  2518.08     70.6073  283.886    49.3706     32.7542     49.3707     
1 1 1 13 11 23 o 7  260.378 3.08918 1211.09     40.3044  1192.83     40.3128  102.505    284.08      159.244     104.08      
1 1 1 13 11 24 o 14 397.44  3.84362 2801.22     76.5539  2801.69     76.5558  300.907    165.68      41.2971     165.68      
1 1 1 13 11 25 o 14 140.234 2.50373 347.084     17.9902  350.333     17.1712  69.3974    170.177     36.5375     350.177     
1 1 1 13 11 26 o 15 62.6299 2.69486 67.2488     8.40894  72.3855     8.41866  21.4489    133.154     89.8052     133.154     
1 1 1 13 11 27 o 11 454.095 4.5706  3622.55     101.507  3696.51     106.498  345.363    294.185     50.1942     294.185     
1 1 1 13 11 28 o 10 212.863 2.85344 790.184     31.116   816.626     29.7165  155.726    247.132     27.3174     247.132     
1 1 1 13 11 29 o 1  302.079 3.6066  1626.93     53.1183  1610.26     56.0233  171.712    183.657     77.2175     3.65673     
1 1 1 13 11 30 o 4  493.816 5.08789 4278.19     122.569  4383.04     129.231  350.364    312.806     4.78168     312.806     
1 1 1 13 11 31 o 19 163.732 2.75464 495.427     22.5736  455.618     22.6007  115.844    229.969     21.785      229.969     
1 1 1 13 11 32 o 4  474.414 4.83545 3976.13     114.93   4017.1      114.993  403.156    23.9449     140.816     23.9449     
1 1 1 13 11 33 o 19 412.273 4.18556 3008.18     82.4435  3025.25     90.3494  292.275    42.6335     6.9049      42.6338     
1 1 1 13 11 34 o 15 446.685 4.42166 3553.33     94.3444  3531.44     103.379  354.937    223.395     84.2579     223.395     
1 1 1 13 11 35 o 3  203.757 2.78194 739.619     27.7284  732.823     29.0626  119.796    50.8799     39.1214     230.88      
1 1 1 13 11 36 o 19 254.334 2.7467  1159.95     34.3563  1134.28     35.6318  181.553    255.146     13.3187     255.146     
1 1 1 13 11 37 o 3  212.393 2.6853  786.128     29.1301  813.89      27.9964  199.923    223.856     118.593     223.856     
1 1 1 13 11 38 o 19 295.851 3.40623 1568.34     49.3014  1537.81     51.6481  203.047    269.239     1.81968     89.2385     
1 1 1 13 11 39 o 17 125.329 2.49548 278.52      16.7615  278.966     14.467   95.1978    138.765     45.7278     138.765     
1 1 1 13 11 40 o 19 335.316 3.70401 1987.76     60.7169  2003.82     63.7423  208.954    36.5179     44.6023     216.518     
1 1 1 13 11 41 o 4  293.766 3.48907 1514.62     53.805   1548.66     48.7389  192.682    117.715     17.2381     297.715     
1 1 1 13 11 42 o 8  286.382 3.35386 1458.08     46.9858  1452.86     49.2512  127.574    40.0733     137.652     220.073     
1 1 1 13 11 43 o 3  96.4767 2.65069 168.527     12.5324  162.171     13.0317  55.1158    69.6321     16.6122     69.6321     
1 1 1 13 11 44 o 14 125.378 2.74406 280.711     17.762   277.502     16.6677  56.2873    344.178     48.4708     164.178     
1 1 1 13 11 45 o 2  125.847 2.49149 309.105     15.836   254.43      15.4794  74.3449    316.691     10.1661     136.691     
1 1 1 13 11 46 o 3  128.752 2.45543 297.362     15.12    291.105     16.4913  66.5899    58.0338     32.0358     238.034     
1 1 1 13 11 47 o 11 47.8717 3.49464 40.0518     7.67627  42.2088     8.83277  16.2639    0.562188    76.4552     0.562188    
1 1 1 13 11 48 o 13 94.5682 2.66776 171.942     12.1966  146.425     12.9073  61.3286    155.548     21.7854     155.548     
1 1 1 13 11 49 o 4  317.699 3.30875 1808.59     51.5022  1776.63     53.8071  259.409    266.659     90.4223     266.659     
1 1 1 13 11 50 o 10 215.86  2.83514 852.363     28.415   802.328     32.6291  157.856    8.04656     27.7519     8.04656     
1 1 1 13 11 51 o 14 25.1986 5.15312 12.2578     6.41152  10.744      7.40358  19.2389    226.61      51.4314     226.61      
1 1 1 13 11 52 o 17 136.11  2.53384 336.723     16.3799  321.356     18.0778  96.5274    248.037     16.993      248.037     
1 1 1 13 11 53 o 14 57.8354 3.15959 62.0894     9.28924  57.5755     8.88512  18.3128    150.301     4.27619     150.301     
1 1 1 13 11 54 o 7  135.958 2.37955 320.576     15.9517  335.881     16.4755  96.8242    166.735     18.0865     166.735     
1 1 1 13 11 55 o 13 81.7947 2.597   117.341     10.7173  120.876     10.513   44.2537    229.392     11.1462     49.3922     
1 1 1 13 11 56 o 6  91.1057 2.49216 139.868     11.0488  155.743     11.6652  50.5978    50.6675     12.5891     230.667     
1 1 1 13 11 57 o 11 111.099 2.76638 220.691     16.0651  218.948     14.6638  86.9001    283.749     34.6431     283.749     
1 1 1 13 11 58 o 11 89.3563 2.74541 135.727     12.042   149.127     12.4835  43.2624    7.35698     25.6238     187.357     
1 1 1 13 11 59 o 12 72.285  2.92983 90.972      10.5047  95.8371     10.6303  50.2268    280.745     21.719      280.745     
1 1 1 13 11 60 o 16 135.296 2.72891 318.073     17.7765  334.591     19.1907  103.477    194.489     34.4948     194.489     
1 1 1 13 11 61 o 7  142.669 2.93867 354.312     20.0207  372.425     21.9491  120.222    296.442     58.2494     296.442     
1 1 1 13 11 62 o 6  17.555  5.20807 0.177278    7.43616  1.88177     8.03227  1.82889    74.0397     5.4965      74.0397     
1 1 1 13 11 63 o 4  105.515 2.93082 205.57      15.0188  192.769     15.8631  77.1288    180.939     19.7352     180.939     
1 1 1 13 11 64 o 19 76.941  3.17283 100.574     11.8882  112.237     12.4705  40.0434    13.6607     16.8488     193.661     
1 1 1 13 11 65 o 1  100.511 2.9973  182.146     14.4586  180.14      15.6367  65.8728    159.002     4.16297     159.002     
1 1 1 13 11 66 o 8  28.413  5.74621 13.1612     8.29264  17.4623     8.95747  6.86535    214.612     11.6432     34.6118     
1 1 1 13 11 67 o 7  27.5519 5.38777 5.65732     8.35198  22.2903     8.46013  2.74416    236.527     22.5439     56.5266     
1 1 1 13 11 68 o 3  28.7026 5.74388 18.0118     8.63158  13.3881     8.75872  7.4805     191.008     12.7899     11.0079     
1 1 1 13 11 69 o 16 36.7055 5.21627 35.1987     9.11686  17.1196     9.39689  18.0655    124.89      9.32737     124.89      
1 1 1 13 11 70 o 10 33.2899 5.38012 22.8107     9.02605  19.8376     8.5428   13.8428    144.352     7.2218      324.353     
1 1 1 13 11 71 o 2  74.2918 3.27945 98.9264     12.3119  101.014     11.978   39.9781    121.697     11.8986     301.697     
1 1 1 13 11 72 o 11 50.6694 4.10893 37.2469     10.0259  58.8523     9.89896  36.9584    211.06      30.4377     211.06      
1 1 1 13 11 73 o 3  70.1476 3.47182 87.92       12.5929  91.6225     11.6116  48.9647    184.635     12.2705     184.635     
1 1 1 13 11 74 o 4  108.929 2.99537 220.362     17.019   209.476     15.618   69.3312    127.501     3.49351     127.501     
1 1 1 13 11 75 o 15 55.3165 4.07024 62.9258     11.7908  51.4275     10.454   34.8405    46.3417     3.48569     46.3417     
1 1 1 13 11 76 o 18 95.1731 2.9761  173.491     15.3418  156.218     12.9688  77.0789    313.08      38.042      313.08      
1 1 1 13 11 77 o 8  17.8238 5.4055  -1.95892    7.99346  3.61822     9.37245  1.2999     77.5696     17.7139     77.5696     
1 1 1 13 11 78 o 4  24.7294 6.21335 11.4701     8.86749  11.0908     10.5303  6.44114    227.27      10.6373     47.2698     
1 1 1 13 11 79 o 14 65.6993 3.82317 83.6354     12.5939  77.5518     12.352   43.6579    164.943     9.66331     164.943     
1 1 1 13 11 80 o 2  19.7965 5.89948 0.0871619   8.41722  6.32995     11.4747  1.6625     71.918      9.30155     251.918     
1 1 1 13 11 81 o 12 33.2397 6.96353 29.5787     12.8055  17.1475     12.6734  10.9567    237.097     14.3342     57.0971     
1 1 1 13 11 82 f 0  29.1429 7.24779 8.62116     15.3544  23.0272     12.6743  23.3919    26.2609     0           0           
1 1 1 13 11 83 o 1  30.2939 7.7794  22.9288     15.5219  15.3862     15.2243  13.446     214.134     3.538       34.1342     
1 1 1 13 11 84 o 13 22.4535 6.90882 4.23255     14.7419  2.21504     14.3264  5.00367    13.5011     9.80866     193.501     
1 1 1 13 11 85 o 1  25.3142 7.37599 16.0764     15.692   3.8628      15.08    4.76507    157.164     14.5852     337.164     
1 1 1 13 11 86 o 18 21.8321 6.83417 8.61497     15.1497  -5.97173    15.1303  2.89441    341.415     5.2274      161.415     
1 1 1 13 11 87 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 11 88 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 12 0  o 5  193.461 2.60706 663.945     25.2551  663.945     25.2551  134.796    1.1012e-07  10.2006     180         
1 1 1 13 12 1  o 12 246.925 2.8667  1069.96     35.4639  1091.37     35.4812  110.179    139.199     123.357     319.199     
1 1 1 13 12 2  o 19 274.459 3.03733 1331.38     41.7702  1338.89     41.7821  165.655    350.814     51.3605     170.814     
1 1 1 13 12 3  o 2  414.2   4.07277 3048.59     82.674   3034.81     86.3563  374.013    173.443     161.616     173.443     
1 1 1 13 12 4  o 19 351.751 3.62696 2172.87     62.5373  2213.96     65.3241  150.101    32.8108     202.304     212.811     
1 1 1 13 12 5  o 5  486.277 4.8253  4183.05     120.343  4204.13     114.755  359.535    30.9832     20.7444     30.9832     
1 1 1 13 12 6  o 17 247.873 2.95292 1079.84     35.882   1098.2      37.4743  144.443    251.351     53.4509     71.3505     
1 1 1 13 12 7  o 3  450.181 4.25051 3603.63     95.8941  3583.28     95.892   212.263    344.041     223.402     164.041     
1 1 1 13 12 8  o 17 489.316 4.51647 4241.97     110.746  4249.76     110.756  303.1      161.978     97.8998     341.978     
1 1 1 13 12 9  o 11 296.98  3.19069 1570.78     47.4863  1555.97     47.4866  202.482    303.582     10.7787     123.582     
1 1 1 13 12 10 o 14 233.546 2.87126 963.127     34.3175  970.394     32.8713  103.346    243.52      117.287     63.5196     
1 1 1 13 12 11 o 19 534.524 5.10883 5040.05     130.517  5096.68     142.968  479.721    289.816     193.59      289.816     
1 1 1 13 12 12 o 6  407.485 4.12863 2945.59     88.0546  2943.03     80.3937  322.417    80.9998     65.2504     80.9998     
1 1 1 13 12 13 o 7  111.719 2.33461 226.307     13.0498  216.53      13.0581  23.3284    121.573     79.3013     301.573     
1 1 1 13 12 14 o 6  96.6409 2.38159 172.084     11.5298  159.486     11.492   16.7473    45.2504     18.7666     225.25      
1 1 1 13 12 15 o 12 357.48  3.73313 2257.88     66.8806  2273.85     66.8754  355.074    283.716     213.097     283.716     
1 1 1 13 12 16 o 7  503.45  4.83871 4507.34     122.082  4485.74     122.079  402.816    349.742     84.974      349.742     
1 1 1 13 12 17 o 3  289.263 3.13667 1481.91     46.4452  1484.78     44.4708  256.798    234.768     114.66      234.768     
1 1 1 13 12 18 o 14 507.766 4.86884 4592.45     123.898  4556.69     123.889  362.934    310.778     1.50877     130.778     
1 1 1 13 12 19 o 1  333.099 3.5733  1962.77     62.2976  1972.15     56.863   195.456    150.398     81.1847     330.398     
1 1 1 13 12 20 o 3  320.611 3.41615 1807.26     56.0587  1838.07     53.6676  253.894    331.362     58.0733     331.362     
1 1 1 13 12 21 o 2  391.719 3.98567 2708.25     78.2296  2735.08     78.2516  287.069    168.414     18.6879     168.414     
1 1 1 13 12 22 f 0  228.195 2.96611 927.405     34.7093  919.012     33.1182  113.245    233.543     0           0           
1 1 1 13 12 23 o 4  247.854 3.14177 1083.3      39.0235  1095.22     39.0235  96.077     100.554     154.386     280.554     
1 1 1 13 12 24 o 13 182.039 2.79961 595.745     25.5319  579.313     25.5444  141.315    227.138     49.7742     227.138     
1 1 1 13 12 25 o 15 110.492 2.64169 221.694     15.0039  211.723     14.2109  33.9307    196.432     61.9121     16.4318     
1 1 1 13 12 26 o 16 340.789 3.62692 2062.44     61.9442  2057.59     61.9393  271.896    144.37      67.4182     144.37      
1 1 1 13 12 27 o 3  69.4615 2.6203  92.7763     9.01642  79.0638     9.1066   6.07439    247.629     66.6773     247.629     
1 1 1 13 12 28 o 2  185.395 2.62689 616.114     23.8464  602.661     24.9394  109.55     191.759     30.2121     11.7594     
1 1 1 13 12 29 o 9  264.096 3.05054 1242.91     39.4772  1230.8      41.2413  112.736    354.773     143.638     174.773     
1 1 1 13 12 30 o 19 246.913 2.86184 1076.04     35.4113  1086.09     35.412   209.614    47.4944     81.5014     47.4944     
1 1 1 13 12 31 o 6  54.0836 2.77111 48.4023     7.41033  56.0137     7.48186  10.6946    267.522     62.8734     267.522     
1 1 1 13 12 32 o 3  207.219 2.77656 763.714     28.8222  759.145     28.8446  137.802    91.408      9.03413     271.408     
1 1 1 13 12 33 o 16 77.025  2.56271 109.058     9.83761  101.857     9.88071  13.4267    275.942     62.3673     95.9423     
1 1 1 13 12 34 f 0  58.5493 3.0854  59.2525     8.69331  63.0579     9.28471  71.8738    146.219     0           0           
1 1 1 13 12 35 o 11 393.903 4.22403 2749.66     85.5501  2760.24     81.1482  277.964    243.572     4.92768     243.571     
1 1 1 13 12 36 o 8  288.156 3.52811 1481.9      52.2858  1465.08     49.5896  264.832    100.226     134.179     100.226     
1 1 1 13 12 37 o 1  479.335 4.88415 4082.44     117.324  4084.4      117.325  389.175    105.611     109.372     105.611     
1 1 1 13 12 38 o 8  139.602 2.56531 348.934     17.5167  342.751     18.329   117.26     160.887     69.9701     160.887     
1 1 1 13 12 39 o 2  70.7457 3.03785 78.2138     11.1591  100.74      9.9452   15.1182    50.3393     40.151      230.339     
1 1 1 13 12 40 o 9  124.008 2.58155 258.431     15.6936  287.89      16.3514  56.5703    262.177     47.008      82.1771     
1 1 1 13 12 41 o 7  175.603 2.66151 551.736     22.3631  542.143     24.4159  121.805    232.091     10.711      232.091     
1 1 1 13 12 42 o 10 164.25  2.57569 477.256     21.2024  479.707     21.1998  106.923    125.079     2.84301     305.079     
1 1 1 13 12 43 o 13 116.844 2.59094 244.864     14.7368  239.929     15.5479  13.1512    243.918     126.977     63.9178     
1 1 1 13 12 44 o 13 197.117 3.16163 700         30.2642  679.231     32.1372  108.918    184.713     47.4993     4.71332     
1 1 1 13 12 45 o 8  329.58  3.747   1924.2      64.8731  1934.47     58.732   211.144    357.055     28.0739     177.055     
1 1 1 13 12 46 o 6  209.299 2.62967 766.818     26.3987  787.613     28.7434  158.443    197.156     37.1987     197.156     
1 1 1 13 12 47 o 6  116.059 2.43612 235.754     14.1503  242.596     14.1542  74.3807    158.545     2.65474     158.545     
1 1 1 13 12 48 o 16 78.4067 2.50923 109.134     10.0262  109.473     9.63705  38.6593    42.1756     19.4763     42.1756     
1 1 1 13 12 49 o 18 334.307 3.09413 1971.56     51.8337  1998.37     51.8399  268.164    129.908     83.3574     129.908     
1 1 1 13 12 50 o 10 211.505 2.56379 803.407     27.1478  784.741     27.1979  158.882    101.619     34.8733     101.619     
1 1 1 13 12 51 o 15 355.079 3.40863 2224.18     59.5199  2259.95     61.7837  250.227    335.342     20.7211     335.342     
1 1 1 13 12 52 o 14 41.2007 3.78652 32.6326     7.49929  28.8762     7.72071  3.91743    322.58      47.2233     322.58      
1 1 1 13 12 53 o 13 161.67  2.44351 455.422     20.1548  472.963     19.4131  104.243    309.393     4.78823     129.393     
1 1 1 13 12 54 o 2  127.535 2.46739 280.775     15.7     297.64      15.8026  101.419    191.021     39.6191     191.021     
1 1 1 13 12 55 o 18 107.606 2.51371 198.442     13.4391  213.699     13.6267  56.6043    162.68      25.3329     342.68      
1 1 1 13 12 56 o 11 53.5865 3.31576 56.7066     8.78058  46.6602     8.77597  23.2079    80.9536     9.0198      260.954     
1 1 1 13 12 57 o 19 79.2902 2.80206 114.592     11.1082  109.818     11.0861  34.8307    250.831     29.0581     70.8312     
1 1 1 13 12 58 o 2  31.2275 5.42257 20.3146     8.37449  16.2938     8.52241  2.90402    345.925     25.3778     345.925     
1 1 1 13 12 59 o 13 117.589 2.7472  240.79      17.3313  252.443     14.8344  80.2979    45.4786     10.4862     45.4786     
1 1 1 13 12 60 o 9  94.0113 2.68656 164.576     12.9652  151.033     12.2993  67.8981    50.1956     18.1501     50.1956     
1 1 1 13 12 61 o 18 77.9553 3.085   102.331     12.5745  115.636     11.2748  59.3465    143.132     22.8643     143.132     
1 1 1 13 12 62 o 16 21.9766 5.74446 1.13148     9.68545  10.5727     8.05187  1.467      74.6376     17.1619     74.6376     
1 1 1 13 12 63 o 13 60.0741 3.57776 70.4639     10.6366  60.2301     10.6469  49.6619    312.857     36.2375     312.857     
1 1 1 13 12 64 o 14 36.9846 4.97723 22.6666     8.87051  28.8763     8.87723  4.13195    296.18      35.1453     116.18      
1 1 1 13 12 65 o 17 81.1711 3.04831 118.014     12.0691  118.899     12.6369  31.2621    90.7759     40.6321     270.776     
1 1 1 13 12 66 o 13 63.3624 3.43478 72.0005     10.6639  73.4204     10.983   44.2616    93.4555     11.3808     93.4555     
1 1 1 13 12 67 o 9  107.785 2.88058 207.13      15.1975  210.2       15.8627  73.8814    263.085     11.0891     263.085     
1 1 1 13 12 68 o 14 72.5963 3.28275 96.9445     11.5694  93.7096     12.1687  41.2574    321.9       7.88234     141.9       
1 1 1 13 12 69 o 7  31.7818 5.60597 17.3773     8.77025  21.711      9.07231  13.6099    72.1864     4.27399     252.186     
1 1 1 13 12 70 o 3  50.0311 4.05241 55.2145     9.90459  37.8895     9.73766  19.0325    332.519     22.676      152.519     
1 1 1 13 12 71 o 12 69.6994 3.47811 86.7659     11.6547  90.1314     12.4842  45.772     97.6823     5.77022     97.6823     
1 1 1 13 12 72 f 0  70.7327 3.49131 94.9397     11.8976  87.7524     12.6357  46.5824    145.7       0           0           
1 1 1 13 12 73 o 13 83.8588 3.28665 135.853     13.2972  120.527     14.1105  53.7593    336.23      3.66287     336.23      
1 1 1 13 12 74 o 7  91.1523 3.35138 156.307     15.1753  147.434     15.3219  59.1608    322.092     5.5406      322.092     
1 1 1 13 12 75 o 15 50.194  4.52365 47.7304     11.6765  47.8703     10.516   40.9209    196.471     25.027      196.471     
1 1 1 13 12 76 o 13 40.9858 5.62266 34.1896     11.2201  32.667      11.0444  27.3941    193.719     9.44076     193.719     
1 1 1 13 12 77 f 0  25.4898 6.45605 7.09381     10.876   16.1963     10.6531  12.6988    120.453     0           0           
1 1 1 13 12 78 o 3  20.8051 6.29763 7.27816     12.7115  -3.25615    10.9775  0.341701   330.937     19.7202     330.937     
1 1 1 13 12 79 o 5  26.2913 6.35557 14.2038     10.1855  12.9706     9.94638  7.32066    351.478     10.2558     171.478     
1 1 1 13 12 80 o 11 17.1603 5.71906 -11.6203    12.2699  -9.35573    13.1895  0.484743   319.172     12.5658     319.172     
1 1 1 13 12 81 o 4  23.1159 6.94154 9.52162     14.2088  -1.96982    14.4128  3.41209    45.4661     16.2827     225.466     
1 1 1 13 12 82 o 18 26.8905 7.50344 6.72283     15.4921  17.4362     14.972   9.31932    227.85      8.00932     47.8497     
1 1 1 13 12 83 o 11 46.6085 6.52803 45.4884     14.899   46.5895     14.514   35.1856    41.7467     20.3121     41.7467     
1 1 1 13 12 84 o 8  21.2956 6.45173 -4.15165    12.5949  9.59395     12.8075  2.00201    319.14      1.04496     139.14      
1 1 1 13 12 85 o 16 18.1545 5.89145 -3.69542    12.244   -3.90782    12.1378  1.71589    163.036     16.3366     163.036     
1 1 1 13 12 86 o 12 28.1296 7.22163 9.69033     13.764   24.8675     13.7344  1.70236    163.871     24.8813     343.871     
1 1 1 13 12 87 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 13 13 0  o 16 429.457 5.81909 3272.72     125.134  3272.72     125.134  413.08     180         198.392     180         
1 1 1 13 13 1  o 8  177.125 2.5422  556.645     22.5448  556.645     22.5448  153.344    210         60.0767     210         
1 1 1 13 13 2  f 0  426.147 4.07295 3220.67     86.9461  3220.67     86.9461  206.581    240         0           0           
1 1 1 13 13 3  o 15 174.697 2.53773 541.504     22.1961  541.504     22.1961  59.909     90.0001     44.5839     90.0001     
1 1 1 13 13 4  o 7  403.331 4.07106 2885.23     82.249   2885.23     82.249   438.365    120         287.377     120         
1 1 1 13 13 5  o 17 181.609 2.68008 585.243     24.368   585.243     24.368   94.5643    330         75.7564     150         
1 1 1 13 13 6  o 16 89.0132 2.51978 141.082     11.1993  141.082     11.1993  11.675     180         52.4608     8.57788e-06 
1 1 1 13 13 7  f 0  243.744 2.89132 1053.76     35.2951  1053.76     35.2951  279.078    210         0           0           
1 1 1 13 13 8  o 12 262.463 2.98283 1221.77     39.2107  1221.77     39.2107  303.333    240         251.688     240         
1 1 1 13 13 9  o 13 470.549 4.41424 3927.15     104.052  3927.15     104.052  282.848    90          120.643     270         
1 1 1 13 13 10 o 10 373.027 3.69333 2467.81     69.0124  2467.81     69.0124  358.827    120         173.845     120         
1 1 1 13 13 11 o 11 84.3488 2.52809 126.759     10.6426  126.759     10.6426  10.9064    330         44.3452     150         
1 1 1 13 13 12 o 1  95.4315 2.51944 162.064     12.011   162.064     12.011   16.2848    360         87.9127     180         
1 1 1 13 13 13 o 15 196.408 2.73937 684.439     26.9394  684.439     26.9394  190.036    210         147.951     210         
1 1 1 13 13 14 o 1  32.3942 4.1325  20.3178     6.06065  20.3178     6.06065  63.6872    60          143.925     60          
1 1 1 13 13 15 o 17 127.032 2.35068 286.553     14.9415  286.553     14.9415  80.1726    90          33.4439     90          
1 1 1 13 13 16 o 2  237.265 3.27287 998.921     38.882   998.921     38.882   78.7841    120         186.835     300         
1 1 1 13 13 17 o 11 200.256 3.0268  711.734     30.3446  711.734     30.3446  190.614    150         92.9071     150         
1 1 1 13 13 18 f 0  386.505 4.16106 2650.3      80.555   2650.3      80.555   268.871    180         0           0           
1 1 1 13 13 19 f 0  67.4143 2.81399 81.3851     9.4303   81.3851     9.4303   12.4417    30          0           0           
1 1 1 13 13 20 o 7  25.5868 5.56301 14.4667     6.23734  14.4667     6.23734  67.9634    240         146.481     240         
1 1 1 13 13 21 o 9  19.8709 5.97845 9.93987     6.04769  9.93987     6.04769  2.33771    270.001     4.88933     270.001     
1 1 1 13 13 22 o 1  57.3077 3.00946 59.1677     8.53087  59.1677     8.53087  0.418919   300.002     1.83246     300.002     
1 1 1 13 13 23 o 19 67.6597 2.8379  81.9909     9.54424  81.9909     9.54424  42.7666    150         168.979     150         
1 1 1 13 13 24 o 17 408.672 4.1119  2963.15     84.1744  2963.15     84.1744  270.898    180         46.1916     8.65135e-06 
1 1 1 13 13 25 o 16 273.056 3.19516 1322.75     43.6956  1322.75     43.6956  234.087    30          75.8401     30          
1 1 1 13 13 26 o 15 106.111 2.65786 200.314     14.0934  200.314     14.0934  56.9152    60          19.7291     60          
1 1 1 13 13 27 o 3  238.978 2.96988 1013.26     35.543   1013.26     35.543   150.247    270         41.8916     90          
1 1 1 13 13 28 o 13 251.64  3.04615 1123.46     38.3888  1123.46     38.3888  133.463    300         93.0527     120         
1 1 1 13 13 29 o 15 57.2114 3.05012 59.0041     8.62794  59.0041     8.62794  48.2331    330         173.499     330         
1 1 1 13 13 30 o 6  278.768 3.39089 1378.98     47.3399  1378.98     47.3399  213.341    360         29.1723     360         
1 1 1 13 13 31 o 11 165.959 2.59025 488.894     21.5191  488.894     21.5191  99.8643    30          36.519      210         
1 1 1 13 13 32 o 15 205.307 2.81627 748.018     28.9513  748.018     28.9513  120.969    60          49.8162     240         
1 1 1 13 13 33 o 18 48.3671 3.243   42.5812     7.68837  42.5812     7.68837  2.50481    270         20.9893     270         
1 1 1 13 13 34 o 19 158.48  2.85573 446.1       22.6472  446.1       22.6472  77.9967    300         68.3956     120         
1 1 1 13 13 35 o 13 144.67  2.52704 371.658     18.2957  371.658     18.2957  62.3345    330         79.7696     150         
1 1 1 13 13 36 f 0  136.34  2.5822  330.208     17.6144  330.208     17.6144  7.13997    180         0           0           
1 1 1 13 13 37 o 18 12.3147 5.24939 2.61102     5.8952   2.61102     5.8952   10.9231    210         22.5068     210         
1 1 1 13 13 38 o 17 394.179 4.43723 2758.97     87.6027  2758.97     87.6027  322.73     60          91.7675     60          
1 1 1 13 13 39 o 6  133.968 2.76846 318.986     18.5506  318.986     18.5506  128        90          89.9153     90          
1 1 1 13 13 40 o 11 79.3135 2.68761 112.285     10.6264  112.285     10.6264  9.74321    300         2.95363     300         
1 1 1 13 13 41 f 0  105.688 2.41661 198.622     12.7692  198.622     12.7692  79.0297    330         0           0           
1 1 1 13 13 42 o 15 78.5077 2.57859 109.969     10.095   109.969     10.095   38.6476    360         4.92921     360         
1 1 1 13 13 43 o 12 112.963 2.3888  226.811     13.4957  226.811     13.4957  86.3127    30          18.215      30          
1 1 1 13 13 44 o 11 194.256 2.5613  669.707     24.9147  669.707     24.9147  180.416    240         91.6572     240         
1 1 1 13 13 45 o 12 79.549  2.65692 112.949     10.5379  112.949     10.5379  41.2683    90          18.3253     90          
1 1 1 13 13 46 f 0  68.1206 2.8315  83.1413     9.58906  83.1413     9.58906  78.5823    300         0           0           
1 1 1 13 13 47 f 0  53.4239 3.50986 51.9395     9.20006  51.9395     9.20006  50.7682    330         0           0           
1 1 1 13 13 48 o 18 87.8448 2.79651 137.696     12.254   137.696     12.254   19.451     180         15.0523     180         
1 1 1 13 13 49 o 19 10.4984 4.91811 -1.74996    6.79969  -1.74996    6.79969  8.41317    30          17.5698     30          
1 1 1 13 13 50 o 14 52.4246 3.18055 49.8412     8.2088   49.8412     8.2088   12.9024    240         39.7381     60          
1 1 1 13 13 51 o 17 130.806 2.34663 304.05      15.3604  304.05      15.3604  40.4982    90          96.961      270         
1 1 1 13 13 52 o 2  158.816 2.43709 448.059     19.376   448.059     19.376   83.5482    300         48.3525     120         
1 1 1 13 13 53 o 10 92.1038 2.62744 151.269     12.0825  151.269     12.0825  47.0258    150         30.5188     330         
1 1 1 13 13 54 o 6  139.841 2.30994 347.518     16.1682  347.518     16.1682  108.328    1.91337e-07 28.0568     1.91337e-07 
1 1 1 13 13 55 f 0  76.3243 2.59877 104.125     9.88734  104.125     9.88734  82.5985    30          0           0           
1 1 1 13 13 56 o 15 110.628 2.51521 217.944     13.9117  217.944     13.9117  81.7767    240         15.2608     240         
1 1 1 13 13 57 o 11 18.3754 6.5321  8.92172     7.4017   8.92172     7.4017   13.4073    270         33.7827     270         
1 1 1 13 13 58 o 7  73.8508 3.04052 97.9399     11.1648  97.9399     11.1648  14.4406    300         69.4906     120         
1 1 1 13 13 59 o 2  75.6034 2.94066 102.542     11.064   102.542     11.064   28.8442    150         42.6949     330         
1 1 1 13 13 60 o 6  21.8089 6.52181 12.0961     7.20417  12.0961     7.20417  0.0640963  180         0.911033    180         
1 1 1 13 13 61 o 19 128.67  2.6025  295.034     16.7503  295.034     16.7503  88.0835    30          6.45204     30          
1 1 1 13 13 62 o 11 13.8305 6.01639 2.84504     8.09383  2.84504     8.09383  1.84167    59.9999     5.20823     59.9999     
1 1 1 13 13 63 o 10 67.0312 3.4429  81.4186     11.4223  81.4186     11.4223  59.5255    90          31.3535     90          
1 1 1 13 13 64 o 12 51.2097 3.89058 48.4915     9.69368  48.4915     9.69368  44.6671    120         32.7127     120         
1 1 1 13 13 65 o 5  99.3368 2.95802 176.852     14.666   176.852     14.666   45.9621    330         37.2884     150         
1 1 1 13 13 66 o 8  12.7459 5.753   0.889319    8.16459  0.889319    8.16459  12.1292    8.66254e-06 32.9287     8.66254e-06 
1 1 1 13 13 67 o 12 19.7313 7.04575 10.5444     8.63196  10.5444     8.63196  0.554121   30.0001     9.90873     210         
1 1 1 13 13 68 o 8  96.5979 3.04602 167.582     14.6786  167.582     14.6786  70.9413    240         17.6106     240         
1 1 1 13 13 69 o 11 32.2066 6.77717 23.214      9.51837  23.214      9.51837  19.0926    270         0.74604     270         
1 1 1 13 13 70 o 6  82.599  3.37666 123.394     13.8695  123.394     13.8695  37.6451    120         30.1649     300         
1 1 1 13 13 71 o 15 133.688 2.81149 320.174     18.7983  320.174     18.7983  99.1973    330         28.3772     330         
1 1 1 13 13 72 o 18 21.1532 7.22623 12.3171     8.91011  12.3171     8.91011  5.3713     1.31858e-05 2.05577     180         
1 1 1 13 13 73 o 8  180.876 2.98123 587.326     26.99    587.326     26.99    133.607    210         39.0101     210         
1 1 1 13 13 74 f 0  15.5874 6.75766 4.48373     10.1314  4.48373     10.1314  2.93608    240         0           0           
1 1 1 13 13 75 o 5  20.0903 7.83408 11.2626     11.4566  11.2626     11.4566  3.50834    90          2.50313     270         
1 1 1 13 13 76 o 11 51.1611 6.09163 52.4284     14.2887  52.4284     14.2887  33.4521    300         3.15291     300         
1 1 1 13 13 77 o 9  13.535  6.38407 -2.34659    11.7904  -2.34659    11.7904  2.66739    150         10.8452     150         
1 1 1 13 13 78 o 15 13.6095 6.40389 -1.99504    11.7431  -1.99504    11.7431  0.91238    180         3.73409     180         
1 1 1 13 13 79 o 2  24.8841 8.27577 17.6798     11.6051  17.6798     11.6051  8.05674    210         12.1297     30          
1 1 1 13 13 80 o 19 15.9761 7.11836 3.69409     12.0411  3.69409     12.0411  1.79839    240         18.8778     240         
1 1 1 13 13 81 o 4  9.54289 4.8329  -15.7271    10.7502  -15.7271    10.7502  10.104     90          26.8961     90          
1 1 1 13 13 82 f 0  52.0274 6.64829 55.9187     15.6548  55.9187     15.6548  28.8428    300         0           0           
1 1 1 13 13 83 f 0  33.9819 9.05095 30.9563     14.4194  30.9563     14.4194  24.211     150         0           0           
1 1 1 13 13 84 o 6  10.8737 5.44463 -13.1455    12.2706  -13.1455    12.2706  0.0926203  180         0.256814    180         
1 1 1 13 13 85 o 8  13.2762 6.39894 -4.61192    13.1384  -4.61192    13.1384  1.8467     210         6.03896     210         
1 1 1 13 13 86 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 0  0  o 3  1458.41 17.711  37773       1293.59  37773       1293.59  1086.58    2.43917e-07 63.8667     2.43917e-07 
1 1 1 14 0  1  o 9  760.888 6.18385 10265.5     235.728  10265.5     235.728  691.434    240         282.427     240         
1 1 1 14 0  2  o 9  592.197 4.75573 6217.35     141.097  6217.35     141.097  395.325    300         65.7478     120         
1 1 1 14 0  3  o 9  403.111 3.61474 2880.88     72.997   2880.88     72.997   392.507    180         202.677     180         
1 1 1 14 0  4  o 2  1479.15 12.1837 38831.8     902.86   38831.8     902.86   1057.49    240         23.3649     59.9999     
1 1 1 14 0  5  o 7  108.615 2.3015  209.595     12.5019  209.595     12.5019  69.7294    300         263.834     300         
1 1 1 14 0  6  o 13 536.158 5.27177 5097.48     141.586  5097.48     141.586  253.922    1.38119e-06 266.828     180         
1 1 1 14 0  7  o 4  300.792 3.66548 1604.66     55.2162  1604.66     55.2162  106.358    240         221.702     60          
1 1 1 14 0  8  o 10 775.753 7.45631 10673.3     289.752  10673.3     289.752  665.555    300         211.123     300         
1 1 1 14 0  9  o 17 575.908 6.3254  5882.66     182.459  5882.66     182.459  536.372    180         241.672     180         
1 1 1 14 0  10 o 12 553.13  5.83663 5425.94     161.708  5425.94     161.708  518.059    240         238.336     240         
1 1 1 14 0  11 o 10 1574.2  14.8313 44004.7     1169.57  44004.7     1169.57  1177.55    120         85.9419     120         
1 1 1 14 0  12 o 15 308.13  3.09243 1683.36     47.7306  1683.36     47.7306  136.064    2.79062e-06 171.727     180         
1 1 1 14 0  13 o 8  1452.85 11.9656 37453.9     870.927  37453.9     870.927  1171.65    60          251.845     60          
1 1 1 14 0  14 o 9  133.188 2.25203 314.853     15.012   314.853     15.012   5.71449    120         6.35595     300         
1 1 1 14 0  15 o 14 405.782 3.77434 2919.26     76.7229  2919.26     76.7229  352.52     1.18247e-06 121.815     1.18247e-06 
1 1 1 14 0  16 o 2  845.513 7.24936 12677.1     307.069  12677.1     307.069  740.047    60          265.852     60          
1 1 1 14 0  17 f 0  1736.64 14.7479 53548.8     1283.1   53548.8     1283.1   1197.76    120         0           0           
1 1 1 14 0  18 o 17 1499.49 12.7181 39906.3     955.401  39906.3     955.401  1105.48    180         61.5896     180         
1 1 1 14 0  19 o 1  1139.37 9.4224  23026.9     537.842  23026.9     537.842  688.112    60          255.289     240         
1 1 1 14 0  20 o 3  84.6351 2.06891 127.375     8.75131  127.375     8.75131  53.7392    300         181.739     300         
1 1 1 14 0  21 o 5  1699.09 13.3793 51247       1138.91  51247       1138.91  1331.67    2.84948e-06 235.716     2.84948e-06 
1 1 1 14 0  22 o 15 388.293 3.4961  2672.95     68.0055  2672.95     68.0055  342.388    60          130.686     60          
1 1 1 14 0  23 o 7  617.961 5.01799 6770.27     155.354  6770.27     155.354  621.106    300         361.427     300         
1 1 1 14 0  24 o 6  186.586 2.43909 617.508     22.7894  617.508     22.7894  89.9051    2.94471e-06 70.8731     180         
1 1 1 14 0  25 o 19 76.5795 2.18663 104.418     8.36052  104.418     8.36052  12.8537    60.0001     37.3664     60.0001     
1 1 1 14 0  26 o 19 513.965 4.38574 4683.35     112.926  4683.35     112.926  355.132    300         19.3243     120         
1 1 1 14 0  27 o 2  96.4715 2.1381  165.391     10.3138  165.391     10.3138  19.0243    2.31643e-05 79.9376     2.31643e-05 
1 1 1 14 0  28 o 1  776.3   6.51307 10687.3     253.302  10687.3     253.302  704.777    240         310.858     240         
1 1 1 14 0  29 f 0  775.283 6.49392 10659.6     252.226  10659.6     252.226  543.594    300         0           0           
1 1 1 14 0  30 o 7  1053.63 8.47683 19695.6     447.462  19695.6     447.462  828.752    9.33864e-08 171.075     9.33864e-08 
1 1 1 14 0  31 o 1  192.357 2.41129 656.263     23.2279  656.263     23.2279  94.1454    60          77.726      240         
1 1 1 14 0  32 o 2  482.693 4.37027 4131.44     105.677  4131.44     105.677  453.443    300         228.249     300         
1 1 1 14 0  33 o 9  193.226 2.5354  662.283     24.5321  662.283     24.5321  80.1422    180         110.129     8.77615e-06 
1 1 1 14 0  34 o 4  379.436 3.7541  2553.08     71.3532  2553.08     71.3532  188.181    60          155.16      240         
1 1 1 14 0  35 o 4  915.572 7.74111 14877.5     355.072  14877.5     355.072  727.977    120         175.846     120         
1 1 1 14 0  36 o 15 486.503 4.51678 4197.73     110.079  4197.73     110.079  397.812    360         116.752     360         
1 1 1 14 0  37 o 11 532.681 4.83117 5032.9      128.92   5032.9      128.92   416.113    60          90.4158     60          
1 1 1 14 0  38 o 7  238.169 2.72261 1006.04     32.477   1006.04     32.477   55.9409    300         219.106     120         
1 1 1 14 0  39 f 0  400.275 3.85817 2841.66     77.3605  2841.66     77.3605  220.466    180         0           0           
1 1 1 14 0  40 f 0  145.556 2.38994 376.063     17.4121  376.063     17.4121  19.188     240         0           0           
1 1 1 14 0  41 o 5  121.107 2.4656  260.571     14.9361  260.571     14.9361  18.9026    300         8.49737     300         
1 1 1 14 0  42 o 5  537.036 4.85734 5117.17     130.678  5117.17     130.678  382.469    180         25.1827     180         
1 1 1 14 0  43 o 3  251.994 3.133   1126.6      39.5373  1126.6      39.5373  180.829    240         15.3581     240         
1 1 1 14 0  44 o 6  143.874 2.54926 367.551     18.3544  367.551     18.3544  109.34     300         27.6651     300         
1 1 1 14 0  45 o 5  374.372 3.61794 2486.12     67.8488  2486.12     67.8488  295.826    1.01096e-06 79.6684     1.01096e-06 
1 1 1 14 0  46 o 11 96.944  2.25926 167.099     10.9491  167.099     10.9491  58.8843    60          15.4517     60          
1 1 1 14 0  47 f 0  49.7501 2.67521 44.6254     6.57889  44.6254     6.57889  31.322     120         0           0           
1 1 1 14 0  48 o 11 11.0778 4.50761 2.71736     4.00761  2.71736     4.00761  2.20955    2.44706e-05 4.51662     2.44706e-05 
1 1 1 14 0  49 o 15 586.043 5.48859 6098.89     161.131  6098.89     161.131  415.568    60          37.9623     59.9999     
1 1 1 14 0  50 o 3  236.282 3.04844 990.718     36.0696  990.718     36.0696  147.285    300         24.3488     120         
1 1 1 14 0  51 o 7  85.6922 2.61541 130.888     11.1839  130.888     11.1839  29.2133    360         7.6322      360         
1 1 1 14 0  52 o 13 76.8025 3.08262 105.583     11.7766  105.583     11.7766  26.1798    240         32.5115     60          
1 1 1 14 0  53 o 7  367.971 3.7442  2402.86     69.0128  2402.86     69.0128  335.756    120         179.07      120         
1 1 1 14 0  54 o 16 192.764 2.54993 659.362     24.6134  659.362     24.6134  136.023    360         14.8408     360         
1 1 1 14 0  55 o 16 373.115 3.84724 2470.94     71.9025  2470.94     71.9025  291.428    60          86.5017     60          
1 1 1 14 0  56 o 2  308.532 3.64315 1689.84     56.2942  1689.84     56.2942  176.386    300         56.4103     120         
1 1 1 14 0  57 o 9  276.735 3.34234 1359.44     46.3222  1359.44     46.3222  221.333    2.84652e-06 76.798      2.84653e-06 
1 1 1 14 0  58 o 13 146.051 2.53438 378.871     18.5245  378.871     18.5245  139.443    60          87.4631     60          
1 1 1 14 0  59 f 0  61.333  3.13009 67.7584     9.50333  67.7584     9.50333  17.7277    120         0           0           
1 1 1 14 0  60 o 14 201.882 2.66314 723.525     26.9222  723.525     26.9222  145.544    1.59489e-08 26.7593     1.59489e-08 
1 1 1 14 0  61 o 8  32.3771 4.05164 20.2646     5.9598   20.2646     5.9598   13.6137    240         51.4305     240         
1 1 1 14 0  62 o 15 15.8421 5.43384 6.56808     5.0449   6.56808     5.0449   13.8886    300         30.8691     300         
1 1 1 14 0  63 o 16 20.4055 7.19892 10.9523     8.95629  10.9523     8.95629  17.8948    180         43.9437     180         
1 1 1 14 0  64 o 10 190.356 2.83662 643.973     27.0329  643.973     27.0329  159.719    60          73.5921     60          
1 1 1 14 0  65 o 2  17.5854 6.54244 8.01932     7.64541  8.01932     7.64541  9.94873    300         23.747      300         
1 1 1 14 0  66 o 10 21.8025 6.75209 12.1983     7.68961  12.1983     7.68961  23.0967    8.65048e-06 61.2621     8.65048e-06 
1 1 1 14 0  67 o 13 30.5055 6.27083 20.3096     8.32001  20.3096     8.32001  2.39178    240         18.2551     240         
1 1 1 14 0  68 o 7  179.65  3.09729 574.714     27.8475  574.714     27.8475  118.465    120         8.27263     120         
1 1 1 14 0  69 o 10 115.646 3.32782 239.121     19.2137  239.121     19.2137  83.0568    180         19.4764     180         
1 1 1 14 0  70 o 13 40.1279 5.44028 31.7643     9.77691  31.7643     9.77691  15.604     240         8.05783     240         
1 1 1 14 0  71 o 9  8.87209 4.39845 -7.7321     7.40203  -7.7321     7.40203  25.5499    120         55.9554     120         
1 1 1 14 0  72 o 13 135.852 3.20607 329.872     21.7721  329.872     21.7721  89.8249    180         9.39445     180         
1 1 1 14 0  73 o 1  97.5122 3.28829 170.692     15.9854  170.692     15.9854  62.1741    240         2.63059     240         
1 1 1 14 0  74 o 8  59.6949 4.13021 65.5996     12.0654  65.5996     12.0654  37.8884    300         1.58737     300         
1 1 1 14 0  75 o 5  44.9052 5.8323  39.8232     11.8186  39.8232     11.8186  11.9235    180         9.05451     180         
1 1 1 14 0  76 o 10 80.1364 3.94128 116.69      15.6491  116.69      15.6491  55.0405    60          11.2805     60          
1 1 1 14 0  77 o 14 88.4804 3.79575 141.768     16.6875  141.768     16.6875  54.7354    300         0.843164    300         
1 1 1 14 0  78 o 6  29.7366 7.67416 21.5258     10.5342  21.5258     10.5342  2.58657    360         30.7064     180         
1 1 1 14 0  79 f 0  11.0694 5.29508 -3.8486     8.65504  -3.8486     8.65504  5.02058    240         0           0           
1 1 1 14 0  80 o 9  10.4074 5.06998 -6.06779    8.75771  -6.06779    8.75771  5.00121    120         13.6782     120         
1 1 1 14 0  81 o 13 52.4201 5.22175 52.8884     12.9353  52.8884     12.9353  37.4089    180         11.5861     180         
1 1 1 14 0  82 f 0  43.5591 5.72634 38.0458     11.2316  38.0458     11.2316  32.9656    240         0           0           
1 1 1 14 0  83 o 8  48.7721 5.08769 46.1431     11.6422  46.1431     11.6422  44.4019    300         33.5477     300         
1 1 1 14 0  84 o 6  12.71   5.98495 -2.19231    10.2883  -2.19231    10.2883  1.26781    180         4.48656     180         
1 1 1 14 0  85 o 15 24.4074 8.4527  17.1403     12.25    17.1403     12.25    7.30835    240         6.74905     60          
1 1 1 14 0  86 o 6  10.7514 5.31494 -9.49318    10.5867  -9.49318    10.5867  1.5597     120         4.2264      120         
1 1 1 14 0  87 o 18 53.8042 8.05521 61.6355     19.1045  61.6355     19.1045  17.1653    180         28.7977     8.67961e-06 
1 1 1 14 0  88 o 6  13.0885 6.44124 -11.3959    15.0735  -11.3959    15.0735  0.321709   60.0003     1.63501     60.0002     
1 1 1 14 0  89 o 15 18.511  8.33134 5.12314     16.9768  5.12314     16.9768  1.6627     120         12.0516     300         
1 1 1 14 0  90 o 11 21.1909 9.06553 11.8771     17.7123  11.8771     17.7123  1.52778    360         0.897265    180         
1 1 1 14 0  91 o 3  20.0684 9.48045 1.71176     26.178   1.71176     26.178   1.36168    240         4.91374     60          
1 1 1 14 0  92 o 18 33.3565 12.8974 43.8431     30.7691  43.8431     30.7691  13.8506    120         3.7651      120         
1 1 1 14 0  93 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 1  0  o 14 465.026 4.50289 3834.31     104.893  3834.31     104.893  445.045    180         217.192     180         
1 1 1 14 1  1  o 1  895.35  8.61783 14171.7     405.456  14270.5     366.794  620.269    270.581     44.7489     90.5805     
1 1 1 14 1  2  o 15 598.731 5.90425 6384.64     185.836  6325.74     168.112  338.407    118.559     176.207     298.559     
1 1 1 14 1  3  o 13 882.989 8.32325 13911.8     368.29   13748       368.312  710.257    58.3294     155.373     58.3294     
1 1 1 14 1  4  o 13 865.64  7.91434 13485       351.497  13096.5     335.153  643.269    57.0132     45.8049     57.0132     
1 1 1 14 1  5  o 11 654.502 6.23468 7620.14     209.319  7569.13     199.589  518.782    56.7757     107.535     56.7757     
1 1 1 14 1  6  o 18 279.104 3.15233 1408.15     45.1466  1353        43.0409  102.788    126.146     173.05      306.146     
1 1 1 14 1  7  o 4  489.806 5.16311 4194.13     136.206  4311.27     116.176  325.016    320.371     39.4837     140.371     
1 1 1 14 1  8  o 15 1212.08 11.457  26090.1     660.154  26075.8     729.918  940.875    114.338     139.123     114.338     
1 1 1 14 1  9  o 11 509.216 5.01221 4578.9      130.891  4613.25     124.826  338.542    293.706     40.9356     113.705     
1 1 1 14 1  10 o 12 1457.07 13.3753 37407.2     999.414  38028.3     952.913  1103.76    8.34151     111.404     8.34152     
1 1 1 14 1  11 o 1  192.889 2.72465 657.086     25.7015  661.511     26.9631  103.927    146.352     14.4504     146.352     
1 1 1 14 1  12 o 2  505.187 4.66757 4474.67     118.152  4572.33     118.176  380.459    301.605     51.8759     301.605     
1 1 1 14 1  13 o 13 700.872 6.20638 8657.88     226.818  8759.3      208.673  499.085    277.294     1.01358     277.295     
1 1 1 14 1  14 o 15 465.527 4.24391 3821.41     100.951  3860.3      97.0045  328.412    233.724     5.6093      233.724     
1 1 1 14 1  15 o 19 1286.87 10.555  29551       706.496  29234       654.159  929.093    196.13      14.0343     196.13      
1 1 1 14 1  16 o 3  314.902 3.23276 1763.32     52.0236  1751.23     49.9956  121.062    203.53      191.572     23.5298     
1 1 1 14 1  17 o 10 428.336 4.07467 3240.17     87.4579  3263.09     87.4725  203.637    219.98      193.291     39.9796     
1 1 1 14 1  18 o 12 502.664 4.60969 4492.95     116.111  4463.87     116.129  409.114    322.115     116.345     322.115     
1 1 1 14 1  19 o 16 666.291 5.93509 7891.7      198.167  7849.28     198.184  506.379    209.314     70.7663     209.314     
1 1 1 14 1  20 o 15 506.359 4.69127 4518.04     119.028  4571.26     119.058  373.18     327.792     38.6115     327.792     
1 1 1 14 1  21 o 9  288.266 3.1984  1486.36     47.2011  1458.86     45.2021  193.544    67.6203     7.2411      67.6204     
1 1 1 14 1  22 o 15 750.698 6.47668 9893        238.745  10092.4     248.55   650.942    18.3257     244.714     18.3257     
1 1 1 14 1  23 o 10 166.414 2.49254 495.725     19.8779  485.767     21.6394  47.9823    146.873     90.4051     326.873     
1 1 1 14 1  24 o 3  592.528 5.25124 6224.92     152.764  6222.99     159.033  388.165    202.609     53.2373     22.6088     
1 1 1 14 1  25 o 10 303.672 3.22277 1619.11     46.9632  1649.45     51.0754  234.182    225.844     81.1451     225.844     
1 1 1 14 1  26 o 2  146.754 2.39181 371.678     16.838   391.729     18.3413  2.40991    86.3247     166.034     86.3248     
1 1 1 14 1  27 o 9  166.035 2.44669 506.06      19.8714  471.269     20.7828  55.1879    39.984      55.1165     219.984     
1 1 1 14 1  28 f 0  1336.1  11.0579 31767.1     725.405  31680.7     755.073  886.223    76.7275     0           0           
1 1 1 14 1  29 o 2  1073.98 8.86834 20604.9     467.586  20353.4     486.708  818.189    121.993     125.924     121.993     
1 1 1 14 1  30 o 11 123.697 2.22562 272.639     13.5031  269.834     14.0685  4.36602    303.544     140.078     303.544     
1 1 1 14 1  31 o 10 604.676 5.22437 6497.82     155.099  6469.96     161.449  359.771    351.048     123.194     171.048     
1 1 1 14 1  32 o 19 561.432 4.89932 5620.59     135.04   5558.48     140.562  304.688    148.245     171.99      328.245     
1 1 1 14 1  33 o 3  702.425 6.01655 8674.95     207.525  8833.62     216.036  458.1      266.349     63.0498     86.3489     
1 1 1 14 1  34 o 7  791.528 6.66645 11063.8     259.101  11178.6     269.714  573.67     147.875     44.4579     147.875     
1 1 1 14 1  35 o 3  143.52  2.31703 355.216     16.0139  375.012     17.3169  20.6432    148.295     138.394     328.295     
1 1 1 14 1  36 o 8  165.457 2.34984 482.705     18.7314  487.671     20.2161  111.751    334.557     60.1438     334.557     
1 1 1 14 1  37 o 10 222.865 2.63773 862.429     28.3115  898.494     30.6017  172.142    294.623     57.8989     294.623     
1 1 1 14 1  38 o 14 416.244 3.79769 3077.01     76.1049  3067.92     82.2055  251.055    68.6794     68.616      248.679     
1 1 1 14 1  39 o 5  352.479 3.40322 2190.28     57.7652  2215.71     62.4005  276.707    289.577     77.0998     289.577     
1 1 1 14 1  40 o 7  493.954 4.62771 4327.71     112.045  4331.51     117.012  384.824    123.444     94.3664     123.444     
1 1 1 14 1  41 o 8  205.035 2.60898 734.933     26.2726  755.616     27.343   177.651    210.026     114.595     210.026     
1 1 1 14 1  42 o 7  195.527 2.66771 673.76      25.5955  681.783     26.679   139.419    64.4065     31.8061     64.4065     
1 1 1 14 1  43 o 10 177.211 2.54356 543.849     22.5645  569.734     22.6047  101.136    61.7639     24.5803     241.764     
1 1 1 14 1  44 o 18 196.236 2.57396 664.627     24.2491  701.015     26.375   153.246    144.473     56.2056     144.473     
1 1 1 14 1  45 o 14 417.377 3.89712 3068.91     79.8692  3113.16     83.1463  347.982    254.661     131.823     254.661     
1 1 1 14 1  46 o 3  110.297 2.24321 215.878     12.1109  215.789     12.6555  66.7404    223.833     8.6196      223.833     
1 1 1 14 1  47 o 5  467.971 4.13511 3924.5      97.4244  3850.22     96.5284  366.601    211.366     101.195     211.366     
1 1 1 14 1  48 o 18 368.481 3.72629 2413.71     68.0511  2405.23     69.5578  258.383    182.466     22.162      182.466     
1 1 1 14 1  49 o 7  421.319 4.08955 3173.29     84.5784  3129.51     88.053   323.983    241.703     83.0561     241.703     
1 1 1 14 1  50 o 6  24.3215 4.32583 9.62522     5.58848  12.1334     5.00353  53.1365    293.485     118.547     293.485     
1 1 1 14 1  51 o 4  194.942 2.7801  663.813     26.3661  684.273     27.9497  125.409    3.78538     1.1683      183.785     
1 1 1 14 1  52 o 17 288.315 3.39834 1499.52     49.8603  1450.94     48.3458  206.026    254.009     32.3723     254.009     
1 1 1 14 1  53 o 6  243.191 3.11039 1041.55     35.9688  1057.1      39.7764  170.705    328.472     24.444      328.472     
1 1 1 14 1  54 o 5  292.239 3.29342 1507.07     47.0721  1524.15     49.3782  211.486    145.676     39.804      145.676     
1 1 1 14 1  55 o 15 221.008 2.90125 861.861     31.363   871.306     32.8925  144.594    172.751     3.06324     172.751     
1 1 1 14 1  56 o 2  398.254 4.15724 2854.29     80.9433  2783.08     84.8909  265.733    73.3191     7.08437     73.3192     
1 1 1 14 1  57 o 4  178.644 3.18291 563.605     24.0973  569.961     32.3     126.639    153.215     26.2689     153.215     
1 1 1 14 1  58 o 1  71.9941 2.88592 89.1004     10.114   95.544      10.6272  24.9211    89.3484     28.6763     269.348     
1 1 1 14 1  59 o 10 208.018 3.1501  758.248     31.8728  778.854     33.7977  168.91     286.817     71.3659     286.817     
1 1 1 14 1  60 o 9  240.286 3.35274 1032.01     38.5387  1020.33     42.1056  170.2      234.051     30.1782     234.051     
1 1 1 14 1  61 o 9  92.8887 2.68755 149.888     11.3554  157.106     13.5603  52.1881    198.582     6.19617     18.5815     
1 1 1 14 1  62 o 15 194.402 2.89541 648.295     26.6265  695.262     29.7853  152.409    94.4224     57.8069     94.4224     
1 1 1 14 1  63 o 19 150.472 2.73637 389.765     20.7058  415.448     20.5211  80.4703    199.944     29.4649     19.9439     
1 1 1 14 1  64 o 9  41.2642 3.91562 28.739      8.14544  33.1617     7.53288  1.49228    136.763     34.5495     316.763     
1 1 1 14 1  65 o 14 86.232  2.76964 134.635     11.8301  130.47      12.0384  62.2766    21.48       27.1311     21.48       
1 1 1 14 1  66 o 4  121.906 2.72462 276.883     16.838   252.834     16.4019  62.0803    233.555     27.3409     53.5546     
1 1 1 14 1  67 o 5  49.9328 3.71778 43.8478     9.55665  46.272      8.71238  18.2375    16.3721     1.35954     196.372     
1 1 1 14 1  68 o 17 129.328 2.81581 303.927     19.0392  292.739     17.4054  69.6291    349.697     21.7649     169.697     
1 1 1 14 1  69 o 12 76.6949 3.60758 95.8577     13.2988  116.122     14.2518  47.0996    127.692     2.5495      127.692     
1 1 1 14 1  70 o 6  60.5004 3.8508  61.3484     11.4944  71.2692     11.5536  32.1943    353.749     7.05979     173.749     
1 1 1 14 1  71 o 19 172.533 3.1778  527.472     27.4788  538.797     27.4241  110.746    352.029     6.00537     352.029     
1 1 1 14 1  72 o 18 56.5092 4.17451 56.4112     11.1971  60.1578     12.1004  40.9272    131.006     19.7175     131.006     
1 1 1 14 1  73 o 6  99.6388 3.57238 165.907     17.7963  192.848     17.6718  69.1884    81.3733     17.0424     81.3733     
1 1 1 14 1  74 o 5  32.6884 5.91146 14.7708     9.59602  26.5427     10.2194  12.5018    43.442      0.934542    43.4421     
1 1 1 14 1  75 o 5  72.5383 3.84647 98.5173     13.3805  92.9193     14.3207  46.5844    24.7724     6.98896     24.7724     
1 1 1 14 1  76 o 14 45.6002 5.2511  36.3082     11.3981  42.2313     11.7544  17.3711    121.921     17.3124     301.921     
1 1 1 14 1  77 o 13 102.176 3.77739 184.205     19.3403  195.258     19.1908  67.6327    87.5084     12.01       87.5084     
1 1 1 14 1  78 o 10 94.0533 3.54485 154.386     16.69    166.916     16.5801  52.0815    95.5873     9.09283     275.587     
1 1 1 14 1  79 o 1  46.9559 4.98281 32.2858     10.9942  52.262      11.2664  25.9704    239.254     1.52563     59.2535     
1 1 1 14 1  80 f 0  43.1465 5.24501 39.8549     10.7672  31.8885     10.9978  10.8434    350.651     0           0           
1 1 1 14 1  81 f 0  16.3312 5.14899 -4.51896    8.38945  -0.471504   8.77282  14.6177    246.728     0           0           
1 1 1 14 1  82 o 6  44.0043 5.45271 51.6986     11.1196  25.7614     11.4198  20.6212    68.5753     8.33301     248.575     
1 1 1 14 1  83 o 19 49.5645 5.00396 41.67       11.8896  53.3213     12.1176  30.1193    18.0701     4.72507     18.0701     
1 1 1 14 1  84 o 4  48.9742 5.7329  66.6031     13.4875  31.1567     12.8089  24.6498    81.3881     5.53107     261.388     
1 1 1 14 1  85 o 5  26.8388 6.86784 6.8457      12.0985  19.1263     12.4656  6.73748    125.754     10.5796     305.754     
1 1 1 14 1  86 o 7  41.3443 6.701   32.0864     13.0632  39.2079     14.1448  21.67      280.278     0.544569    100.278     
1 1 1 14 1  87 o 4  20.1053 6.20862 -16.8867    14.7255  6.92122     11.5266  3.16863    182.632     7.75701     2.63179     
1 1 1 14 1  88 o 9  25.326  7.53804 9.59471     15.6074  4.48903     17.164   3.81591    276.562     17.2046     96.5619     
1 1 1 14 1  89 o 1  20.1963 6.57995 -12.0298    15.0096  -1.0468     15.9868  3.32534    36.8902     5.15611     216.89      
1 1 1 14 1  90 o 12 22.1496 7.00829 -7.36385    15.531   6.47189     16.7902  3.93465    102.445     5.52963     282.445     
1 1 1 14 1  91 o 18 41.0103 9.54078 71.9057     25.3276  11.4974     31.0586  20.3033    359.101     0.260244    359.101     
1 1 1 14 1  92 x 16 ?       ?       ?           ?        ?           ?        12.3146    319.697     0           0           
1 1 1 14 2  0  o 2  1022.52 10.2424 18551.1     524.608  18551.1     524.608  778.349    180         76.2015     180         
1 1 1 14 2  1  o 8  748.835 8.09198 9979.61     284.003  9911.35     322.007  618.391    144.562     167.113     144.562     
1 1 1 14 2  2  o 16 742.425 7.99405 9768.23     297.425  9783.14     297.428  512.325    216.859     38.3116     36.8593     
1 1 1 14 2  3  o 1  524.838 5.33816 4873.21     136.664  4892.11     144.059  439.122    148.621     140.487     148.621     
1 1 1 14 2  4  o 11 205.184 2.82583 749.495     26.8959  742.57      31.0495  70.727     64.1738     38.862      64.1738     
1 1 1 14 2  5  o 16 310.661 3.14874 1695.45     49.0181  1725.08     49.0217  275.328    257.433     200.35      257.433     
1 1 1 14 2  6  o 2  436.151 3.98833 3351.17     87.1698  3391.42     87.1767  326.253    139.759     44.5866     139.759     
1 1 1 14 2  7  o 10 506.419 4.55592 4573.32     117.927  4517.55     113.299  371.908    289.999     30.2269     289.999     
1 1 1 14 2  8  o 10 484.193 4.3445  4134.66     101.299  4175.49     109.42   406.783    204.23      137.27      204.23      
1 1 1 14 2  9  o 4  888.271 7.45389 13927.4     318.835  14056.1     344.402  630.617    217.974     12.3628     37.9741     
1 1 1 14 2  10 o 8  846.128 7.76771 12504.2     343.751  12890.2     313.801  736.069    184.513     263.406     184.513     
1 1 1 14 2  11 o 12 934.33  8.20617 15255.9     375.845  15712.2     392.633  554.226    291.052     232.153     111.052     
1 1 1 14 2  12 o 1  420.001 4.16644 3161.64     81.7153  3091.18     93.1635  357.116    36.357      135.903     36.357      
1 1 1 14 2  13 o 17 296.677 3.20025 1583.33     45.5161  1536.32     49.4932  177.322    320.305     45.9754     140.305     
1 1 1 14 2  14 o 15 257.344 2.92472 1172.04     36.1071  1175.07     39.2686  96.7862    75.1706     153.403     255.171     
1 1 1 14 2  15 o 3  764.681 6.75753 10460.9     247.833  10275.5     269.422  706.254    242.496     327.111     242.496     
1 1 1 14 2  16 o 18 702.491 6.37983 8826.64     219.619  8672.95     229.377  460.231    234.269     79.2563     54.2686     
1 1 1 14 2  17 o 3  549.562 5.04613 5385.57     133.021  5321.49     144.613  317.702    78.2235     142.072     258.224     
1 1 1 14 2  18 o 10 542.356 4.78254 5217.9      129.985  5209.7      129.991  412.212    312.385     62.2241     312.385     
1 1 1 14 2  19 o 5  220.921 2.74138 839.893     31.535   890.199     29.022   119.419    301.34      76.0808     301.34      
1 1 1 14 2  20 o 19 1204.34 10.1111 25780.1     622.319  25710.7     597.972  895.053    152.579     72.7122     152.579     
1 1 1 14 2  21 o 13 413.594 3.7865  2996.93     78.4639  3066.56     78.4933  209.538    186.104     155.82      6.10355     
1 1 1 14 2  22 o 1  558.488 4.89144 5575.38     136.891  5482.72     136.907  435.04     27.5007     90.3109     27.5007     
1 1 1 14 2  23 o 1  765.55  6.45442 10340.5     247.602  10444.9     247.64   646.412    0.0357592   215.301     0.0357592   
1 1 1 14 2  24 o 11 931.49  7.73267 15354.4     360.939  15431.1     360.995  651.193    255.415     15.1842     75.4151     
1 1 1 14 2  25 o 10 579.192 5.06395 5934.08     141.205  5960.16     152.569  423.152    103.409     39.6708     103.408     
1 1 1 14 2  26 o 18 1172.08 9.82035 24172.4     565.173  24619.6     588.423  922.622    71.1118     188.211     71.1118     
1 1 1 14 2  27 o 4  135.933 2.37647 363.08      14.953   293.878     16.9885  16.0606    189.344     100.186     9.34366     
1 1 1 14 2  28 o 19 416.68  3.88645 3047.82     77.9651  3107.33     84.278   299.788    244.12      29.3588     244.12      
1 1 1 14 2  29 o 1  477.557 4.31386 4027.08     99.171   4058.92     107.185  398.077    322.665     139.8       322.665     
1 1 1 14 2  30 o 7  1210.21 9.87885 25806.3     575.686  26257.4     622.054  918.142    221.334     132.756     221.334     
1 1 1 14 2  31 o 7  358.724 3.61371 2246.99     62.2089  2315.38     67.6751  262.612    187.289     37.1748     187.289     
1 1 1 14 2  32 o 5  413.794 3.91688 3028.3      76.1901  3042.83     85.985   261.912    349.493     46.6694     169.493     
1 1 1 14 2  33 o 9  291.327 3.17587 1513.27     42.2899  1495.54     50.0686  236.339    25.5428     86.8022     25.5428     
1 1 1 14 2  34 o 17 233.464 2.92682 941.842     30.3325  990.688     37.9087  148.684    249.976     9.39413     69.9757     
1 1 1 14 2  35 o 5  144.555 2.33172 374.536     15.3538  366.161     18.2685  50.808     150.386     76.0082     330.386     
1 1 1 14 2  36 o 10 478.413 4.51542 4008.37     98.8974  4111.58     117.071  344.065    227.546     28.2938     227.546     
1 1 1 14 2  37 o 12 256.803 2.91852 1152.9      34.2959  1185.34     40.6376  146.841    131.424     51.2082     311.424     
1 1 1 14 2  38 o 7  575.028 5.17391 5792.6      136.211  5945.53     161.233  374.168    274.696     45.6419     94.6959     
1 1 1 14 2  39 o 5  234.84  2.8134  967.587     31.7012  987.853     34.487   167.814    41.3357     27.8112     41.3357     
1 1 1 14 2  40 o 1  175.761 2.63119 534.857     20.9772  560.559     25.2665  92.6538    314.629     38.799      134.629     
1 1 1 14 2  41 o 15 265.802 3.08838 1248.91     38.3726  1256.6      43.7448  195.733    112.108     39.4585     112.108     
1 1 1 14 2  42 o 10 238.975 2.80727 1003.06     32.2058  1022.05     35.0001  200.592    196.491     91.3645     196.491     
1 1 1 14 2  43 o 5  155.367 2.5472  407.802     18.8737  448.567     20.8031  107.26     292.761     24.1599     292.761     
1 1 1 14 2  44 o 12 198.44  2.55078 669.924     23.8163  726.929     26.9171  128.18     133.941     3.97631     313.941     
1 1 1 14 2  45 o 18 203.573 2.50051 717.666     23.9374  751.994     27.0496  143.199    17.7662     18.572      17.7662     
1 1 1 14 2  46 o 17 230.854 2.79778 904.485     31.6313  986.49      33.1056  138.01     318.397     31.2656     138.397     
1 1 1 14 2  47 o 9  222.519 2.8275  866.859     31.112   889.381     31.9504  164.925    353.74      37.4311     353.74      
1 1 1 14 2  48 o 4  337.592 3.55061 2054.82     57.3135  1990.01     62.6116  242.622    337.228     33.0576     337.228     
1 1 1 14 2  49 o 9  151.591 2.6149  421.701     20.8617  393.547     18.8694  41.1249    76.5469     114.38      256.547     
1 1 1 14 2  50 o 12 310.257 3.31232 1693.86     51.4952  1722.08     51.5041  189.059    310.385     35.2103     130.385     
1 1 1 14 2  51 o 6  95.6588 2.455   166.371     12.3494  158.626     11.1419  15.8496    68.5104     83.3007     248.51      
1 1 1 14 2  52 o 9  192.926 2.61049 675.731     25.8124  644.66      24.6693  91.3323    100.471     68.4866     280.471     
1 1 1 14 2  53 o 19 63.6038 2.91247 71.2273     8.96452  72.9082     9.49969  8.31513    309.088     34.0983     129.088     
1 1 1 14 2  54 o 18 166.759 2.63414 494.452     21.5246  492.03      22.4892  142.33     351.245     81.8071     351.245     
1 1 1 14 2  55 o 17 208.832 2.81917 778.317     30.2945  769.141     28.7001  122.808    135.001     25.0853     315.001     
1 1 1 14 2  56 o 15 393.799 4.53613 2760.26     92.1356  2755.97     86.829   265.593    230.23      12.1843     230.23      
1 1 1 14 2  57 o 13 219.1   3.24272 840.708     34.577   864.198     36.6265  130.495    284.984     23.5217     104.984     
1 1 1 14 2  58 o 6  218.127 3.274   849.672     36.8826  840.543     34.6721  134.621    178.527     13.7482     358.527     
1 1 1 14 2  59 f 0  35.3695 4.43368 24.3802     7.35075  21.5223     7.75698  25.1565    336.492     0           0           
1 1 1 14 2  60 o 18 132.483 2.68749 309.531     16.8461  314.297     18.7644  64.721     206.988     38.176      26.9878     
1 1 1 14 2  61 o 9  188.776 2.88627 630.608     25.5696  635.723     28.9483  114.024    267.469     14.0447     87.4691     
1 1 1 14 2  62 o 8  73.3744 3.29818 104.461     10.5627  88.2095     13.1207  39.7395    304.063     1.99116     124.063     
1 1 1 14 2  63 o 7  76.8969 3.01956 104.514     10.603   106.49      12.5125  41.0755    8.15425     6.68339     188.154     
1 1 1 14 2  64 o 11 149.206 2.87039 390.238     19.6011  402.47      23.1835  93.4588    8.2201      1.18902     188.22      
1 1 1 14 2  65 o 14 42.0481 3.97679 30.5446     8.29839  33.7944     7.99896  3.699      332.661     50.8832     332.661     
1 1 1 14 2  66 o 3  60.8614 3.21319 78.7459     9.89518  55.1348     9.3968   28.0382    63.7578     9.3677      243.758     
1 1 1 14 2  67 o 18 115.8   2.64201 241.805     15.4676  236.155     15.1571  51.0062    256.505     42.0004     76.5054     
1 1 1 14 2  68 f 0  96.7379 2.87963 172.986     13.3277  161.393     14.4527  33.2649    345.943     0           0           
1 1 1 14 2  69 o 19 43.0018 3.86218 33.3558     8.34245  34.0133     7.91496  22.3309    77.3879     0.577202    77.388      
1 1 1 14 2  70 o 1  113.103 3.12488 239.967     19.2609  218.487     16.0679  68.1265    224.531     4.21465     44.5306     
1 1 1 14 2  71 o 17 127.77  2.92757 308.825     20.3141  276.021     17.1243  86.7786    188.482     15.0468     188.482     
1 1 1 14 2  72 o 17 45.3839 4.03039 44.0751     9.93018  31.905      8.02837  20.4152    20.637      10.3817     200.637     
1 1 1 14 2  73 o 14 16.6257 5.09337 -7.7734     7.8645   3.47298     8.497    5.37344    308.488     19.2615     308.488     
1 1 1 14 2  74 o 6  56.2193 4.43594 49.078      12.557   67.9901     11.42    26.743     197.151     12.5945     17.151      
1 1 1 14 2  75 o 16 48.7307 4.80599 42.2908     11.6648  46.228      11.1075  19.7936    94.5515     16.7809     274.552     
1 1 1 14 2  76 o 8  40.2685 5.22958 29.4684     9.99625  32.1086     10.3337  11.5554    312.682     22.3838     132.682     
1 1 1 14 2  77 o 11 70.9645 3.829   101.624     13.3246  82.6388     13.5502  39.5165    223.318     5.53956     43.3185     
1 1 1 14 2  78 o 1  21.5869 5.71108 11.2526     8.75178  0.930243    8.7637   1.83637    66.02       24.5565     66.02       
1 1 1 14 2  79 o 12 35.8049 5.71676 30.4771     10.1629  19.9873     9.99935  16.7143    84.701      5.38957     264.701     
1 1 1 14 2  80 o 10 72.9559 3.7155  99.262      13.2829  96.2994     13.6901  39.8754    227.774     6.86001     47.774      
1 1 1 14 2  81 o 14 18.3875 5.36733 -7.50843    8.28549  8.37673     9.15202  0.702949   208.118     16.7362     208.118     
1 1 1 14 2  82 o 12 67.2918 4.14164 89.6355     13.6165  79.6654     13.9647  44.1912    233.221     10.1218     233.221     
1 1 1 14 2  83 o 19 22.4868 6.17915 9.92532     10.2475  4.81652     9.8812   3.73032    112.75      1.49446     292.75      
1 1 1 14 2  84 o 3  66.5612 4.4675  81.7246     14.4839  86.0392     14.9644  40.2672    250.037     4.04958     250.037     
1 1 1 14 2  85 o 1  23.0899 6.1316  17.4597     10.9378  -9.6623     12.0779  3.83551    251.852     10.5673     71.8523     
1 1 1 14 2  86 o 17 33.6081 7.45576 17.0569     15.3634  30.0149     13.6886  8.93974    30.9519     17.805      210.952     
1 1 1 14 2  87 o 2  34.0972 7.34644 10.4185     16.7473  35.8909     13.9897  10.266     312.752     15.9587     132.752     
1 1 1 14 2  88 o 15 25.7454 7.59278 -0.220539   15.6398  16.1465     17.5904  5.97331    52.4867     1.57357     52.4867     
1 1 1 14 2  89 o 19 25.3252 7.27277 21.546      15.9594  -14.3339    17.283   8.30481    195.656     2.47974     15.6556     
1 1 1 14 2  90 o 13 22.9984 7.15394 8.84925     16.1018  -4.28863    16.4457  3.63611    184.681     2.63021     4.68099     
1 1 1 14 2  91 o 16 31.6429 9.07228 26.3867     25.3213  22.3373     19.6579  10.5667    164.773     6.5934      344.773     
1 1 1 14 2  92 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 3  0  f 0  440.773 4.70196 3445.19     103.808  3445.19     103.808  190.711    5.65859e-06 0           0           
1 1 1 14 3  1  o 4  733.793 6.76712 9753.25     248.814  9342.82     248.8    528.06     14.2128     4.89859     14.2125     
1 1 1 14 3  2  o 2  1202.54 10.3217 25691.6     622.022  25635.4     622.032  1000.41    329.802     267.203     329.802     
1 1 1 14 3  3  o 14 691.646 6.11557 8484.35     211.969  8476.95     211.977  497.361    159.755     5.47497     159.755     
1 1 1 14 3  4  o 14 389.681 3.88254 2658.98     79.1397  2723.45     72.2536  207.227    14.3741     131.529     194.374     
1 1 1 14 3  5  o 14 978.073 8.71451 16871       427.128  17067.5     427.151  742.009    6.85171     77.1424     6.85171     
1 1 1 14 3  6  o 4  388.041 3.81575 2668.07     74.1976  2668.95     74.2075  239.367    152.398     62.5524     332.398     
1 1 1 14 3  7  o 5  425.622 4.04214 3193.54     86.2114  3227.5      86.2219  304.364    354.866     13.8683     354.866     
1 1 1 14 3  8  o 6  995.226 8.42869 17540.3     411.886  17596.8     428.731  634.759    304.906     162.37      124.906     
1 1 1 14 3  9  o 3  546.599 4.78389 5236.71     131.026  5354.67     131.046  471.139    110.446     171.959     110.446     
1 1 1 14 3  10 o 5  259.444 2.85103 1178.47     37.7898  1207.17     36.3108  104.651    44.4473     141.188     224.447     
1 1 1 14 3  11 o 9  877.8   7.75934 13538.5     368.369  13793       311.353  627.535    64.9874     3.36527     244.988     
1 1 1 14 3  12 o 1  368.993 3.65785 2450.78     64.7176  2375.38     70.3451  246.837    130.767     17.0724     310.767     
1 1 1 14 3  13 o 16 521.758 4.58281 4784.11     124.296  4866.21     115.1    453.281    196.074     174.218     196.074     
1 1 1 14 3  14 o 12 267.221 2.9327  1258.02     40.035   1272.76     38.4865  107.687    144.075     147.824     324.075     
1 1 1 14 3  15 o 11 825.923 7.07799 11904       292.892  12291       292.975  602.476    123.693     25.2942     123.693     
1 1 1 14 3  16 o 13 482.341 4.50543 4099.04     108.888  4148.22     108.921  268.131    142.667     143.919     322.667     
1 1 1 14 3  17 o 6  249.28  3.07902 1094.24     37.5248  1108.17     39.3924  106.937    342.117     117.901     162.117     
1 1 1 14 3  18 o 16 419.044 3.97894 3083.9      80.0154  3140.48     87.0119  367.639    176.225     162.936     176.225     
1 1 1 14 3  19 o 13 750.226 6.60888 9991.87     237.875  9969.02     258.614  602.926    29.3823     142.833     29.3823     
1 1 1 14 3  20 o 15 809.897 7.12076 11734.8     276.604  11531.9     300.69   492.707    308.292     165.702     128.292     
1 1 1 14 3  21 o 12 523.799 4.73259 4952.04     121.668  4775.54     126.621  338.708    169.163     56.1701     349.163     
1 1 1 14 3  22 o 9  575.595 5.1171  5832.09     144.638  5914.74     150.549  549.591    156.227     302.926     156.227     
1 1 1 14 3  23 o 19 767.341 6.61306 10450.7     249.163  10434.3     259.333  464.43     19.9288     156.032     199.929     
1 1 1 14 3  24 o 6  327.745 3.3432  1908.42     53.7908  1899        56.0032  292.42     236.202     180.309     236.202     
1 1 1 14 3  25 o 11 655.309 5.66129 7606.33     182.143  7622.78     189.625  614.745    218.61      316.865     218.61      
1 1 1 14 3  26 o 12 391.945 3.7451  2721.36     72.0534  2724.34     75.0404  314.83     257.825     98.9919     257.825     
1 1 1 14 3  27 o 18 279.614 3.09415 1345.12     42.3934  1426.75     44.3281  211.138    76.6394     61.7723     76.6394     
1 1 1 14 3  28 o 17 391.722 3.78385 2711.09     69.6694  2728.82     78.6476  256.482    41.9719     25.3752     221.972     
1 1 1 14 3  29 o 2  651.26  5.57514 7503.61     174.805  7541.79     188.872  440.328    204.791     32.1405     24.7912     
1 1 1 14 3  30 o 8  617.524 5.31162 6734.97     157.921  6791.94     170.637  536.892    39.4187     212.955     39.4187     
1 1 1 14 3  31 o 14 208.064 2.65459 760.139     25.9191  774.373     29.3623  81.0931    193.736     112.136     13.7362     
1 1 1 14 3  32 o 3  511.265 4.55575 4641.91     112.111  4629.01     121.152  343.27     19.3228     24.335      199.323     
1 1 1 14 3  33 o 17 102.675 2.29002 185.698     11.6677  188.344     11.8695  36.3664    137.001     195.469     137.001     
1 1 1 14 3  34 o 16 503.13  4.58271 4466.96     108.388  4512.96     122.354  405.955    188.875     115.891     188.875     
1 1 1 14 3  35 o 5  490.178 4.38844 4229.66     103.565  4293.94     111.934  346.764    146.321     14.9861     146.321     
1 1 1 14 3  36 o 4  552.209 4.90133 5336.04     127.309  5485.88     143.675  428.523    86.1892     92.7836     86.1892     
1 1 1 14 3  37 o 18 268.198 3.15894 1246.76     37.6126  1304.16     46.9788  194.867    207.107     31.2875     207.107     
1 1 1 14 3  38 o 14 429.679 4.14519 3207.01     81.5798  3344.06     96.5877  278.562    37.3312     33.0499     217.331     
1 1 1 14 3  39 o 14 281.854 3.20605 1386.91     43.1762  1430.57     47.3539  201.953    264.023     26.5109     264.023     
1 1 1 14 3  40 o 8  139.578 2.69405 334.865     15.3637  356.411     21.9093  83.181     299.392     9.27758     299.392     
1 1 1 14 3  41 o 3  377.924 3.88605 2514.9      70.1805  2552.84     76.9107  256.337    81.2361     1.78531     261.236     
1 1 1 14 3  42 o 17 551.235 5.1652  5316.07     136.09   5477.7      149.155  403.876    47.537      52.396      47.5371     
1 1 1 14 3  43 o 8  183.108 2.64185 560.904     22.5803  628.967     25.9209  113.539    292.364     12.0447     112.364     
1 1 1 14 3  44 o 12 201.159 2.64681 699.487     24.3626  735.662     28.9094  107.873    305.262     52.0778     125.262     
1 1 1 14 3  45 o 12 269.827 2.9854  1252.87     37.6693  1330.12     43.0237  154.883    210.106     53.4342     30.1056     
1 1 1 14 3  46 o 5  268.424 2.94948 1258.58     36.2189  1297.26     42.9418  184.398    141.707     9.72033     141.707     
1 1 1 14 3  47 o 12 355.244 3.53804 2175.44     57.5795  2304.04     68.2098  225.633    104.945     27.6124     284.945     
1 1 1 14 3  48 o 9  45.9832 3.1353  37.6236     6.66902  38.0895     7.5746   16.8532    59.5564     63.5703     59.5564     
1 1 1 14 3  49 o 16 233.317 2.86467 930.842     31.0159  1000.85     35.9383  161.643    114.833     16.1445     114.833     
1 1 1 14 3  50 o 12 71.7057 2.76267 93.5278     9.27596  89.4234     10.4373  13.7718    28.2861     40.6436     208.286     
1 1 1 14 3  51 f 0  362.286 3.76609 2293.65     65.2459  2366.87     71.4494  206.343    344.432     0           0           
1 1 1 14 3  52 f 0  433.441 4.25564 3259.91     92.4405  3415.85     92.3984  257.796    86.0909     0           0           
1 1 1 14 3  53 f 0  248.429 3.29851 1098.71     43.2929  1091.94     38.7248  178.873    67.0968     0           0           
1 1 1 14 3  54 o 1  105.385 2.66935 188.557     14.5468  206.158     13.5151  39.6631    217.368     48.3441     37.3682     
1 1 1 14 3  55 o 15 47.4107 3.57675 39.7966     8.66792  40.9446     8.03936  0.129101   48.9484     8.28165     48.9485     
1 1 1 14 3  56 o 12 252.528 3.15561 1142.06     40.992   1122.3      38.8657  147.79     38.0099     35.0879     218.01      
1 1 1 14 3  57 o 5  195.065 2.67788 696.004     26.6614  654.832     25.6961  146.825    224.056     42.5739     224.056     
1 1 1 14 3  58 o 17 192.469 3.09443 652.959     30.3996  662.907     29.274   110.958    353.049     27.3657     173.049     
1 1 1 14 3  59 o 11 29.5562 5.68803 12.2446     9.41446  19.5819     8.25795  11.4148    233.734     37.0581     233.734     
1 1 1 14 3  60 o 9  248.054 3.52426 1093.45     39.6947  1095.66     47.573   150.134    1.74224     21.6388     181.742     
1 1 1 14 3  61 o 15 68.0001 3.03594 73.9465     9.8058   91.5779     10.7707  35.0345    250.105     1.90373     70.1053     
1 1 1 14 3  62 o 3  88.4213 2.9154  152.395     12.138   126.806     13.3918  49.7121    85.2292     6.3287      265.229     
1 1 1 14 3  63 o 18 86.1483 2.95938 122.496     12.3696  142.569     13.0957  35.1727    117.72      34.654      297.72      
1 1 1 14 3  64 o 17 186.825 3.00109 604.492     26.5043  638.537     29.6724  136.985    164.667     36.711      164.667     
1 1 1 14 3  65 o 3  197.546 3.13449 702.745     29.1892  688.349     32.7295  130.72     48.2588     10.372      48.2588     
1 1 1 14 3  66 o 15 61.1286 3.44114 67.8925     9.81224  66.3882     11.0395  32.2306    354.824     14.6579     354.824     
1 1 1 14 3  67 o 19 105.679 2.77313 203.59      14.3744  194.964     14.9247  55.5228    225.348     19.8201     45.3479     
1 1 1 14 3  68 o 4  134.055 2.87386 310.691     19.9591  331.114     18.5197  79.0815    229.976     10.0883     49.9762     
1 1 1 14 3  69 o 18 59.6799 3.51338 74.8004     11.0533  54.4781     9.73445  33.1875    53.8918     4.19694     233.892     
1 1 1 14 3  70 o 2  173.862 2.93275 533.896     25.6405  546.693     25.4602  131.356    111.478     44.7746     111.478     
1 1 1 14 3  71 o 7  62.131  3.33615 72.5883     10.8769  66.7577     9.74512  42.6122    291.18      12.8185     291.18      
1 1 1 14 3  72 o 15 45.757  4.07217 34.9236     9.65078  42.0745     8.30657  21.5649    354.27      8.66375     174.27      
1 1 1 14 3  73 o 9  44.9289 4.0217  39.2073     9.57234  35.0246     8.13111  28.7986    195.821     10.913      195.821     
1 1 1 14 3  74 o 10 38.0973 4.72605 31.5334     9.7013   23.2759     7.72922  16.0407    289.72      9.04872     109.72      
1 1 1 14 3  75 o 16 64.7878 3.24705 82.0969     11.3698  69.9806     9.5943   35.0432    218.279     7.02659     38.279      
1 1 1 14 3  76 o 3  50.0305 4.0897  50.4656     10.8896  41.9345     9.26142  19.8434    267.147     18.7472     87.1467     
1 1 1 14 3  77 o 10 37.5146 4.46518 39.3474     8.76199  15.9148     7.16329  16.6345    13.4388     8.04785     193.439     
1 1 1 14 3  78 o 7  26.0368 6.07316 11.4419     8.74721  13.7837     9.65067  8.51428    17.2367     6.8974      197.237     
1 1 1 14 3  79 o 12 51.3181 4.60598 49.9376     10.7427  49.0425     12.3155  27.5853    50.3373     4.42428     230.337     
1 1 1 14 3  80 o 8  40.0646 5.59058 22.3745     10.1377  41.8262     11.5749  14.8528    64.6353     15.8322     244.635     
1 1 1 14 3  81 o 16 58.6658 4.39322 62.5093     11.8609  66.9792     13.5604  33.11      221.308     2.1214      41.3086     
1 1 1 14 3  82 o 9  53.7049 4.88895 64.7715     11.5525  46.3276     13.2908  31.0564    15.3409     0.598409    15.3409     
1 1 1 14 3  83 o 6  25.8153 6.29897 19.6031     10.472   2.40898     11.347   7.21436    15.2191     8.91862     195.219     
1 1 1 14 3  84 f 0  87.433  4.1147  138.502     16.839   147.812     18.9976  41.0807    32.8666     0           0           
1 1 1 14 3  85 o 5  32.8093 8.06352 18.5656     12.7251  27.9944     19.7535  15.3938    357.707     5.25675     357.707     
1 1 1 14 3  86 o 3  46.2109 7.52567 42.3938     18.0039  49.2314     16.2129  21.5562    194.766     8.18111     14.7663     
1 1 1 14 3  87 o 7  31.9397 7.81144 20.9432     16.8542  22.1644     13.7971  13.3357    88.5842     5.58144     268.584     
1 1 1 14 3  88 f 0  35.429  8.35477 34.8602     17.4615  22.1868     18.0751  23.0516    142.956     0           0           
1 1 1 14 3  89 o 12 22.3422 6.96901 9.42472     15.6086  -10.6611    16.2559  4.40944    305.453     3.85166     125.453     
1 1 1 14 3  90 o 4  69.085  7.83128 115.311     28.5043  103.455     23.7693  49.3212    134.821     23.0525     134.821     
1 1 1 14 3  91 o 3  30.5841 8.79527 12.9754     24.7405  27.4684     19.5728  8.55486    254.484     0.760711    254.484     
1 1 1 14 3  92 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 4  0  o 7  287.548 3.46211 1466.4      49.8571  1466.4      49.8571  202.377    180         11.7605     9.78841e-06 
1 1 1 14 4  1  o 6  1025.1  8.17981 18631       420.21   18645.3     420.215  765.814    205.453     53.6526     205.453     
1 1 1 14 4  2  o 13 470.367 4.07339 3895.21     96.0126  3946.98     96.0208  307.503    23.1348     50.4125     203.135     
1 1 1 14 4  3  o 18 1179.18 9.53779 24621.5     573.94   24722.2     553.07   845.391    31.7345     11.6413     211.734     
1 1 1 14 4  4  o 14 1095.76 8.80066 21280.7     492.129  21319.7     474.235  828.328    175.221     76.3709     175.221     
1 1 1 14 4  5  o 6  1292.14 11.0817 29800.4     747.051  29480.6     687.182  936.375    255.098     6.8423      255.098     
1 1 1 14 4  6  o 19 717.458 6.46646 9113.11     227.394  9139.73     237.511  449.817    35.0033     129.651     215.003     
1 1 1 14 4  7  o 16 491.629 4.6628  4330.57     117.374  4237.56     112.376  309.891    24.4567     77.2898     204.457     
1 1 1 14 4  8  o 18 1704.62 14.8347 51698.1     1239.36  51640.8     1294.52  1192.01    49.5144     78.6191     229.514     
1 1 1 14 4  9  o 2  1041.02 8.95546 19161.4     467.185  19292.5     467.219  764.711    307.098     31.0476     307.097     
1 1 1 14 4  10 f 0  512.289 4.84849 4652.19     116.066  4651.33     132.349  423.233    133.407     0           0           
1 1 1 14 4  11 o 19 610.741 5.73914 6611.92     183.456  6613.35     167.492  385.852    234.799     99.6342     54.7989     
1 1 1 14 4  12 o 3  776.586 6.82667 10760.5     254.287  10627.8     276.463  454.863    334.831     203.368     154.831     
1 1 1 14 4  13 o 10 469.081 4.30207 3868.32     99.0952  3931.57     103.155  276.392    64.1479     109.515     244.148     
1 1 1 14 4  14 o 19 782.578 6.37588 10789.8     254.58   10928       245.37   550.762    13.0006     16.9007     193.001     
1 1 1 14 4  15 o 17 1056.97 8.5361  19787.5     460.39   19852.4     443.728  816.591    256.305     118.574     256.305     
1 1 1 14 4  16 o 4  195.406 2.37177 674.272     23.6317  678.939     22.8095  74.8756    267.922     38.6787     267.922     
1 1 1 14 4  17 o 16 150.972 2.31026 409.895     18.1342  397.91      16.8158  29.6965    205.042     104.654     25.0425     
1 1 1 14 4  18 f 0  206.393 2.66084 774.011     28.6538  735.941     26.3866  196.302    281.766     0           0           
1 1 1 14 4  19 o 8  520.37  4.77241 4870.89     124.426  4729.58     124.463  363.203    197.811     3.13839     17.8106     
1 1 1 14 4  20 o 6  255.703 3.04065 1140.65     37.1374  1176.89     40.7558  139.971    176.659     50.9607     356.659     
1 1 1 14 4  21 o 10 444.968 4.20819 3504.36     93.8121  3514.57     93.8663  331.509    263.075     49.544      263.075     
1 1 1 14 4  22 o 13 691.542 6.09061 8469.52     211.033  8491.46     211.119  537.235    308.656     100.208     308.656     
1 1 1 14 4  23 o 10 418.374 4.11418 3184.86     84.2834  3021.35     88.0506  182.448    89.8917     217.327     269.892     
1 1 1 14 4  24 o 8  996.278 8.60268 17681.1     429.492  17558.2     429.527  825.062    45.4749     238.318     45.4749     
1 1 1 14 4  25 o 16 387.81  3.76486 2705.96     73.1551  2625.88     73.1707  288.893    328.875     47.7327     328.875     
1 1 1 14 4  26 o 19 142.655 2.40676 351.82      17.1681  369.548     17.2377  46.9244    327.151     42.1529     147.151     
1 1 1 14 4  27 o 17 703.135 6.23305 8839.93     219.616  8701.75     219.641  536.065    341.391     82.9739     341.391     
1 1 1 14 4  28 o 4  153.456 2.35343 406.581     18.0425  428.191     18.148   12.1134    144.327     221.569     144.327     
1 1 1 14 4  29 o 3  440.586 4.41483 3508.82     92.829   3375.57     101.723  254.898    39.1617     103.865     219.162     
1 1 1 14 4  30 o 5  341.088 3.47612 2093.64     59.3912  2031.29     59.4347  291.838    231.99      122.422     231.99      
1 1 1 14 4  31 o 12 477.961 4.22883 4034.67     97.2956  4067.03     105.164  324.734    193.957     15.658      13.9567     
1 1 1 14 4  32 o 3  253.071 2.81417 1151.58     34.2248  1118.91     37.0539  220.122    194.924     113.53      194.924     
1 1 1 14 4  33 o 16 305.314 3.04652 1652.08     45.7112  1652.74     47.4989  139.146    49.8531     141.085     229.853     
1 1 1 14 4  34 o 8  198.187 2.50491 689.613     23.8498  702.782     25.8836  158.34     107.633     69.3956     107.633     
1 1 1 14 4  35 o 2  293.922 3.02304 1492.43     42.7656  1571.12     46.2897  231.244    210.989     66.2371     210.989     
1 1 1 14 4  36 o 15 413.56  3.7594  2984.39     74.8512  3082.43     80.9416  234.368    246.285     102.282     66.2851     
1 1 1 14 4  37 o 6  346.644 3.34633 2107.1      55.8265  2154.55     60.3926  282.504    133.552     94.3958     133.552     
1 1 1 14 4  38 o 17 429.852 4.11722 3252.48     88.6532  3303.79     88.7268  331.846    199.05      74.3782     199.05      
1 1 1 14 4  39 o 14 82.3288 2.39746 113.136     8.89202  127.792     10.8431  8.81196    198.465     44.7665     18.4653     
1 1 1 14 4  40 o 1  311.313 3.50935 1719.27     50.6313  1718.64     58.5774  245.091    240.253     70.5176     240.253     
1 1 1 14 4  41 o 19 355.529 3.46653 2217.31     57.9519  2266.8      65.4244  273.749    247.738     64.2967     247.738     
1 1 1 14 4  42 o 4  200.972 2.60494 684.886     24.6164  747.975     27.8594  132.915    232.929     0.552237    232.93      
1 1 1 14 4  43 o 10 376.211 3.74066 2434.84     65.8031  2588.82     75.1712  270.428    42.0346     28.0928     42.0346     
1 1 1 14 4  44 o 9  230.508 2.71383 918.809     29.4169  965.819     33.2456  128.375    133.118     52.5976     313.118     
1 1 1 14 4  45 o 8  371.925 3.61196 2425.4      64.4659  2483.68     70.1195  256.146    39.7256     7.81326     39.7257     
1 1 1 14 4  46 o 13 648.291 5.52582 7344.98     168.519  7602.71     190.205  532.723    290.587     182.756     290.587     
1 1 1 14 4  47 o 15 81.8813 2.43722 125.669     9.07429  112.686     10.7008  29.9017    272.799     18.4076     92.7985     
1 1 1 14 4  48 o 8  58.6556 2.57255 64.429      7.22934  58.1417     7.76497  1.30645    128.187     38.1135     308.187     
1 1 1 14 4  49 o 6  195.202 2.65393 671.986     23.5275  679.542     28.2092  128.921    344.014     3.58066     344.014     
1 1 1 14 4  50 o 11 116.616 2.50234 221.651     14.8767  261.961     14.1939  40.1971    150.412     64.6218     330.412     
1 1 1 14 4  51 o 7  38.1265 3.52489 23.6946     6.28514  28.9153     6.85429  12.5478    228.597     38.4953     228.597     
1 1 1 14 4  52 o 15 329.723 3.55737 1910.95     60.1151  1949.05     57.384   255.266    298.273     73.4107     298.273     
1 1 1 14 4  53 o 7  173.381 2.7082  525.733     22.8924  540.828     24.167   130.927    357.853     42.1621     357.853     
1 1 1 14 4  54 o 6  236.721 3.37162 1019.29     38.645   970.732     41.2274  200.839    133.324     94.952      133.324     
1 1 1 14 4  55 o 5  52.2883 3.30359 54.599      8.5111   43.5799     8.52344  15.5929    60.735      85.9642     60.735      
1 1 1 14 4  56 o 1  341.549 3.66475 2068.8      58.0954  2077.25     67.0539  237.91     216.006     25.4191     216.006     
1 1 1 14 4  57 o 1  242.086 3.06839 1060.41     37.2749  1021.3      37.168   167.464    8.8719      18.6043     8.87191     
1 1 1 14 4  58 o 2  123.265 2.61208 297.678     16.2452  243.605     15.8995  53.7373    248.932     49.101      68.9316     
1 1 1 14 4  59 f 0  93.3986 2.6277  146.334     13.1913  164.2       11.113   56.7514    18.1661     0           0           
1 1 1 14 4  60 f 0  86.1522 2.78673 140.958     12.2994  123.605     11.6928  42.1971    338.783     0           0           
1 1 1 14 4  61 o 19 151.428 2.75542 446.281     20.5365  370.783     21.0701  75.3667    158.162     42.9347     338.162     
1 1 1 14 4  62 o 11 168.602 2.92964 539.756     24.7182  472.91      24.6857  119.462    62.7433     24.1644     62.7433     
1 1 1 14 4  63 o 9  57.1271 3.7127  61.0127     10.2637  56.4556     10.7164  15.2179    44.9529     33.8315     224.953     
1 1 1 14 4  64 o 7  118.409 3.03042 240.771     17.3541  259.554     18.5575  84.071     51.4179     22.0085     51.4179     
1 1 1 14 4  65 o 11 75.5698 3.41075 109.82      12.8197  95.1454     12.8248  42.2245    245.079     3.138       65.0792     
1 1 1 14 4  66 o 15 61.336  3.53963 64.5716     11.127   70.8627     10.3689  32.7346    327.154     2.06389     147.154     
1 1 1 14 4  67 o 8  129.522 2.84943 303.832     18.5101  295.016     18.4335  81.6227    70.8445     0.726117    70.8446     
1 1 1 14 4  68 o 2  54.6616 3.76946 54.2055     10.0183  53.9528     10.3665  33.6435    292.968     4.58316     292.968     
1 1 1 14 4  69 o 14 51.0437 3.83233 42.2494     9.83616  52.6923     9.27022  30.1948    349.762     2.613       349.762     
1 1 1 14 4  70 o 7  81.5335 3.01783 122.51      12.1872  116.079     12.3753  44.2592    350.204     11.6016     170.204     
1 1 1 14 4  71 f 0  42.1029 3.93614 35.6997     8.03422  29.4843     8.0895   30.5316    17.9714     0           0           
1 1 1 14 4  72 o 3  104.953 2.77768 204.912     14.4587  190.09      14.6831  69.0444    206.475     8.77984     206.475     
1 1 1 14 4  73 o 16 74.5809 2.9733  109.863     11.0608  90.763      10.9994  26.554     333.118     37.9657     153.118     
1 1 1 14 4  74 o 10 15.689  4.59292 4.75397     6.65369  -3.53334    5.66492  4.89694    359.891     17.757      359.891     
1 1 1 14 4  75 o 12 16.8421 4.78119 5.97098     6.91576  -1.66824    5.84814  3.84261    295.234     17.4873     295.234     
1 1 1 14 4  76 o 11 162.567 2.96595 489.684     24.2249  461.602     24.05    120.833    68.0633     42.1991     68.0633     
1 1 1 14 4  77 o 9  52.8264 3.73816 54.4473     10.4439  48.0639     9.09111  33.9377    297.389     6.69478     297.389     
1 1 1 14 4  78 o 18 95.6302 2.85037 172.67      13.8133  157.646     13.4386  63.2689    145.134     11.0865     145.134     
1 1 1 14 4  79 o 10 55.5441 3.92585 55.0979     11.0642  59.2084     10.4445  32.0772    358.489     0.885005    178.489     
1 1 1 14 4  80 o 13 64.3447 5.15924 62.7843     16.118   97.0625     15.5892  46.3832    186.424     17.834      186.424     
1 1 1 14 4  81 o 13 41.2089 5.5276  31.65       10.383   35.3856     11.6195  28.0443    215.054     13.0882     215.054     
1 1 1 14 4  82 o 6  78.9276 4.40198 110.062     15.5778  124.731     18.9426  46.6535    222.95      0.3017      222.949     
1 1 1 14 4  83 o 1  28.8252 6.72678 16.7558     10.99    16.7448     11.5762  7.58295    198.591     13.6344     18.591      
1 1 1 14 4  84 o 13 28.4196 6.59555 21.1626     11.1196  10.7933     11.2525  9.00225    61.6233     1.90612     61.6233     
1 1 1 14 4  85 o 7  24.9419 7.00634 4.48244     14.5155  12.7332     12.3228  4.45372    191.96      14.8074     11.9599     
1 1 1 14 4  86 o 15 31.2615 6.93338 -0.41259    16.0919  33.5289     13.3851  16.1722    338.093     7.3476      338.093     
1 1 1 14 4  87 o 15 20.8222 6.53173 -3.19234    15.049   1.65563     12.3059  1.5808     72.5785     23.1877     72.5785     
1 1 1 14 4  88 o 1  24.175  7.16123 4.55985     16.317   9.22888     13.1961  6.89452    280.9       6.13927     100.9       
1 1 1 14 4  89 o 5  35.6369 8.61193 35.1616     17.9307  27.0074     19.5693  18.2707    359.126     4.19186     359.126     
1 1 1 14 4  90 f 0  35.327  9.30664 60.2009     27.3841  7.57977     19.8254  20.6852    329.75      0           0           
1 1 1 14 4  91 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 5  0  o 3  846.474 7.0581  12705.9     299.313  12705.9     299.313  428.976    4.91591e-06 370.311     180         
1 1 1 14 5  1  o 5  852.002 6.92319 12910.2     301.037  12833.9     290.096  663.597    66.2917     100.76      66.2918     
1 1 1 14 5  2  o 19 674.624 5.54419 8039.9      187.433  8096.12     187.444  394.326    197.277     180.558     17.2767     
1 1 1 14 5  3  o 5  450.099 3.99498 3591.96     90.1098  3588.94     90.114   314.029    188.967     7.69419     8.96675     
1 1 1 14 5  4  o 9  237.469 2.68801 1000.52     31.985   998.017     31.9925  177.547    69.178      114.226     69.178      
1 1 1 14 5  5  o 14 313.674 3.08758 1760.35     49.4305  1726.91     47.6374  139.68     82.354      156.891     262.354     
1 1 1 14 5  6  o 11 550.894 4.89747 5393.44     132.467  5365.32     137.878  337.968    180.313     110.42      0.312898    
1 1 1 14 5  7  o 3  485.305 4.44544 4169.57     108.111  4179.22     108.121  395.014    225.888     106.034     225.888     
1 1 1 14 5  8  f 0  316.016 3.12169 1759.15     49.4307  1780.35     49.4436  261.965    225.288     0           0           
1 1 1 14 5  9  o 17 297.599 3.1337  1601.06     45.766   1538.21     47.6354  236.318    233.966     79.2905     233.966     
1 1 1 14 5  10 o 13 840.55  7.46836 12443       307.7    12618.4     321.421  570.679    233.232     65.9547     53.2322     
1 1 1 14 5  11 f 0  1252.19 11.4063 27901.3     732.613  27790.2     698.587  971.78     147.409     0           0           
1 1 1 14 5  12 o 12 831.571 7.56314 12263       329.187  12266.7     300.518  477.228    227.992     239.167     47.9922     
1 1 1 14 5  13 o 9  233.856 2.83201 961.55      30.9664  976.713     35.3035  89.9402    127.105     64.3052     127.105     
1 1 1 14 5  14 o 8  836.548 7.1315  12483.1     292.88   12339.5     304.868  579.598    234.559     38.2539     54.5588     
1 1 1 14 5  15 o 16 758.337 6.63162 10246.7     252.011  10149.2     252.033  509.494    48.7803     63.751      228.78      
1 1 1 14 5  16 f 0  484.481 4.42866 4222.71     105.304  4098.64     109.62   376.867    35.2017     0           0           
1 1 1 14 5  17 o 15 650.263 5.54563 7571.9      180.701  7421.84     180.72   375.69     294.626     172.939     114.626     
1 1 1 14 5  18 o 5  274.547 2.92279 1353.15     40.1988  1318.49     40.2235  221.212    324.323     126.567     324.323     
1 1 1 14 5  19 o 3  1033.59 8.34727 19022       424.223  18893.4     440.303  729.054    9.09616     17.8184     189.096     
1 1 1 14 5  20 o 8  688.114 5.8394  8424.84     201.346  8367.51     201.387  504.771    199.565     35.9143     199.565     
1 1 1 14 5  21 o 10 1375.92 11.2002 33660       772.217  33631.4     772.362  1028.65    100.994     91.5565     100.994     
1 1 1 14 5  22 o 6  323.933 3.30459 1931.11     52.4733  1789.69     54.6544  213.98     107.921     9.36041     287.921     
1 1 1 14 5  23 o 8  462.919 4.36494 3879.31     96.8258  3719.25     105.307  286.479    297.426     73.9558     117.426     
1 1 1 14 5  24 o 3  514.882 4.63668 4764.4      117.159  4636.21     121.989  402.97     212.555     86.5277     212.555     
1 1 1 14 5  25 o 5  421.97  4.0024  3105.19     81.0357  3208.13     88.1877  290.796    91.6138     4.51088     271.614     
1 1 1 14 5  26 o 9  605.742 5.43749 6537.31     165.023  6478.26     165.098  606.593    69.113      368.198     69.113      
1 1 1 14 5  27 o 9  650.882 5.68961 7460.81     189.191  7569.81     181.848  414.666    127.204     88.7035     307.204     
1 1 1 14 5  28 o 13 144.672 2.3838  379.716     17.5834  362.237     16.984   19.1261    195.577     225.407     195.577     
1 1 1 14 5  29 o 3  364.424 3.66738 2348.09     66.9627  2360.74     66.9903  288.55     67.3469     76.6429     67.3469     
1 1 1 14 5  30 o 6  388.835 3.79519 2643.55     73.9241  2717.96     73.9731  310.326    32.4198     84.4814     32.4197     
1 1 1 14 5  31 o 9  601.153 5.37729 6405.79     161.975  6418.87     162.021  384.716    50.9945     73.5388     230.994     
1 1 1 14 5  32 o 7  473.605 4.42953 3989.93     105.11   3966.96     105.153  330.594    311.251     1.46947     311.251     
1 1 1 14 5  33 o 12 408.016 4.03632 2941.94     76.9351  2963.07     87.8078  298.771    319.83      32.7847     319.83      
1 1 1 14 5  34 o 17 71.0505 2.49295 90.6722     8.31539  88.7317     9.33912  15.4303    143.299     89.4135     143.299     
1 1 1 14 5  35 o 6  386.013 3.89419 2648.67     73.6232  2637.05     76.9954  303.257    112.229     76.1565     112.229     
1 1 1 14 5  36 f 0  300.034 3.14687 1585.9      46.3031  1606.45     48.3194  76.1233    348.689     0           0           
1 1 1 14 5  37 o 14 335.816 3.36517 1987.91     55.437   2011.9      57.8164  237.99     1.59203     17.9467     1.59204     
1 1 1 14 5  38 o 15 334.63  3.50972 1963.42     60.0471  2008.78     57.6076  159.709    36.1519     139.405     216.152     
1 1 1 14 5  39 o 6  331.192 3.66836 1941.34     56.2957  1950.11     65.1695  261.044    39.5326     72.3066     39.5326     
1 1 1 14 5  40 f 0  255.972 2.9222  1129.94     37.3815  1194.13     37.5728  160.523    100.425     0           0           
1 1 1 14 5  41 o 3  205.099 2.6117  739.939     26.2067  751.703     27.4751  174.89     198.6       83.1994     198.6       
1 1 1 14 5  42 o 1  77.5659 2.43592 90.3092     9.16764  124.839     9.5982   26.7695    192.091     11.1225     12.0912     
1 1 1 14 5  43 o 12 529.834 4.78504 4784.46     121.651  5191.9      132.508  412.729    298.986     99.2374     298.986     
1 1 1 14 5  44 o 7  377.793 3.83972 2437.26     72.5754  2630.64     72.7446  275.117    346.431     36.2418     346.431     
1 1 1 14 5  45 o 4  422.75  4.44013 3072.27     84.3174  3277.27     103.386  270.712    167.99      34.1837     347.99      
1 1 1 14 5  46 o 10 353.067 3.62876 2142.3      62.7913  2283.32     65.6309  210.593    121.907     56.9832     301.907     
1 1 1 14 5  47 o 10 146.409 2.45695 376.432     18.0075  383.776     18.0459  103.396    233.976     24.5267     233.976     
1 1 1 14 5  48 o 5  220.156 2.91883 808.29      32.8411  912.795     31.3697  182.725    181.912     78.4669     181.912     
1 1 1 14 5  49 o 8  192.008 2.64245 632.569     25.3579  675.484     25.4784  126.857    256.877     3.60924     256.877     
1 1 1 14 5  50 o 4  210.538 2.64811 751.053     27.849   822.091     27.9946  160.793    17.1794     47.666      17.1794     
1 1 1 14 5  51 o 16 196.831 2.58518 651.535     24.3551  723.687     26.6617  129.073    218.871     1.78634     218.871     
1 1 1 14 5  52 o 17 215.951 2.72742 794.825     29.4237  860.368     29.581   164.297    144.026     47.5655     144.026     
1 1 1 14 5  53 o 9  150.164 2.38267 396.772     17.9155  403.1       17.9448  112.825    238.011     38.7589     238.011     
1 1 1 14 5  54 o 8  81.5576 2.7539  127.345     11.0731  109.583     11.3047  17.4448    41.4689     61.7769     221.469     
1 1 1 14 5  55 o 16 191.584 2.78505 628.137     26.715   675.146     26.7385  141.168    200.166     34.2307     200.166     
1 1 1 14 5  56 o 4  321.158 3.39125 1825.05     53.3998  1840.03     55.7449  268.558    103.629     114.2       103.629     
1 1 1 14 5  57 o 7  91.9507 2.59843 139.694     11.6957  161.334     12.1865  32.7749    281.097     48.2235     101.097     
1 1 1 14 5  58 o 6  162.924 2.59544 483.856     20.4057  458.893     21.8992  103.085    196.672     3.50273     16.6719     
1 1 1 14 5  59 o 13 81.9579 3.24169 115.902     14.1202  123.79      12.2569  47.2312    170.348     0.765397    350.348     
1 1 1 14 5  60 o 3  86.2905 2.90293 138.919     13.6951  126.542     11.3152  29.8052    353.232     46.5864     173.232     
1 1 1 14 5  61 o 6  30.5474 5.13206 17.7908     8.65668  16.9408     6.83522  20.0943    50.1366     67.5612     50.1366     
1 1 1 14 5  62 o 15 182.711 2.88533 635.518     29.0645  553.814     23.7778  123.334    216.069     12.3497     216.07      
1 1 1 14 5  63 o 11 167.957 3.05523 527.669     27.6166  478.249     23.7878  126.825    256.17      40.3795     256.17      
1 1 1 14 5  64 o 9  142.47  2.89281 366.883     21.4814  356.837     19.7684  124.015    221.342     71.7588     221.342     
1 1 1 14 5  65 o 16 106.876 3.17317 195.562     15.9212  212.918     17.9952  71.4934    349.084     11.5437     349.084     
1 1 1 14 5  66 o 9  39.541  5.60668 32.6756     9.35208  25.8975     11.9299  9.79422    35.5824     0.577787    215.583     
1 1 1 14 5  67 o 11 74.8119 3.24592 98.7895     10.5435  102.051     13.5261  21.9999    293.7       48.8826     113.7       
1 1 1 14 5  68 o 11 85.9478 3.28485 125.4       12.6095  140.008     15.5541  56.1587    59.5644     6.34578     59.5644     
1 1 1 14 5  69 o 12 97.5342 3.04232 171.334     13.3735  169.726     16.1418  56.6257    176.761     8.09175     356.761     
1 1 1 14 5  70 o 15 39.7326 4.19616 27.7971     7.98231  30.5055     8.21214  20.6337    141.663     0.445306    141.662     
1 1 1 14 5  71 o 16 56.6748 3.24514 64.1866     9.28837  52.222      8.9405   34.5999    50.9156     2.778       50.9156     
1 1 1 14 5  72 o 1  87.0643 2.8087  140.958     12.3489  131.234     12.092   55.5766    78.6263     4.58805     78.6263     
1 1 1 14 5  73 o 6  40.2885 4.32136 27.6109     8.84696  32.797      7.87697  16.8752    138.156     11.3069     318.156     
1 1 1 14 5  74 o 5  30.9094 5.0587  16.8037     7.86229  19.7089     7.52038  2.33076    192.449     39.2417     192.449     
1 1 1 14 5  75 o 17 72.0323 3.11712 103.43      11.1602  84.5303     11.1444  44.7942    205.226     3.05312     205.226     
1 1 1 14 5  76 o 18 43.0917 4.21416 41.6283     8.85282  28.0632     8.59896  25.3725    192.829     2.44624     192.829     
1 1 1 14 5  77 f 0  69.826  3.23564 86.7523     11.3111  90.417      11.202   38.2639    85.0772     0           0           
1 1 1 14 5  78 o 11 94.3533 2.96948 173.79      13.9807  149.047     13.9656  60.2204    297.375     6.36087     297.375     
1 1 1 14 5  79 o 4  92.4076 3.14196 155.055     14.0989  155.704     14.9053  55.5504    153.052     0.236613    333.052     
1 1 1 14 5  80 o 2  62.4678 4.15376 65.3999     12.1987  80.9042     13.4942  41.2902    16.1324     9.4516      16.1324     
1 1 1 14 5  81 o 12 24.5936 6.20052 9.76798     9.10037  12.3216     10.1796  7.37433    12.0395     0.44931     192.039     
1 1 1 14 5  82 o 14 41.2545 5.6681  30.112      10.4276  37.9776     12.1946  22.344     92.5708     0.287047    272.571     
1 1 1 14 5  83 o 8  64.2127 4.8448  72.2022     14.1796  86.4416     16.5479  36.2635    322.08      1.6714      142.08      
1 1 1 14 5  84 o 10 40.3079 6.65163 23.6904     12.3477  45.3521     14.4889  21.6073    0.411204    0.280967    0.4112      
1 1 1 14 5  85 o 16 31.7963 7.6508  23.0548     15.2452  19.4654     13.9221  13.0215    31.9703     6.38729     211.97      
1 1 1 14 5  86 o 2  24.7727 7.41524 6.55499     15.828   6.31541     15.9687  4.20035    238.598     15.9042     58.598      
1 1 1 14 5  87 f 0  20.2487 6.56719 1.2341      15.4407  -14.6762    15.4256  16.433     99.41       0           0           
1 1 1 14 5  88 o 3  27.9601 7.96147 18.3433     16.9725  10.4412     17.6312  8.20618    340.108     2.27782     340.108     
1 1 1 14 5  89 o 1  20.5278 6.71439 -15.563     15.9364  2.83523     17.084   1.29634    131.652     3.13467     311.652     
1 1 1 14 5  90 o 7  41.5404 9.44438 63.6536     24.2666  32.5095     22.0805  21.8957    82.1385     4.25032     82.1385     
1 1 1 14 5  91 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 6  0  o 8  418.79  4.01936 3109.64     84.3204  3109.64     84.3204  245.358    180         117.486     1.01033e-05 
1 1 1 14 6  1  o 11 283.879 3.14278 1417.75     43.7271  1438.47     45.6844  171.792    304.407     40.9398     124.407     
1 1 1 14 6  2  o 9  936.288 8.07158 15471.1     378.72   15629.6     378.73   548.826    343.963     254.81      163.963     
1 1 1 14 6  3  o 13 590.134 5.33353 6158.48     151.032  6188.68     164.193  379.834    319.559     84.7445     139.559     
1 1 1 14 6  4  o 19 344.157 3.43758 2092.75     55.6376  2105.33     62.7468  111.597    54.8621     260.716     234.862     
1 1 1 14 6  5  o 9  689.89  5.85689 8423.45     194.566  8452.67     210.144  456.278    348.802     77.7659     168.802     
1 1 1 14 6  6  o 6  755.107 6.62724 10182.6     250.792  10038.9     250.768  490.587    304.405     104.513     124.405     
1 1 1 14 6  7  o 2  573.991 5.22288 5749.44     137.311  5932.09     162.471  326.143    199.739     168.206     19.7393     
1 1 1 14 6  8  o 4  311.26  3.14901 1691.76     47.2145  1742.2      51.0002  121.678    185.165     188.324     5.16495     
1 1 1 14 6  9  o 11 412.694 3.82795 3005.47     76.0756  3031.57     82.1703  376.827    60.7664     188.401     60.7664     
1 1 1 14 6  10 o 14 301.425 3.08849 1604.52     44.8278  1615.7      48.4225  262.455    257.618     143.557     257.618     
1 1 1 14 6  11 o 15 996.256 8.93251 17358.6     425.433  17869.3     466.095  713.442    29.8219     6.53227     209.822     
1 1 1 14 6  12 o 1  806.383 7.88917 11428.8     310.355  11642.8     327.18   424.849    81.8026     308.19      261.803     
1 1 1 14 6  13 o 11 772.758 7.02031 10529.6     271.869  10652.7     271.863  633.065    174.483     162.645     174.483     
1 1 1 14 6  14 o 3  845.509 7.54097 12668.7     297.959  12694.3     339.759  604.686    80.6359     1.24498     260.636     
1 1 1 14 6  15 o 12 1100.08 9.40965 21507.5     496.622  21458.9     539.921  779.32     228.309     20.8774     48.3093     
1 1 1 14 6  16 o 17 468.144 4.46755 3870.44     102.513  3899.16     107.076  413.434    250.309     180.967     250.309     
1 1 1 14 6  17 o 1  722.245 6.35876 9245.37     220.349  9256.73     239.567  530.78     157.981     34.2726     157.981     
1 1 1 14 6  18 o 11 559.998 5.08267 5546.32     136.572  5573.29     148.485  424.759    133.14      60.8262     133.14      
1 1 1 14 6  19 o 11 649.686 5.76099 7567.05     179.49   7403.17     195.132  532.48     159.18      146.281     159.18      
1 1 1 14 6  20 o 11 604.302 5.25702 6432.24     155.973  6518        162.407  484.165    302.111     115.692     302.111     
1 1 1 14 6  21 o 18 466.703 4.19237 3879.44     98.0371  3842.82     98.0672  314.499    221.192     24.9115     41.1918     
1 1 1 14 6  22 o 16 556.09  4.95005 5501.88     140.675  5464.32     135.183  386.427    194.434     11.595      14.4335     
1 1 1 14 6  23 o 4  418.704 3.95646 3139.91     84.6669  3075.81     81.3645  345.481    320.439     111.422     320.439     
1 1 1 14 6  24 o 11 264.51  2.94453 1272.02     39.7956  1208.43     38.2728  134.229    246.726     90.6323     66.7262     
1 1 1 14 6  25 o 5  1013.76 8.44672 18206.8     420.394  18307.7     437.723  710.465    259.076     20.8744     79.076      
1 1 1 14 6  26 o 13 324.717 3.25492 1825.32     51.8683  1913.19     54.0726  260.19     134.251     77.7769     134.251     
1 1 1 14 6  27 o 3  261.206 2.89855 1213.62     37.1227  1205        38.7387  178.806    318.456     6.19426     318.456     
1 1 1 14 6  28 o 11 161.126 2.41373 466.614     19.0367  453.652     19.9181  33.1439    128.393     143.659     308.393     
1 1 1 14 6  29 o 11 341.788 3.40498 2064.62     54.6821  2077.36     61.7673  221.12     279.769     30.6247     99.769      
1 1 1 14 6  30 o 18 472.689 4.27234 3941.03     99.1386  3984.38     103.249  317.157    269.37      27.1098     89.3697     
1 1 1 14 6  31 o 12 498.304 4.41063 4405.85     110.126  4403.02     110.159  389.768    248.755     83.327      248.755     
1 1 1 14 6  32 o 13 749.832 6.261   9918.65     235.232  10054       235.302  520.613    106.946     12.5441     286.946     
1 1 1 14 6  33 o 4  507.122 4.49318 4559.44     114.173  4566.05     114.206  365.06     175.521     22.8673     175.521     
1 1 1 14 6  34 o 7  123.015 2.28932 264.294     14.0596  272.557     14.1409  60.8525    208.122     10.5662     28.1222     
1 1 1 14 6  35 o 15 294.759 2.94595 1554.19     42.608   1526.71     44.3883  225.606    197.291     51.7016     197.291     
1 1 1 14 6  36 o 3  185.556 2.51958 614.26      21.8831  606.483     24.8614  83.8284    230.371     76.8566     50.3711     
1 1 1 14 6  37 o 12 154.997 2.61514 451.364     19.2001  401.462     21.187   85.3874    351.949     24.6954     171.949     
1 1 1 14 6  38 o 13 537.118 4.92721 5113.96     121.052  5131.13     143.296  460.805    218.116     179.151     218.116     
1 1 1 14 6  39 o 3  215.344 2.63794 800.124     27.1957  844.518     29.7369  140.19     207.866     7.49485     27.8661     
1 1 1 14 6  40 o 8  103.463 2.57239 197.358     12.1966  182.822     14.2604  36.4642    94.3938     52.726      274.394     
1 1 1 14 6  41 o 8  281.548 3.1163  1384.2      41.0059  1427.78     46.8223  229.221    310.384     76.961      310.384     
1 1 1 14 6  42 o 16 260.45  3.07022 1166.18     36.2807  1240.65     43.7204  198.612    36.8495     45.8191     36.8495     
1 1 1 14 6  43 o 17 323.626 3.76008 1784.75     56.004   1934.09     65.8815  226.648    167.724     13.0313     167.724     
1 1 1 14 6  44 o 13 271.025 3.26051 1280.67     40.9591  1325.8      47.4729  122.577    37.3094     122.425     217.309     
1 1 1 14 6  45 o 16 246.878 2.90213 1070.3      34.9912  1091.81     36.812   146.922    328.634     37.8582     148.634     
1 1 1 14 6  46 o 11 195.413 2.51579 658.847     24.0071  695.69      25.2714  116.792    158.538     24.5931     338.538     
1 1 1 14 6  47 o 5  460.843 4.12884 3619.19     93.3326  3927.16     97.3796  361.458    17.7098     98.2519     17.7098     
1 1 1 14 6  48 o 13 239.957 2.76551 992.252     32.4566  1050.76     34.0614  192.68     359.198     68.8893     359.198     
1 1 1 14 6  49 o 16 163.031 2.47394 461.375     20.102   481.428     20.32    78.2626    119.951     55.5825     299.951     
1 1 1 14 6  50 o 13 97.4761 2.54828 157.149     11.0632  180.756     13.7852  17.2817    18.7831     85.4433     198.783     
1 1 1 14 6  51 o 10 84.9576 2.4867  120.036     10.3838  136.701     10.7307  28.7398    207.692     38.9004     27.6919     
1 1 1 14 6  52 o 2  94.2479 2.51851 157.403     11.4732  158.165     12.263   12.2616    167.281     91.9032     347.281     
1 1 1 14 6  53 o 3  102.023 2.53601 183.55      12.8455  186.218     13.0467  46.3033    16.375      31.9545     196.375     
1 1 1 14 6  54 o 10 316.294 3.46108 1736.84     56.0549  1817.98     53.5596  261.536    4.50945     104.483     4.50945     
1 1 1 14 6  55 o 4  58.3569 3.39264 57.6357     10.0998  64.2792     9.49654  11.6693    71.7881     39.057      251.788     
1 1 1 14 6  56 o 5  172.708 2.79839 532.601     24.829   526.639     23.6024  118.232    229.733     12.6473     229.733     
1 1 1 14 6  57 o 6  86.4238 2.81864 124.72      12.5244  141.424     11.7218  32.1631    69.3046     41.8233     249.305     
1 1 1 14 6  58 o 12 82.5286 2.8367  111.939     12.3199  131.021     10.8489  32.1761    320.355     36.0516     140.355     
1 1 1 14 6  59 o 7  65.8194 4.43387 91.8315     15.4938  65.3459     13.3579  34.1606    339.24      13.9159     339.24      
1 1 1 14 6  60 o 13 93.6888 3.45786 162.025     19.2941  151.564     12.5291  30.9451    287.437     55.4094     107.437     
1 1 1 14 6  61 o 2  123.64  2.80862 283.271     17.7784  261.316     16.9831  95.5452    210.063     36.9989     210.063     
1 1 1 14 6  62 o 12 26.0199 5.19965 5.66831     8.61076  17.5425     6.79572  15.7232    186.228     49.8502     186.228     
1 1 1 14 6  63 o 5  228.447 3.07548 915.471     36.1655  944.952     34.1862  179.629    174.028     65.7393     174.028     
1 1 1 14 6  64 o 5  30.6422 4.89941 13.8408     8.20738  21.1425     6.59807  7.08214    110.997     37.8837     110.997     
1 1 1 14 6  65 f 0  51.4942 3.28886 50.8018     8.87648  44.7729     7.92326  39.4219    137.638     0           0           
1 1 1 14 6  66 o 4  61.3261 3.17874 74.1942     9.9856   61.213      9.39458  30.1746    140.143     13.0765     320.143     
1 1 1 14 6  67 o 7  96.6368 2.32309 191.286     11.9418  143.399     10.5113  56.6323    128.774     7.79667     308.774     
1 1 1 14 6  68 o 14 74.8535 2.52765 112.175     9.36668  88.8177     9.43259  51.8269    265.979     12.5957     265.979     
1 1 1 14 6  69 o 2  67.4466 3.22247 84.716      10.1265  79.1775     11.4272  34.289     78.3843     13.707      258.384     
1 1 1 14 6  70 o 7  89.933  3.00892 149.182     13.1028  141.418     13.8993  53.0013    137.945     5.30816     317.945     
1 1 1 14 6  71 o 14 49.093  3.92426 44.6187     9.00692  43.6258     9.92037  17.0878    336.309     24.0291     156.309     
1 1 1 14 6  72 o 10 17.2551 4.91799 4.32013     6.7765   0.822488    6.41649  16.1702    83.2461     48.7104     83.2461     
1 1 1 14 6  73 o 6  85.2547 3.07503 131.948     12.5539  129.999     13.6032  56.6074    155.667     9.2227      155.667     
1 1 1 14 6  74 o 6  81.7815 3.22696 122.785     12.0203  118.973     14.1862  49.3534    242.687     0.847791    62.6869     
1 1 1 14 6  75 o 12 75.9035 3.65223 103.296     11.6954  106.558     15.6568  62.282     310.565     34.2927     310.565     
1 1 1 14 6  76 f 0  50.2681 4.1695  38.7512     9.46135  55.7402     11.1046  16.1121    87.6124     0           0           
1 1 1 14 6  77 o 14 23.7494 5.33435 0.546993    7.65682  18.3589     8.56141  4.93494    307.734     13.2464     127.734     
1 1 1 14 6  78 o 7  20.4696 4.97874 14.4736     7.67327  -5.76568    7.45698  3.86375    62.4713     2.86        242.471     
1 1 1 14 6  79 o 19 20.2733 5.56602 6.47792     8.49202  4.97773     7.69653  3.65614    334.562     6.97413     154.562     
1 1 1 14 6  80 o 17 63.5975 4.22417 63.8525     11.9767  89.0195     14.6662  44.0685    228.037     13.7616     228.037     
1 1 1 14 6  81 o 2  65.6409 4.4817  77.7625     12.6122  85.4542     16.3609  35.8048    74.7967     5.59438     254.797     
1 1 1 14 6  82 o 18 21.6604 6.05269 -3.87119    8.70757  14.8323     11.9502  3.54184    253.945     5.99994     73.9447     
1 1 1 14 6  83 o 15 18.228  5.62956 -3.63139    8.74007  3.45089     10.7448  1.04899    335.944     14.7549     335.944     
1 1 1 14 6  84 o 3  33.7713 7.12839 19.1273     14.4032  28.6136     12.3131  13.6564    171.539     8.23084     351.539     
1 1 1 14 6  85 o 4  26.412  6.80548 7.66197     12.2201  17.558      11.83    10.5357    337.39      2.44933     157.39      
1 1 1 14 6  86 o 9  29.0351 7.55004 26.106      16.1749  7.29797     13.7137  13.3003    51.6918     3.79328     51.6918     
1 1 1 14 6  87 o 8  66.3111 5.96311 93.3343     20.8684  86.4202     17.791   49.7731    125.579     25.0013     125.579     
1 1 1 14 6  88 o 14 23.9363 7.2317  3.40151     17.7505  9.1095      13.5212  4.55332    288.673     1.64829     108.673     
1 1 1 14 6  89 o 10 29.1747 7.96827 29.3273     17.4026  5.0679      18.145   9.71       319.444     3.41685     139.444     
1 1 1 14 6  90 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 7  0  o 14 449.149 4.23835 3576.88     95.3616  3576.88     95.3616  327.488    5.60986e-06 2.07904     5.60985e-06 
1 1 1 14 7  1  o 17 538.612 5.03441 5160.27     132.893  5124.94     138.8    577.303    148.171     408.865     148.171     
1 1 1 14 7  2  o 1  151.751 2.48293 395.746     19.2605  420.575     18.4582  48.3799    66.8116     30.9141     246.812     
1 1 1 14 7  3  o 8  688.473 6.06991 8387.07     209.422  8421.6      209.428  391.297    0.531279    207.636     180.531     
1 1 1 14 7  4  o 2  1030.16 8.82027 18895.9     455.35   18767.9     455.35   806.861    81.4716     126.023     81.4716     
1 1 1 14 7  5  o 9  336.203 3.41408 2018.29     57.5262  1988.13     57.5162  250.186    177.8       42.8963     177.8       
1 1 1 14 7  6  o 10 318.804 3.39531 1812.19     55.4199  1790.26     53.0584  226.682    90.3277     21.9973     90.3277     
1 1 1 14 7  7  o 8  811.406 7.36775 11741.5     299.595  11614.9     299.587  641.588    239.731     117.36      239.731     
1 1 1 14 7  8  o 14 487.892 4.62277 4227.23     110.536  4211.65     115.457  380.511    205.701     74.052      205.701     
1 1 1 14 7  9  o 18 121.938 2.28109 268.643     13.643   258.722     14.1914  60.7467    156.954     261.632     156.954     
1 1 1 14 7  10 o 8  200.229 2.57255 736.708     25.2612  684.664     26.2923  113.33     0.116386    14.4012     0.116386    
1 1 1 14 7  11 o 5  103.34  2.34828 193.579     11.8746  185.328     12.3947  11.639     181.738     72.7091     181.738     
1 1 1 14 7  12 o 18 398.025 3.92123 2731.57     76.4995  2885.35     79.9441  262.16     42.5187     28.7241     222.519     
1 1 1 14 7  13 o 1  850.248 7.48668 12807.8     325.848  12842.8     311.989  567.064    359.615     85.8338     179.615     
1 1 1 14 7  14 o 9  253.185 2.99906 1137.44     35.4883  1134.59     40.4485  148.65     206.512     30.8708     26.5122     
1 1 1 14 7  15 o 6  348.861 3.46205 2142.57     59.3117  2171.46     61.7315  224.843    308.011     29.4733     128.011     
1 1 1 14 7  16 o 2  205.909 2.66514 756.147     26.3256  746.578     28.6142  10.8316    28.7768     297.518     28.7767     
1 1 1 14 7  17 o 14 409.34  3.85035 2956.9      77.3921  2983.11     80.5589  190.217    275.626     195.119     95.6261     
1 1 1 14 7  18 o 8  94.4757 2.37437 163.387     10.7458  153.432     11.6461  46.5755    187.5       181.213     187.5       
1 1 1 14 7  19 o 4  65.4975 2.56204 81.0724     8.15546  71.5894     8.54267  39.0308    248.167     106.619     248.167     
1 1 1 14 7  20 o 7  452.893 4.27097 3592.5      92.8448  3680.29     100.944  302.831    64.084      31.2191     244.084     
1 1 1 14 7  21 o 5  219.751 2.67065 874.629     27.5351  837.211     31.0908  67.8864    2.49136     159.985     182.491     
1 1 1 14 7  22 o 16 288.924 3.10043 1493.63     42.0887  1465.56     47.4784  237.343    92.6035     88.2769     92.6035     
1 1 1 14 7  23 o 18 162.536 2.44706 465.953     19.0823  470.409     20.7544  41.0153    164.999     127.126     344.999     
1 1 1 14 7  24 f 0  327.395 3.50781 1933.25     53.6118  1867.24     61.1064  249.62     4.82977     0           0           
1 1 1 14 7  25 o 18 359.158 3.56727 2247.08     64.1844  2326.84     64.2152  295.742    89.1318     95.609      89.1318     
1 1 1 14 7  26 o 5  538.985 4.79623 5128.67     126.933  5176.71     132.136  347.05     219.536     67.0808     39.5359     
1 1 1 14 7  27 o 15 605.764 5.41543 6489.03     164.381  6533.19     164.414  424.663    132.801     6.62118     312.801     
1 1 1 14 7  28 o 13 329.786 3.4786  1915.07     58.7054  1941.44     56.2303  199.556    55.3938     58.9435     235.394     
1 1 1 14 7  29 o 1  52.3877 2.94128 54.5494     7.15854  43.6754     7.95872  52.2685    91.6728     145.354     91.6728     
1 1 1 14 7  30 o 8  198.904 2.60614 713.165     25.9026  689.467     26.0447  68.9776    62.1686     130.995     242.169     
1 1 1 14 7  31 o 9  120.659 2.30407 248.425     13.8017  268.218     14.0293  51.2976    351.425     34.5723     171.425     
1 1 1 14 7  32 o 11 333.404 3.28067 1957.08     52.627   1984.97     56.9448  224.135    288.631     12.1883     108.631     
1 1 1 14 7  33 o 1  411.43  3.87142 3003.65     78.1744  3001.55     81.4365  277.624    51.4064     16.6644     231.406     
1 1 1 14 7  34 o 7  584.677 5.02537 6004.4      147.207  6134.06     147.274  455.542    3.74966     94.6732     3.74966     
1 1 1 14 7  35 o 14 238.677 2.80335 1016.25     34.1655  1003.78     32.8916  154.048    225.367     13.097      45.3667     
1 1 1 14 7  36 o 3  244.876 2.74981 1066.17     34.3678  1060.13     33.1138  167.093    178.322     3.85227     178.322     
1 1 1 14 7  37 o 3  342.072 3.64327 2085.6      59.5178  2065.92     65.2332  258.648    152.866     47.4525     152.866     
1 1 1 14 7  38 o 4  253.898 3.07423 1137.41     37.3138  1149.02     40.8553  225.16     44.9543     110.238     44.9543     
1 1 1 14 7  39 o 9  411.377 4.05607 2973.13     78.015   3033.85     88.9668  320.693    78.2542     73.7289     78.2542     
1 1 1 14 7  40 o 9  49.9358 3.07983 45.7009     7.28094  43.4368     7.94015  35.8619    121.878     122.942     121.878     
1 1 1 14 7  41 o 7  264.891 3.19795 1249.31     39.2517  1239.98     45.4048  186.762    79.2612     13.7544     79.2612     
1 1 1 14 7  42 o 17 43.6665 3.18929 27.337      6.36967  41.8095     7.29903  9.20685    326.203     35.7709     326.203     
1 1 1 14 7  43 o 4  93.9317 2.69787 144.633     10.9297  169.304     14.3921  28.4553    48.694      55.3985     228.694     
1 1 1 14 7  44 o 9  395.039 3.75842 2737.7      72.8468  2802.44     75.9604  219.45     217.934     101.242     37.9341     
1 1 1 14 7  45 o 2  210.486 2.64919 777.942     27.2613  793.536     28.6227  153.514    305.303     28.4263     305.303     
1 1 1 14 7  46 o 2  386.086 3.64504 2612.68     67.7094  2679.41     73.2927  334.701    242.54      147.02      242.54      
1 1 1 14 7  47 o 18 171.404 2.49621 509.671     19.9517  532.474     22.8879  120.341    172.42      19.3011     172.42      
1 1 1 14 7  48 o 12 325.729 3.38619 1835.19     53.9675  1931.55     56.591   286.455    66.5061     136.958     66.5061     
1 1 1 14 7  49 o 1  191.825 2.64098 636.581     22.9952  668.969     27.6692  136.525    143.959     22.6344     143.959     
1 1 1 14 7  50 o 1  221.835 2.82926 837.035     29.1654  909.873     33.7242  158.03     112.138     23.5426     112.138     
1 1 1 14 7  51 o 10 102.106 2.69015 178.35      13.8304  192.215     13.6291  46.1376    289.182     31.5359     109.182     
1 1 1 14 7  52 o 14 240.76  2.84621 982.233     33.3526  1076.2      35.3373  170.365    231.166     22.2736     231.166     
1 1 1 14 7  53 o 10 328.907 3.58881 1856.11     57.6698  1989.4      60.6505  235.714    165.586     33.0394     165.586     
1 1 1 14 7  54 o 19 127.761 2.67281 285.123     15.6948  294.845     18.4253  88.3851    262.778     15.0689     262.778     
1 1 1 14 7  55 o 10 348.742 3.95224 2119.68     72.5882  2208.87     65.1791  273.284    29.1875     83.7126     29.1875     
1 1 1 14 7  56 o 10 203.61  2.80363 750.082     30.0151  722.688     27.1743  141.443    98.0012     16.4099     98.0012     
1 1 1 14 7  57 o 10 136.621 2.47057 329.119     17.5266  333.935     16.2526  102.119    309.112     30.981      309.112     
1 1 1 14 7  58 o 9  173.441 2.63358 552.264     24.4994  516.863     21.2549  147.882    23.0238     73.3443     23.0238     
1 1 1 14 7  59 o 9  100.675 2.66572 195.284     14.5483  166.081     12.3245  66.4175    62.9775     8.85813     62.9775     
1 1 1 14 7  60 o 11 23.939  5.18767 3.11862     8.87347  14.5016     6.31729  11.9818    339.65      35.7303     339.65      
1 1 1 14 7  61 o 9  195.778 2.8034  688.951     26.8883  675.255     28.0936  130.836    16.5091     8.52067     16.5091     
1 1 1 14 7  62 o 17 91.188  2.73445 149.691     12.5772  146.875     12.3582  39.8865    199.003     33.4124     19.0033     
1 1 1 14 7  63 o 6  98.8471 2.67598 183.09      13.4163  165.563     13.0373  80.8292    292.704     45.0796     292.704     
1 1 1 14 7  64 o 4  57.6201 3.20463 60.3064     9.51747  58.9637     8.83412  32.1558    12.4041     1.44581     12.404      
1 1 1 14 7  65 o 13 118.393 2.56868 247.273     15.6012  252.61      14.8234  54.1229    294.989     42.3458     114.989     
1 1 1 14 7  66 o 15 115.683 2.6192  248.65      15.1235  229.229     15.1842  75.4652    6.61241     4.50835     6.61242     
1 1 1 14 7  67 o 8  69.0109 3.21594 88.6864     11.4776  82.6431     10.6458  44.4527    66.5518     4.97545     66.5519     
1 1 1 14 7  68 o 13 52.2104 4.23257 49.3963     9.75126  50.3713     11.8836  24.4448    244.992     13.0874     64.9923     
1 1 1 14 7  69 o 5  60.7001 3.43217 74.0802     10.8468  59.6254     9.84993  32.5185    280.667     8.23496     100.667     
1 1 1 14 7  70 o 4  56.6523 4.05061 56.1418     10.9017  61.2962     11.7879  39.6864    21.6711     13.6972     21.6711     
1 1 1 14 7  71 f 0  90.701  2.92781 162.213     13.0774  134.185     13.3454  56.3427    248.644     0           0           
1 1 1 14 7  72 o 11 41.5551 4.8768  30.9551     8.79389  33.9817     10.7783  18.9757    263.829     13.1382     263.829     
1 1 1 14 7  73 f 0  95.0039 3.31941 174.233     14.454   152.397     16.7415  57.2439    356.943     0           0           
1 1 1 14 7  74 o 9  98.1179 2.86407 182.942     14.3636  163.89      13.7369  81.1798    145.137     42.7665     145.137     
1 1 1 14 7  75 o 9  29.5086 5.33392 20.1176     8.24302  13.7417     7.71074  12.5221    155.817     4.45103     335.817     
1 1 1 14 7  76 o 12 69.7069 3.299   85.2287     11.7159  91.7493     11.1557  47.4301    291.881     11.0355     291.881     
1 1 1 14 7  77 o 2  15.6472 4.76682 -4.48821    7.0721   2.79493     6.93743  1.15814    12.2009     11.6447     12.2009     
1 1 1 14 7  78 f 0  48.3192 4.3281  47.0219     10.4674  41.0217     10.0089  31.2488    359.721     0           0           
1 1 1 14 7  79 o 5  16.2539 4.92586 -5.68649    7.93328  3.80314     7.17817  1.98942    62.9185     15.9043     62.9185     
1 1 1 14 7  80 o 18 18.1738 5.68878 -2.34672    9.20154  0.0142277   11.1913  9.40804    325.005     36.9779     325.005     
1 1 1 14 7  81 o 17 28.3362 6.49857 20.3077     9.68493  10.0079     12.7731  11.5138    200.052     0.322522    200.052     
1 1 1 14 7  82 o 11 50.7411 5.26937 40.5517     11.3345  61.4935     14.7341  30.3107    153.889     3.57406     153.889     
1 1 1 14 7  83 o 13 14.3302 4.85527 -11.0185    8.00402  -9.95613    11.2774  0.630683   3.29156     3.6323      3.29156     
1 1 1 14 7  84 o 3  80.6917 4.82964 147.702     18.1616  103.362     19.5655  53.7806    6.05956     13.0077     6.05955     
1 1 1 14 7  85 o 18 52.2733 6.25318 63.1023     15.0909  49.0697     16.1693  34.3382    233.617     10.0127     233.617     
1 1 1 14 7  86 o 4  42.2821 6.99783 26.7001     14.5993  52.2223     15.2807  17.4068    326.887     12.2227     146.887     
1 1 1 14 7  87 o 6  66.0772 5.44604 80.6667     17.2994  95.8453     18.0217  46.5625    288.673     18.5814     288.673     
1 1 1 14 7  88 o 12 26.0782 7.156   17.5701     13.1989  8.43206     14.1941  6.72721    66.8091     1.555       246.809     
1 1 1 14 7  89 o 17 23.4586 7.3744  1.58491     21.4585  6.09518     13.9029  2.7253     291.686     4.11396     111.686     
1 1 1 14 7  90 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 8  0  o 4  332.74  3.42741 1963.17     57.1246  1963.17     57.1246  214.866    360         54.3894     180         
1 1 1 14 8  1  o 1  468.812 4.38796 3880.62     103.091  3911.03     103.09   397.009    206.235     137.538     206.235     
1 1 1 14 8  2  o 5  501.137 4.85849 4399.36     116.383  4504.96     127.515  360.493    255.686     10.8315     255.686     
1 1 1 14 8  3  o 10 663.451 6.00503 7817.45     203.953  7792.85     195.28   479.758    217.993     8.41268     217.993     
1 1 1 14 8  4  o 14 669.685 5.92836 7917.22     198.953  7987.68     198.964  528.734    272.824     98.9063     272.824     
1 1 1 14 8  5  o 14 180.307 2.5359  575.921     22.9025  576.296     22.926   51.2402    245.147     115.13      65.1471     
1 1 1 14 8  6  o 5  362.773 3.70222 2327.03     68.7478  2337.98     65.8265  317.114    274.728     147.96      274.728     
1 1 1 14 8  7  o 18 481.884 4.57888 4129.82     108.141  4102.89     112.943  369.108    326.951     59.8635     326.951     
1 1 1 14 8  8  o 12 888.424 8.38897 14076.7     391.825  13939.5     354.406  678.77     233.713     78.0465     233.713     
1 1 1 14 8  9  o 16 275.089 3.04493 1336.29     41.9721  1345.91     41.9816  102.778    347.052     169.642     167.052     
1 1 1 14 8  10 o 7  428.607 4.1604  3269.65     91.2909  3242.88     87.4063  340.742    229.238     84.3        229.238     
1 1 1 14 8  11 o 11 522.036 4.88212 4775.44     124.935  4887.78     130.502  402.319    19.436      65.7391     19.4359     
1 1 1 14 8  12 o 13 457.952 4.37663 3761.44     102.621  3674.15     98.2584  273.746    14.5016     100.408     194.502     
1 1 1 14 8  13 o 10 540.623 5.04958 5159.84     127.602  5204.3      145.501  351.25     138.008     66.8829     318.008     
1 1 1 14 8  14 o 19 542.733 5.03797 5249.14     139.984  5196.33     134.031  337.535    140.264     97.8539     320.264     
1 1 1 14 8  15 o 9  218.716 2.77768 842.985     29.7697  852.556     31.1135  95.3045    280.349     97.4685     100.349     
1 1 1 14 8  16 o 2  399.027 3.80127 2805.78     74.4758  2838.97     77.5365  325.007    220.2       95.311      220.2       
1 1 1 14 8  17 f 0  503.665 4.48979 4418.83     111.046  4577.03     115.613  367.954    61.8926     0           0           
1 1 1 14 8  18 o 12 385.025 3.69753 2615.98     69.899   2639.67     72.7729  251.208    327.952     37.5006     147.952     
1 1 1 14 8  19 o 17 234.866 2.86919 958.906     34.4721  996.569     33.0161  163        357.428     16.8892     357.428     
1 1 1 14 8  20 o 7  345.09  3.43891 2060.42     58.2812  2162.05     60.6706  265.111    312.728     51.7425     312.728     
1 1 1 14 8  21 o 15 487.457 4.41365 4194.6      105.647  4232.12     109.965  454.406    327.873     224.136     327.873     
1 1 1 14 8  22 o 17 463.266 4.35305 3758.25     96.7941  3853.29     105.245  404.185    26.9052     157.528     26.9052     
1 1 1 14 8  23 o 7  200.818 2.6411  701.394     25.4593  728.243     27.6879  60.3225    347.888     151.161     167.888     
1 1 1 14 8  24 o 16 225.005 2.852   894.375     30.0074  900.352     34.188   175.553    183.527     56.6799     183.527     
1 1 1 14 8  25 o 1  519.27  4.68426 4758.12     114.375  4807.61     129.05   415.951    166.448     98.7053     166.448     
1 1 1 14 8  26 o 8  240.374 2.91414 1066.73     31.9302  982.554     37.7521  116.441    316.186     97.0745     136.186     
1 1 1 14 8  27 o 1  134.295 2.46272 329.768     15.083   309.964     17.8321  70.2697    191.213     33.228      191.213     
1 1 1 14 8  28 o 4  129.309 2.29623 303.343     14.254   289.657     15.4341  72.7924    139.237     19.5478     139.237     
1 1 1 14 8  29 f 0  232.511 2.70654 959.56      30.3042  957.091     32.72    145.327    2.06702     0           0           
1 1 1 14 8  30 o 15 719.719 6.08652 9173.61     210.922  9230.3      227.857  569.562    323.215     123.233     323.215     
1 1 1 14 8  31 o 16 493.729 4.57378 4307.04     113.156  4344.8      113.179  465.772    339.362     243.138     339.362     
1 1 1 14 8  32 o 5  463.017 4.43717 3841.19     100.654  3767.84     105.164  264.692    123.284     119.163     303.284     
1 1 1 14 8  33 o 15 37.1002 3.56405 26.4872     6.38215  23.2875     6.4938   23.457     161.008     56.1781     161.008     
1 1 1 14 8  34 o 17 268.417 3.2249  1308.52     42.2926  1247.25     44.3732  176.021    167.471     14.6863     347.471     
1 1 1 14 8  35 o 6  297.202 3.4186  1594.77     49.6494  1538.82     52.0985  207.626    6.76261     7.05236     6.76263     
1 1 1 14 8  36 o 5  228.99  3.33038 936.035     41.4841  924.062     34.6912  110.115    251.313     92.5782     71.3126     
1 1 1 14 8  37 o 10 349.235 3.79732 2192.04     66.4555  2136.29     66.4548  304.965    328.522     129.306     328.522     
1 1 1 14 8  38 o 1  373.919 3.9323  2522.56     73.6466  2440.3      73.709   257.55     229.851     2.54751     49.8509     
1 1 1 14 8  39 o 17 282.839 3.32932 1436.06     48.2803  1402.29     46.0963  269.966    180.654     157.359     180.654     
1 1 1 14 8  40 o 6  166.875 2.43502 496.555     20.6739  490.921     20.0516  110.015    19.8926     0.236898    19.8921     
1 1 1 14 8  41 f 0  146.454 2.35463 391.001     17.1666  369.717     17.3799  39.5485    125.338     0           0           
1 1 1 14 8  42 o 14 105.97  2.44708 209.277     12.2135  189.619     13.6102  40.9844    27.1817     48.9622     207.182     
1 1 1 14 8  43 o 9  248.422 2.99103 1047.38     34.6394  1143.11     39.8264  156.591    288.344     22.8006     108.344     
1 1 1 14 8  44 o 7  165.289 2.38516 482.053     18.8559  486.83      20.6269  111.565    194.405     8.20571     194.405     
1 1 1 14 8  45 o 17 128.375 2.3528  297.623     14.3599  287.094     15.8302  47.6775    153.307     69.9106     333.307     
1 1 1 14 8  46 o 9  154.065 2.52857 419.431     18.9332  422.469     20.0988  101.163    308.697     4.51799     308.697     
1 1 1 14 8  47 o 12 55.1232 3.20683 54.7686     8.35641  53.8014     9.17443  1.8298     51.7054     46.0759     51.7054     
1 1 1 14 8  48 o 6  232.095 2.93996 917.605     34.0152  994.663     34.3464  177.12     329.155     46.3803     329.155     
1 1 1 14 8  49 o 18 148.969 2.49832 386.964     18.4379  400.308     18.8651  99.4493    281.17      8.6411      281.17      
1 1 1 14 8  50 o 11 324.874 3.4615  1825.26     53.6954  1923.64     59.0011  246.658    115.33      57.6323     115.33      
1 1 1 14 8  51 o 19 90.9734 2.76454 145.397     12.3944  148.882     12.7545  54.9157    189.677     9.24962     189.677     
1 1 1 14 8  52 f 0  209.085 2.70584 740.316     27.6208  812.21      29.0867  106.493    1.20844     0           0           
1 1 1 14 8  53 o 19 26.1379 5.00635 8.76122     6.30888  16.5845     7.37026  9.95712    96.7331     27.7997     96.7331     
1 1 1 14 8  54 o 12 221.853 2.75976 836.076     30.305   912.568     31.0446  177.97     270.252     63.7957     270.252     
1 1 1 14 8  55 o 15 44.0253 3.63086 27.9281     7.21586  42.7643     8.42137  3.81124    158.886     28.0006     338.886     
1 1 1 14 8  56 o 12 30.6118 5.01441 15.1152     7.13618  19.8357     7.98108  14.5267    174.345     50.9448     174.345     
1 1 1 14 8  57 o 3  153.5   2.33835 414.067     18.2454  422.69      17.7195  97.9038    187.879     2.9905      7.87934     
1 1 1 14 8  58 o 4  87.2711 2.66369 134.862     11.6709  136.369     11.5725  67.977     307.471     41.4765     307.471     
1 1 1 14 8  59 o 12 46.8429 3.37471 41.9068     8.11567  37.1541     7.5106   8.01524    53.5629     32.9644     233.563     
1 1 1 14 8  60 o 18 70.7483 3.11799 96.5963     10.8341  82.6861     11.089   29.0971    14.2644     26.6604     194.264     
1 1 1 14 8  61 o 14 61.4579 3.54775 71.1837     11.3974  64.6692     10.2722  23.5256    115.449     23.7998     295.449     
1 1 1 14 8  62 f 0  157.089 3.10936 462.316     22.1171  418.859     26.3522  105.322    282.117     0           0           
1 1 1 14 8  63 o 9  62.1414 3.3649  74.3708     10.1951  64.5835     10.53    38.382     25.405      7.92916     25.405      
1 1 1 14 8  64 o 6  90.9261 2.96434 147.841     12.7172  147.862     14.183   57.1669    202.502     0.743211    202.501     
1 1 1 14 8  65 o 11 51.1955 3.95869 45.3851     9.88197  49.9416     10.089   33.8772    227.639     23.0798     227.639     
1 1 1 14 8  66 o 8  25.4252 5.48574 9.66654     7.69836  13.9874     7.6987   1.01224    76.29       19.6401     256.29      
1 1 1 14 8  67 o 4  89.4365 2.94622 146.046     13.0806  140.821     13.2497  66.0363    59.7734     20.9815     59.7734     
1 1 1 14 8  68 o 2  98.8965 2.78491 182.178     13.3714  168.449     14.12    57.24      47.9889     9.72329     227.989     
1 1 1 14 8  69 o 5  67.2799 3.18438 89.1141     10.5862  74.5281     10.6828  53.9686    17.8553     28.3421     17.8553     
1 1 1 14 8  70 o 18 28.5468 5.21892 15.7127     8.26228  15.3641     6.80228  5.2276     7.58972     0.418473    7.58971     
1 1 1 14 8  71 o 14 65.6992 3.25418 80.491      10.7135  75.7041     10.5752  37.1466    62.3476     5.58541     242.348     
1 1 1 14 8  72 o 9  18.9473 5.20122 3.82143     8.18017  4.93348     6.04144  4.61483    92.8613     24.908      92.8613     
1 1 1 14 8  73 o 1  82.5081 3.36785 127.355     13.2987  119.423     14.3614  47.4275    187.473     6.54708     7.47286     
1 1 1 14 8  74 o 14 107.321 3.00441 204.666     15.2276  211.064     16.9986  74.501     50.0195     16.557      50.0195     
1 1 1 14 8  75 o 16 39.2827 4.90275 26.5852     8.75168  32.4482     9.85978  18.7637    281.266     7.51496     101.266     
1 1 1 14 8  76 o 8  42.9249 4.68696 34.5479     9.27684  35.447      10.223   32.3876    120.944     23.1523     120.944     
1 1 1 14 8  77 f 0  25.0504 5.87565 12.9297     8.09748  10.574      9.24202  11.0849    180.591     0           0           
1 1 1 14 8  78 o 15 40.4008 5.3043  31.2231     10.2622  32.7559     10.426   16.5195    61.6856     13.455      241.686     
1 1 1 14 8  79 o 11 33.5526 5.7972  24.5208     10.6465  20.993      8.69139  14.7873    83.249      6.69832     263.249     
1 1 1 14 8  80 o 5  22.5925 6.20099 8.03005     9.1589   7.44644     10.982   4.43604    173.7       2.23759     353.7       
1 1 1 14 8  81 o 6  50.4046 5.00509 42.3901     11.3311  56.8574     13.2637  30.9356    339.389     4.91598     339.389     
1 1 1 14 8  82 o 14 47.6738 5.38966 47.4195     11.2857  42.2652     13.3199  25.1435    217.041     3.77906     37.0407     
1 1 1 14 8  83 o 11 44.3561 6.40082 42.2473     13.9036  38.7468     13.5912  31.883     272.757     16.8342     272.757     
1 1 1 14 8  84 o 3  36.0505 7.19245 28.9915     13.6379  27.2317     13.4817  17.3667    175.145     4.02039     355.145     
1 1 1 14 8  85 o 15 58.2774 5.41482 74.6479     15.523   60.8217     15.2014  34.7522    62.009      2.623       62.009      
1 1 1 14 8  86 o 12 19.5275 6.04312 -16.2124    11.9997  9.4206      12.5613  2.32986    215.394     8.10383     35.3943     
1 1 1 14 8  87 o 4  24.4764 7.17358 11.8181     15.0425  7.15828     13.7907  1.4731     47.4249     0.137212    227.425     
1 1 1 14 8  88 o 1  41.6183 7.49957 46.5373     15.26    35.3041     16.5032  24.1664    168.728     7.89844     168.728     
1 1 1 14 8  89 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 9  0  o 16 95.5113 2.46898 162.291     11.7818  162.291     11.7818  8.5323     180         49.6212     180         
1 1 1 14 9  1  o 2  188.748 2.57223 637.741     24.329   624.948     24.3304  104.646    296.595     12.1266     296.595     
1 1 1 14 9  2  o 15 336.019 3.5101  1978.6      57.8088  2023.85     60.4018  156.327    194.476     157.33      14.476      
1 1 1 14 9  3  o 16 621.311 5.65901 6879.43     180.009  6811.28     172.346  476.188    75.2381     62.0174     75.2381     
1 1 1 14 9  4  o 11 623.281 5.6956  6891.2      174      6886.62     181.72   491.102    89.6944     89.4571     89.6944     
1 1 1 14 9  5  o 4  452.168 4.3476  3633.86     96.3477  3614.87     100.627  447.399    160.38      270.199     160.38      
1 1 1 14 9  6  o 10 308.977 3.41554 1746.33     52.8744  1638.55     52.8592  274.285    350.264     146.384     350.264     
1 1 1 14 9  7  o 11 721.815 6.48527 9285.75     229.413  9198.33     239.609  552.145    186.034     65.874      186.034     
1 1 1 14 9  8  o 7  327.038 3.43837 1904.88     57.577   1886.42     55.1116  219.032    347.996     13.3147     167.996     
1 1 1 14 9  9  o 7  264.542 3.05424 1236.85     39.6077  1243.73     41.36    155.586    128.691     45.8281     308.691     
1 1 1 14 9  10 o 14 546.488 4.95409 5268.28     135.67   5322.38     135.68   451.62     95.2645     125.416     95.2645     
1 1 1 14 9  11 f 0  586.039 5.51547 6088.96     154.447  6092.48     169.187  369.906    138.263     0           0           
1 1 1 14 9  12 o 15 373.797 3.78341 2492.34     72.3958  2461.21     69.3339  259.62     223.859     4.5657      43.859      
1 1 1 14 9  13 o 9  332.725 3.49461 1947.17     59.5062  1977.44     56.9844  229.887    314.5       2.36709     134.499     
1 1 1 14 9  14 o 16 573.04  5.51211 5785.45     161.981  5863.03     154.461  322.185    322.549     176.982     142.55      
1 1 1 14 9  15 o 11 518.211 4.84355 4733.83     123.03   4790.29     128.51   290.081    140.624     160.719     320.624     
1 1 1 14 9  16 o 13 185.396 2.49977 616.084     22.7354  602.238     23.6923  83.9305    359.468     74.1187     179.468     
1 1 1 14 9  17 o 16 159.279 2.4043  460.531     18.7863  438.806     19.5616  75.1921    316.153     45.673      136.153     
1 1 1 14 9  18 o 5  594.363 5.22018 6294.78     152.326  6237.62     158.557  483.367    188.383     118.663     188.383     
1 1 1 14 9  19 o 1  146.621 2.36422 383.931     16.9866  378.054     17.742   81.6813    249.75      9.19412     249.75      
1 1 1 14 9  20 o 14 309.61  3.17558 1696.5      48.2674  1701.89     50.2591  214.112    299.161     2.11776     119.161     
1 1 1 14 9  21 o 12 376.871 3.70579 2516.28     69.9777  2520.05     70.0017  252.156    298.475     26.4491     118.475     
1 1 1 14 9  22 o 9  159.03  2.41335 457.32      18.8208  439.229     19.6162  108.228    133.543     49.7151     133.543     
1 1 1 14 9  23 o 13 444.27  4.19152 3522.3      93.3192  3478.55     93.3197  356.429    38.1771     85.8109     38.1771     
1 1 1 14 9  24 o 3  230.137 2.74159 934.029     31.6072  943.585     31.6304  169.565    63.3184     29.0572     63.3184     
1 1 1 14 9  25 o 10 560.775 5.03675 5567.19     135.533  5593.4      147.339  374.005    123.941     48.7259     303.941     
1 1 1 14 9  26 o 12 277.718 3.13634 1355.63     42.6878  1379.23     44.6059  131.434    174.916     124.092     354.916     
1 1 1 14 9  27 o 4  461.043 4.34399 3753.33     96.1053  3788.71     104.491  346.383    302.227     42.9522     302.227     
1 1 1 14 9  28 o 11 576.74  5.19722 5895.94     143.824  5914.14     156.36   467.414    160.31      119.954     160.31      
1 1 1 14 9  29 f 0  193.641 2.63503 658.019     23.8457  671.464     27.2166  133.89     219.49      0           0           
1 1 1 14 9  30 o 1  309.388 3.485   1727.42     48.7717  1668.12     58.656   262.152    143.286     99.9926     143.286     
1 1 1 14 9  31 o 13 188.614 2.75711 646.067     23.5017  615.565     28.2736  133.903    348.943     22.8614     348.943     
1 1 1 14 9  32 o 17 567.237 5.3153  5628.83     144.122  5801.77     157.935  503.137    351.724     210.629     351.724     
1 1 1 14 9  33 o 12 123.611 2.37634 278.699     14.3471  263.534     15.0306  67.3324    185.935     12.3792     5.93488     
1 1 1 14 9  34 o 3  471.874 4.53862 4007.3      104.915  3898.77     109.608  283.603    98.0553     93.7906     278.055     
1 1 1 14 9  35 o 13 204.96  2.78708 755.017     28.6164  734.819     28.634   124.243    235.63      29.7817     55.63       
1 1 1 14 9  36 o 17 90.768  2.68088 157.711     11.3698  135.396     12.7616  3.63676    263.646     107.401     83.6459     
1 1 1 14 9  37 o 6  271.236 3.18474 1340.49     41.1896  1269.86     45.1659  97.644     179.865     180.31      359.865     
1 1 1 14 9  38 o 9  123.247 2.43774 263.524     13.5717  275.595     16.4327  75.0701    18.5717     4.54387     198.572     
1 1 1 14 9  39 o 2  215.541 2.89789 861.34      29.7703  787.41      32.5955  131.287    271.016     30.0522     91.0162     
1 1 1 14 9  40 o 15 268.154 3.16302 1298.32     40.4962  1253.13     44.3489  224.111    95.8095     84.2416     95.8095     
1 1 1 14 9  41 o 19 187.702 2.75543 633.393     26.6187  616.376     25.216   125.468    64.0831     0.899702    64.0833     
1 1 1 14 9  42 o 3  154.32  2.55974 426.777     20.5618  417.89      19.0148  131.586    138.764     102.234     138.764     
1 1 1 14 9  43 o 1  65.621  2.86181 83.0435     9.91838  70.5554     8.82297  4.15108    133.162     56.924      313.163     
1 1 1 14 9  44 o 4  129.119 2.40911 305.786     16.104   286.061     15.0503  101.17     36.0592     57.3543     36.0592     
1 1 1 14 9  45 o 3  276.074 2.96438 1336.23     42.5815  1368.21     39.3369  171.695    262.573     30.6149     82.5731     
1 1 1 14 9  46 o 12 24.4865 4.85531 14.9659     6.21189  6.27491     6.82141  26.9457    305.847     61.8427     305.847     
1 1 1 14 9  47 o 12 17.461  4.78611 3.90612     5.84993  2.82325     6.12826  26.432     315.739     56.5643     315.739     
1 1 1 14 9  48 o 10 80.8569 2.56974 112.365     10.288   120.108     10.4811  24.395     45.6079     43.9905     225.608     
1 1 1 14 9  49 o 18 114.15  2.41013 230.119     13.3827  232.544     14.1537  54.6447    201.765     34.6901     21.7646     
1 1 1 14 9  50 o 7  257.601 2.86929 1139.6      36.2112  1216.57     37.8766  141.981    60.6186     61.8602     240.619     
1 1 1 14 9  51 o 12 49.0122 3.38316 43.9572     7.66377  42.2076     8.67979  1.71422    100.108     41.2685     280.108     
1 1 1 14 9  52 o 4  100.858 2.55263 174.599     13.0503  187.035     12.685   69.7008    296.642     16.3142     296.642     
1 1 1 14 9  53 o 7  65.6128 2.94408 75.6421     8.64848  77.9088     10.5409  32.8435    324.431     5.48978     324.431     
1 1 1 14 9  54 o 19 102.937 2.55411 174.489     12.2463  202.775     14.0824  67.7712    150.196     7.67605     150.196     
1 1 1 14 9  55 o 15 265.372 2.92632 1191        36.9194  1313.6      40.9373  187.202    237.649     22.3343     237.649     
1 1 1 14 9  56 o 5  126.849 2.58979 277.667     15.8403  294.642     17.0542  70.3311    91.4257     22.9726     271.426     
1 1 1 14 9  57 o 17 80.8775 2.71619 110.825     9.6408   122.397     12.2642  17.8769    59.6001     65.8728     239.6       
1 1 1 14 9  58 o 16 89.1693 2.70812 136.24      11.7105  147.179     12.4401  25.2598    205.323     62.5479     25.3229     
1 1 1 14 9  59 o 11 73.6456 3.20291 95.7794     10.6001  98.2584     12.8409  36.2237    290.24      16.0944     110.24      
1 1 1 14 9  60 o 14 190.752 2.74733 670.335     25.5951  625.611     26.8479  150.114    125.833     53.1488     125.833     
1 1 1 14 9  61 o 14 103.201 3.00234 194.793     15.6729  185.663     15.3159  76.1828    316.56      25.1821     316.56      
1 1 1 14 9  62 o 15 121.985 3.0556  277.803     17.2186  254.12      19.8359  63.7413    38.572      28.6247     218.572     
1 1 1 14 9  63 o 3  140.359 2.69927 347.349     18.5804  355.523     19.3566  86.1974    191.086     8.12134     11.0863     
1 1 1 14 9  64 o 15 71.6788 3.17194 84.8856     10.887   99.8611     11.785   52.8417    206.334     18.1015     206.334     
1 1 1 14 9  65 o 1  67.8626 3.26581 85.3337     10.6405  80.4216     11.3934  45.9989    131.369     9.11353     131.369     
1 1 1 14 9  66 o 18 31.7701 5.36439 20.3152     8.62399  18.0644     8.22919  7.47265    143.254     17.9775     323.254     
1 1 1 14 9  67 o 1  138.225 2.58362 346.11      18.0598  337.12      17.7029  103.065    322.18      30.5227     322.18      
1 1 1 14 9  68 o 7  43.0175 4.04614 35.426      8.95217  32.7344     8.06182  27.9689    107.799     12.9531     107.799     
1 1 1 14 9  69 o 9  64.7949 3.17066 81.1181     10.6122  70.7032     9.85333  40.3311    216.105     1.77894     216.105     
1 1 1 14 9  70 o 1  91.4961 2.81299 143.488     13.0881  157.484     12.5954  57.2351    219.007     0.520872    219.007     
1 1 1 14 9  71 o 4  45.3054 3.92668 40.8761     9.42241  34.8125     8.04983  21.0036    176.859     11.0708     356.859     
1 1 1 14 9  72 o 11 64.5611 3.27706 78.0343     11.2728  73.175      9.77463  52.4503    238.635     28.6232     238.635     
1 1 1 14 9  73 o 2  33.8173 5.43685 17.8159     10.0473  26.3386     8.11113  10.9857    290.567     16.1046     110.567     
1 1 1 14 9  74 o 5  46.0438 4.17702 41.8007     9.93772  37.2554     8.90295  20.0462    204.074     14.7256     24.0736     
1 1 1 14 9  75 o 14 78.9943 3.05049 116.294     12.0091  110.296     12.0435  44.7028    79.2121     7.38472     259.212     
1 1 1 14 9  76 o 9  81.3563 3.25283 111.044     12.6331  131.019     13.785   53.966     338.371     8.79221     338.371     
1 1 1 14 9  77 o 8  20.8622 5.52598 9.70292     7.78986  3.02576     8.29684  1.2718     271.238     17.4391     91.2378     
1 1 1 14 9  78 o 14 34.8079 5.55618 26.4005     9.93188  22.1215     9.00746  20.5507    179.818     5.07109     179.818     
1 1 1 14 9  79 o 4  21.4054 5.77024 9.17449     8.98805  5.045       8.27946  3.39792    113.493     2.2674      293.493     
1 1 1 14 9  80 o 2  25.733  6.27614 17.6353     9.56796  5.34098     11.5815  8.26593    67.4705     2.49993     247.471     
1 1 1 14 9  81 o 7  56.178  4.91284 64.4319     12.5175  57.6535     14.2717  37.8229    155.121     11.2888     155.121     
1 1 1 14 9  82 o 5  92.0481 4.49584 154.243     20.3944  167.198     20.8159  52.6566    354.854     4.52364     174.854     
1 1 1 14 9  83 o 6  29.2241 6.79808 4.94905     13.0905  27.19       12.5443  5.41589    172.548     20.8489     352.548     
1 1 1 14 9  84 o 19 22.9582 6.53061 15.1277     12.6604  -4.13955    12.0566  5.00145    59.9015     0.301942    59.9015     
1 1 1 14 9  85 o 13 22.9788 6.65085 13.2457     12.8731  -0.563604   12.3798  6.29281    94.565      5.44997     274.565     
1 1 1 14 9  86 o 1  39.0467 8.16759 41.7232     18.343   32.7149     15.8965  21.6007    73.2549     3.59247     73.2549     
1 1 1 14 9  87 o 16 41.9552 8.03615 38.1001     18.8124  48.092      16.4231  17.7013    329.359     12.5914     329.359     
1 1 1 14 9  88 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 10 0  o 3  114.862 2.3137  234.348     13.2937  234.348     13.2937  14.0512    3.19507e-05 21.7971     180         
1 1 1 14 10 1  o 11 382.443 3.85048 2638.66     72.1401  2547.11     75.346   298.031    232.133     59.2249     232.134     
1 1 1 14 10 2  o 12 571.07  5.27938 5781.86     154.331  5784.68     147.774  387.574    23.5449     46.2516     203.545     
1 1 1 14 10 3  o 11 327.417 3.53999 1910        58.0797  1890.35     58.0893  208.883    185.554     39.7791     5.5543      
1 1 1 14 10 4  o 2  161.856 2.53272 463.974     20.9802  464.543     20.0968  83.7879    156.911     9.42683     156.911     
1 1 1 14 10 5  o 18 658.183 5.95318 7670.91     192.054  7697.81     200.591  595.358    343.094     245.071     343.094     
1 1 1 14 10 6  o 18 516.703 4.85026 4789.51     128.325  4678.96     122.853  290.891    77.8419     160.705     257.842     
1 1 1 14 10 7  o 2  357.775 3.67177 2273.59     64.3888  2264.4      67.2411  150.341    258.381     207.636     78.3808     
1 1 1 14 10 8  o 4  173.328 2.56339 528.843     22.748   536.003     21.766   107.398    132.185     32.9345     132.185     
1 1 1 14 10 9  o 10 443.358 4.29259 3511.46     97.4376  3458.72     93.2946  257.616    25.138      118.487     205.138     
1 1 1 14 10 10 o 12 500.239 4.71982 4409.51     115.735  4465.24     120.88   331.229    306.546     54.3282     126.546     
1 1 1 14 10 11 o 16 453.474 4.47437 3625.78     96.9703  3666.79     106.232  381.116    5.59398     118.254     5.59398     
1 1 1 14 10 12 o 8  250.737 2.9672  1104.24     38.0707  1124.4      36.4637  127.637    125.452     91.1669     305.452     
1 1 1 14 10 13 o 1  292.813 3.16726 1522.48     46.4791  1517.01     46.4738  150.178    308.198     110.231     128.198     
1 1 1 14 10 14 o 17 469.413 4.48572 3910.22     103.195  3904.59     107.797  268        168.975     135.881     348.975     
1 1 1 14 10 15 o 4  434.604 4.43174 3315.36     98.7585  3383.67     94.1774  325.644    336.89      33.4966     336.89      
1 1 1 14 10 16 o 10 307.939 3.33197 1676.46     50.2894  1685.51     52.5306  188.538    298.018     54.7405     118.018     
1 1 1 14 10 17 o 12 350.56  3.54258 2164.55     62.233   2192.88     62.2372  208.641    105.432     78.4129     285.432     
1 1 1 14 10 18 o 4  447.772 4.22903 3563.87     94.8951  3547.32     94.9011  400.303    358.949     166.991     358.949     
1 1 1 14 10 19 o 9  367.424 3.64698 2394.81     67.1433  2392.35     67.1613  195.595    187.964     130.032     7.96366     
1 1 1 14 10 20 o 4  119.951 2.38034 253.299     13.6759  257.131     14.8957  17.3062    41.7046     190.101     41.7046     
1 1 1 14 10 21 o 3  369.691 3.59637 2442.01     65.2736  2404.75     67.9345  333.86     156.301     150.09      156.301     
1 1 1 14 10 22 o 3  195.205 2.53304 669.194     24.2786  681.654     25.2781  63.3663    335.723     141.271     155.723     
1 1 1 14 10 23 o 19 183.434 2.50571 614.123     22.5392  578.964     23.4767  119.911    114.062     1.84123     294.062     
1 1 1 14 10 24 o 4  298.158 3.18982 1549.44     47.6346  1603.14     47.6798  129.123    48.7699     160.881     228.77      
1 1 1 14 10 25 o 5  514.277 4.81458 4680.01     121.357  4707.57     126.767  462.583    229.896     197.573     229.896     
1 1 1 14 10 26 o 2  334.525 3.5065  1991.6      57.4846  1977.6      60.0467  217.768    249.32      33.2924     69.3195     
1 1 1 14 10 27 o 16 104.367 2.45165 195.359     12.7715  191.249     12.8367  10.5891    151.944     104.268     331.944     
1 1 1 14 10 28 o 13 279.261 3.29727 1375.58     47.2223  1390.45     45.0286  163.817    335.06      59.8878     155.06      
1 1 1 14 10 29 o 8  225.023 3.02101 900.868     34.0616  894.856     34.0731  178.021    116.588     55.2183     116.588     
1 1 1 14 10 30 o 4  334.521 3.67015 1983.93     56.9722  1986.24     65.7709  196.614    171.885     74.5693     351.885     
1 1 1 14 10 31 o 13 67.6043 2.691   80.3264     8.67235  82.2539     9.47812  7.41537    2.03113     75.7751     2.03113     
1 1 1 14 10 32 o 1  358.5   3.78243 2282.35     64.7906  2278.19     70.9721  285.573    239.404     71.2913     239.404     
1 1 1 14 10 33 o 15 153.951 2.44604 410.537     17.2578  429.946     20.4179  89.4753    55.1018     24.6203     235.102     
1 1 1 14 10 34 o 8  34.3145 3.84478 25.1151     5.83376  17.9729     6.66903  35.8797    1.87212     93.7817     1.87212     
1 1 1 14 10 35 o 13 62.9808 2.88833 71.4244     8.33232  69.8587     9.72706  5.77667    269.197     7.15562     89.1973     
1 1 1 14 10 36 o 12 99.828  2.39859 179.478     12.0108  174.322     11.9525  58.628     357.421     6.19298     357.421     
1 1 1 14 10 37 o 16 428.798 4.10873 3226.19     88.2701  3302.58     88.3051  365.089    28.1581     133.913     28.1581     
1 1 1 14 10 38 o 11 358.166 3.97906 2304.83     67.719   2250.09     74.8493  279.461    68.6509     63.3029     68.6509     
1 1 1 14 10 39 o 13 216.407 2.87117 859.248     32.5775  802.541     29.7031  167.126    115.48      42.6444     115.48      
1 1 1 14 10 40 o 15 229.672 2.9839  959.175     35.1276  912.569     33.5659  152.383    240.888     7.25785     60.8881     
1 1 1 14 10 41 o 6  179.907 2.70873 571.378     23.7944  576.729     25.0382  138.707    318.379     40.72       318.379     
1 1 1 14 10 42 o 1  110.518 2.60374 211.109     14.1238  222.693     14.6794  64.6595    356.231     3.54944     176.231     
1 1 1 14 10 43 o 8  120.415 2.82573 245.412     17.0365  269.861     16.9881  74.0483    64.4184     0.483308    244.418     
1 1 1 14 10 44 o 4  237.998 2.98631 1020.25     34.8248  989.814     36.3648  190.319    301.883     61.3071     301.883     
1 1 1 14 10 45 o 14 98.1694 2.58984 166.571     12.8254  175.836     12.5978  36.2004    3.95092     48.0837     183.951     
1 1 1 14 10 46 o 4  139.483 2.50859 333.515     17.7838  357.086     17.2307  107.375    303.403     40.5994     303.403     
1 1 1 14 10 47 o 1  186.201 2.72278 610.021     25.2724  620.255     25.5421  167.199    292.516     93.9505     292.516     
1 1 1 14 10 48 o 17 121.596 2.57495 248.1       15.3108  277.409     16.0308  100.175    311.346     61.8603     311.346     
1 1 1 14 10 49 o 5  129.927 2.55415 296.611     15.8502  302.923     17.3584  47.6228    321.304     75.0469     141.304     
1 1 1 14 10 50 o 3  219.103 2.80472 837.424     29.7964  867.065     31.7914  157.189    207.107     21.6363     207.107     
1 1 1 14 10 51 o 13 229.686 2.84862 916.606     31.7458  957.089     33.8329  145.464    53.0887     16.6964     233.089     
1 1 1 14 10 52 o 14 166.297 2.72366 510.001     22.2399  472.509     23.0917  91.0489    147.474     38.0357     327.474     
1 1 1 14 10 53 o 16 89.3143 2.64941 137.504     11.1237  146.395     12.5336  54.2082    326.042     0.627244    146.042     
1 1 1 14 10 54 o 14 114.355 2.4198  222.769     13.7916  242.249     13.8978  75.9427    277.096     6.33523     277.096     
1 1 1 14 10 55 o 19 57.8113 3.11107 59.0638     8.19065  60.5227     9.65265  20.9036    22.706      21.8574     202.706     
1 1 1 14 10 56 o 10 130.904 2.31553 288.287     14.6111  321.072     15.7643  73.9427    256.793     22.0325     76.7931     
1 1 1 14 10 57 o 14 129.132 2.46001 283.455     14.7417  310.02      17.0632  77.5492    100.6       11.9477     280.6       
1 1 1 14 10 58 o 12 84.1209 2.50894 122.194     10.2115  129.986     10.8971  58.0583    145.085     15.1364     145.085     
1 1 1 14 10 59 o 1  77.5773 2.88078 107.816     11.5328  107.176     10.7767  55.7509    17.1751     23.0886     17.1751     
1 1 1 14 10 60 o 6  59.1121 3.30024 71.0611     9.91123  54.9859     9.41177  30.6861    327.355     2.94253     147.355     
1 1 1 14 10 61 o 13 56.4861 3.6788  43.1547     9.96834  74.1009     9.96006  29.7195    160.504     4.18272     340.504     
1 1 1 14 10 62 o 4  75.921  3.27811 106.253     12.0546  100.636     12.7335  48.1282    177.882     2.28631     177.882     
1 1 1 14 10 63 o 10 25.6654 5.25588 19.026      7.7728   3.8191      8.05653  1.39375    255.649     1.98745     75.6488     
1 1 1 14 10 64 o 13 100.151 2.83439 178.103     13.8396  180.873     14.5502  51.6161    280.659     24.809      100.659     
1 1 1 14 10 65 o 8  52.8431 3.79546 43.5979     9.62465  58.5195     10.0704  36.883     279.945     13.0024     279.945     
1 1 1 14 10 66 o 15 90.4966 3.01462 155.629     13.6516  138.798     13.5836  63.8059    60.2748     13.9212     60.2748     
1 1 1 14 10 67 o 5  55.7563 3.70609 57.5797     10.2892  55.6119     10.178   32.3367    141.075     2.51593     321.075     
1 1 1 14 10 68 o 13 71.0359 3.28356 97.6803     11.675   84.9217     11.5378  38.7249    17.8743     10.7141     197.874     
1 1 1 14 10 69 o 18 43.8239 4.50007 34.666      9.63487  36.8484     9.54174  29.6914    332.993     12.8775     332.993     
1 1 1 14 10 70 o 6  104.551 2.82028 194.925     15.2551  197.977     14.2154  78.6532    309.505     26.6902     309.505     
1 1 1 14 10 71 o 17 40.2136 4.62852 28.3011     9.58387  32.5132     8.25708  11.9499    133.999     23.433      313.999     
1 1 1 14 10 72 o 16 21.8768 5.49914 12.308      8.77089  3.67241     6.72335  2.65815    52.5092     14.0518     232.509     
1 1 1 14 10 73 o 14 20.9062 5.49857 3.43404     9.04819  8.69015     6.88741  1.50924    181.487     0.680727    1.48652     
1 1 1 14 10 74 o 9  104.474 2.78425 210.921     15.5559  183.845     13.5632  70.8452    289.613     12.2462     289.613     
1 1 1 14 10 75 f 0  20.198  5.47027 3.80742     9.06001  7.17888     6.75101  12.3926    154.936     0           0           
1 1 1 14 10 76 o 15 75.5137 3.57753 108.64      13.3665  101.544     13.5336  54.6172    134.05      17.7269     134.05      
1 1 1 14 10 77 o 19 61.5489 3.81087 64.7548     10.9675  76.5083     12.3171  41.3358    56.9797     9.29988     56.9797     
1 1 1 14 10 78 o 12 56.6835 4.14427 68.6103     11.9448  52.889      11.1766  30.6635    177.403     5.9227      357.403     
1 1 1 14 10 79 o 6  21.3341 5.73554 10.901      8.80987  2.3801      8.72248  0.762922   10.5414     17.8544     190.541     
1 1 1 14 10 80 o 4  39.9707 6.3417  34.719      10.7597  31.2264     14.0509  21.5664    245.866     0.426338    65.8659     
1 1 1 14 10 81 o 12 21.4775 6.17613 4.47187     9.18501  6.9999      11.6101  3.23158    112.308     1.24211     292.308     
1 1 1 14 10 82 o 15 36.8356 7.61518 33.5719     16.405   26.3232     13.4955  13.8691    155.746     13.3638     335.746     
1 1 1 14 10 83 o 15 23.2609 7.03884 2.7591      15.0122  6.41875     14.2812  7.28898    244.919     3.31105     64.9194     
1 1 1 14 10 84 o 6  23.6295 7.10488 0.570881    15.2638  10.2633     14.6344  7.05568    179.415     5.63274     359.415     
1 1 1 14 10 85 o 18 21.6357 6.79945 -3.68269    15.596   5.04953     14.3659  3.05856    280.411     2.37527     100.411     
1 1 1 14 10 86 o 5  34.5209 8.18216 26.7086     14.545   33.0194     18.873   16.5973    166.105     1.38847     166.105     
1 1 1 14 10 87 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 11 0  o 14 455.977 4.30443 3687.15     98.3207  3687.15     98.3207  367.714    180         69.6779     180         
1 1 1 14 11 1  f 0  255.102 2.93884 1152.93     37.568   1153.93     37.5736  152.206    134.442     0           0           
1 1 1 14 11 2  o 3  543.172 4.95454 5232.13     134.864  5232.85     134.867  311.202    251.47      162.531     71.4699     
1 1 1 14 11 3  o 11 414.904 4.1788  3019.86     82.8643  3084.67     90.8066  166.642    0.171457    263.527     180.171     
1 1 1 14 11 4  o 18 313.7   3.37405 1741.07     54.183   1747.69     51.8728  170.31     320.561     103.324     140.561     
1 1 1 14 11 5  o 11 871.611 7.6782  13467.2     328.011  13517.8     342.623  690.091    179.827     114.962     179.827     
1 1 1 14 11 6  o 3  508.918 4.89542 4639.32     124.859  4547.75     124.837  346.426    240.867     39.899      60.8669     
1 1 1 14 11 7  o 18 617.867 5.51991 6822.91     170.917  6722.49     170.912  564.452    198.143     239.216     198.143     
1 1 1 14 11 8  f 0  533.887 4.88223 5048        130.624  5062.79     130.627  505.149    192.859     0           0           
1 1 1 14 11 9  o 10 283.604 3.17348 1423.92     44.1103  1427.49     46.0772  240.66     175.842     92.52       175.842     
1 1 1 14 11 10 o 4  258.421 3.01454 1193        39.8798  1174.48     38.1933  155.909    6.95814     47.178      186.958     
1 1 1 14 11 11 o 7  218.688 2.8594  848.985     29.8929  846.369     32.7136  126.202    133.82      45.6747     313.82      
1 1 1 14 11 12 o 17 274.901 3.19677 1349.33     46.0002  1329.91     42.0169  185.58     242.333     11.7013     62.3334     
1 1 1 14 11 13 o 14 169.366 2.54535 510.886     21.1295  505.924     22.0636  33.0881    136.152     163.182     316.152     
1 1 1 14 11 14 o 7  453.316 4.26451 3645.88     96.8753  3642.77     96.8833  472.539    147.261     305.496     147.261     
1 1 1 14 11 15 o 18 127.608 2.50245 293.127     15.997   284.57      15.9758  56.1629    208.445     18.048      208.445     
1 1 1 14 11 16 o 4  243.813 2.9894  1072.09     36.5133  1035.59     36.5302  173.854    224         12.4598     224         
1 1 1 14 11 17 o 10 724.253 6.34909 9404.53     230.439  9226.26     230.429  524.057    351.776     4.40492     351.776     
1 1 1 14 11 18 o 15 399.514 3.88844 2841.4      77.8516  2819.71     77.8507  318.304    103.005     69.1319     103.005     
1 1 1 14 11 19 o 4  217.706 2.72721 843.618     29.7621  836.695     29.7463  141.688    338.24      14.4283     158.24      
1 1 1 14 11 20 o 16 552.687 5.21419 5428.05     144.419  5415.57     144.42   417.628    96.9098     44.0411     96.9098     
1 1 1 14 11 21 o 10 277.25  3.18797 1357.17     44.2981  1368.63     44.2896  133.726    225.35      122.464     45.3504     
1 1 1 14 11 22 f 0  252.465 3.11741 1113.9      40.3392  1146.44     38.4897  182.049    141.154     0           0           
1 1 1 14 11 23 o 3  74.2008 2.65169 98.2087     9.5697   97.4956     10.0782  2.71574    175.835     30.71       355.835     
1 1 1 14 11 24 o 16 146.519 2.651   385.039     18.44    376.42      20.3966  67.3052    330.67      54.532      150.67      
1 1 1 14 11 25 o 10 316.18  3.51025 1750.31     54.2807  1795.95     56.9551  233.973    30.0034     26.0797     30.0034     
1 1 1 14 11 26 o 18 183.401 2.61633 604.786     23.4791  587.894     24.5823  76.4099    76.3556     95.588      256.356     
1 1 1 14 11 27 o 16 124.236 2.43041 276.527     14.7473  271.132     15.4699  37.2211    272.843     83.302      92.8427     
1 1 1 14 11 28 o 5  274.764 3.17865 1354.62     43.7577  1323.17     43.7747  143.173    69.0564     97.4743     249.056     
1 1 1 14 11 29 o 18 297.52  3.269   1563.64     47.6682  1576.26     49.7978  250.628    330.222     88.7733     330.222     
1 1 1 14 11 30 o 8  250.089 2.88678 1114.11     36.1783  1104.03     36.1813  177.178    153.386     8.53165     153.386     
1 1 1 14 11 31 o 9  257.109 2.94705 1181.11     37.9587  1163.48     37.9836  159.677    38.5005     38.3794     218.501     
1 1 1 14 11 32 o 12 127.985 2.4913  298.709     16.6828  282.668     15.2424  48.2206    162.899     73.855      342.899     
1 1 1 14 11 33 o 11 250.299 3.09221 1096.74     37.8566  1125.77     39.7149  186.286    218.104     26.3935     218.104     
1 1 1 14 11 34 o 15 536.849 5.56748 5106.38     137.461  5143.02     161.237  424.031    69.883      92.958      69.883      
1 1 1 14 11 35 o 18 123.025 2.68152 268.197     16.1143  269.098     16.9026  92.8551    63.7089     40.7568     63.7089     
1 1 1 14 11 36 o 4  128.007 2.66637 291.984     16.1724  289.688     17.9457  90.2061    332.44      20.8009     332.44      
1 1 1 14 11 37 f 0  457.025 4.49221 3690.23     98.1188  3730.69     107.489  265.101    292.616     0           0           
1 1 1 14 11 38 o 2  151.288 2.79897 395.307     19.6078  417.055     22.7657  115.518    302.115     36.3865     302.115     
1 1 1 14 11 39 o 12 83.8484 2.55701 115.706     10.6106  134.471     10.7945  5.07182    107.286     92.7559     287.286     
1 1 1 14 11 40 o 13 256.606 3.31968 1124.21     39.2795  1213.69     46.043   191.756    178.72      33.3506     178.72      
1 1 1 14 11 41 o 4  20.5754 4.92006 8.83145     6.00046  4.74214     6.28176  15.686     273.37      34.3333     273.37      
1 1 1 14 11 42 o 18 327.119 3.62718 1879.35     58.0253  1920.29     60.8888  216.738    258.322     16.0178     78.3219     
1 1 1 14 11 43 o 4  217.867 3.25171 808.984     32.1701  876.513     38.7502  110.874    117.274     73.9592     297.274     
1 1 1 14 11 44 o 14 71.1328 2.76701 86.5731     9.37621  93.5669     10.2784  15.8767    166.712     44.636      346.712     
1 1 1 14 11 45 o 12 239.146 3.06907 1038.75     35.8477  991.511     37.6367  133.249    165.833     57.8939     345.833     
1 1 1 14 11 46 o 10 117.004 2.51714 238.957     14.3368  247.235     15.1472  92.8934    86.3004     58.0597     86.3004     
1 1 1 14 11 47 o 8  136.851 2.38874 328.128     16.4253  336.555     16.3227  85.0252    30.3159     7.96404     210.316     
1 1 1 14 11 48 o 15 68.7246 2.73915 80.4025     9.3186   87.8677     9.46416  31.9808    74.4075     2.12141     254.408     
1 1 1 14 11 49 o 5  166.216 2.45497 483.715     19.6576  496.838     21.2292  141.947    90.0415     65.9677     90.0415     
1 1 1 14 11 50 o 10 136.364 2.37755 325.247     15.9855  334.767     16.5105  95.6008    343.465     13.4373     343.465     
1 1 1 14 11 51 o 5  215.838 2.69025 848.251     28.2815  806.596     29.8422  113.778    193.21      62.2015     13.2099     
1 1 1 14 11 52 o 17 91.2371 2.52865 140.048     11.2003  156.256     11.8794  26.0707    23.8085     64.8695     203.809     
1 1 1 14 11 53 o 18 56.4126 3.1809  54.8119     8.61469  59.1494     9.22481  24.4216    295.286     2.2206      115.286     
1 1 1 14 11 54 o 19 93.8771 2.4432  150.521     10.9632  163.121     11.9903  63.6924    62.8174     11.1325     62.8174     
1 1 1 14 11 55 o 15 24.3344 5.1775  12.0458     6.44682  9.16668     7.34906  11.7051    266.266     35.6365     266.266     
1 1 1 14 11 56 o 12 27.3327 5.00776 10.1309     6.71334  17.8342     7.33822  10.2106    225.48      38.4431     225.48      
1 1 1 14 11 57 o 7  65.2942 2.97703 76.9243     9.46438  75.5847     9.90419  26.3997    188.517     25.3782     8.5171      
1 1 1 14 11 58 o 10 41.5606 4.03569 32.66       7.86699  30.3496     8.45024  7.55532    19.0599     23.4403     199.06      
1 1 1 14 11 59 o 15 50.6452 3.67685 50.6911     9.91393  42.2168     8.50278  14.2937    123.341     28.2927     303.341     
1 1 1 14 11 60 o 5  72.5356 3.03644 93.9205     11.4787  94.52       10.4691  45.91      36.8107     3.77419     36.8108     
1 1 1 14 11 61 o 19 30.9059 5.2383  16.3536     8.36856  19.6049     7.68997  0.0282608  39.7427     31.7243     219.742     
1 1 1 14 11 62 o 1  87.8893 2.91839 154.455     14.5008  123.003     11.1721  63.9741    343.122     16.5973     343.122     
1 1 1 14 11 63 o 5  88.8687 2.96428 133.064     13.4055  150.286     12.8422  67.2608    24.5389     22.3126     24.5389     
1 1 1 14 11 64 o 11 99.1894 2.86611 164.949     14.577   187.991     13.7384  56.4978    160.281     13.8805     340.281     
1 1 1 14 11 65 o 17 104.613 2.8226  197.458     15.1479  194.911     14.3877  65.2646    329.541     2.98871     149.541     
1 1 1 14 11 66 o 14 70.8879 3.16775 97.8454     11.2403  83.6941     11.106   41.1906    296.787     6.06216     116.787     
1 1 1 14 11 67 o 1  36.9786 5.10937 32.3169     8.87545  20.0586     9.28455  5.84695    67.2153     31.7438     247.215     
1 1 1 14 11 68 o 17 98.2591 3.09205 172.348     14.37    175.586     15.974   68.8622    171.454     14.0164     171.454     
1 1 1 14 11 69 o 5  23.0749 5.88215 8.65442     8.31052  8.73308     9.09266  3.25252    275.225     11.0587     95.2246     
1 1 1 14 11 70 o 2  61.8349 3.91101 63.4248     11.7299  77.0374     12.1986  41.2834    129.21      7.43916     129.21      
1 1 1 14 11 71 o 4  175.318 2.84775 550.81      24.3246  555.115     25.7007  120.285    297.677     18.9331     297.677     
1 1 1 14 11 72 o 19 79.2697 3.25155 112.087     12.7007  116.283     13.0228  69.7866    307.975     42.8295     307.975     
1 1 1 14 11 73 o 2  30.8803 5.33982 11.5919     9.35266  25.4003     7.80839  13.6668    154.794     6.30413     334.794     
1 1 1 14 11 74 o 15 47.2578 4.24716 41.5644     10.3612  42.376      9.23836  29.8246    170.845     3.83658     170.845     
1 1 1 14 11 75 o 5  16.8864 5.1306  1.259       8.7924   0.110193    6.75801  7.03091    7.64109     30.6962     7.64109     
1 1 1 14 11 76 o 4  49.9242 4.69062 49.5676     11.2947  45.9289     11.5611  24.4941    90.2076     10.4752     270.208     
1 1 1 14 11 77 o 7  54.5392 4.7885  60.3697     12.9171  54.0279     12.6708  33.8639    319.332     3.3473      319.332     
1 1 1 14 11 78 o 11 54.5126 5.3877  53.2187     15.0807  63.685      13.0565  25.5555    350.945     13.4253     170.945     
1 1 1 14 11 79 o 11 15.9514 5.26187 -7.15582    8.47439  -5.99048    11.7749  4.3218     95.3415     20.1854     95.3415     
1 1 1 14 11 80 o 18 24.0136 5.93335 20.318      10.1145  -15.3746    13.6012  7.61394    333.553     1.20864     153.553     
1 1 1 14 11 81 o 12 36.3913 7.93404 27.5583     16.4492  31.2808     15.4811  23.3979    109.178     11.6131     109.178     
1 1 1 14 11 82 o 19 45.7654 6.98031 39.619      14.2877  50.4505     16.8331  26.859     314.327     1.89524     314.327     
1 1 1 14 11 83 o 4  18.4898 5.90303 -10.8498    12.0641  2.60607     11.8753  2.15707    152.291     3.13286     332.291     
1 1 1 14 11 84 o 2  21.7096 6.4225  -5.59549    12.3505  12.6065     12.5455  4.12429    252.434     3.08711     72.4339     
1 1 1 14 11 85 o 1  37.0619 7.27771 24.8563     14.643   39.4054     14.121   20.2495    344.383     4.1399      344.383     
1 1 1 14 11 86 o 8  24.8615 7.16745 10.1044     13.1828  12.8223     14.9566  3.79891    356.991     13.029      176.991     
1 1 1 14 11 87 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 12 0  o 15 105.898 2.35464 199.311     12.468   199.311     12.468   32.6316    9.69283e-06 57.0504     180         
1 1 1 14 12 1  o 15 631.506 5.62551 7094.7      178.034  7058.76     178.031  475.696    32.9703     35.6273     32.9704     
1 1 1 14 12 2  o 5  451.61  4.25859 3630.61     96.3791  3602.99     96.3812  315.073    71.9161     20.283      251.916     
1 1 1 14 12 3  o 11 227.003 2.84595 894.214     33.0426  932.746     31.6539  140.597    200.16      31.3174     20.1605     
1 1 1 14 12 4  o 8  87.95   2.45343 135.527     10.5775  139.097     11.0072  33.2054    279.35      167.429     279.35      
1 1 1 14 12 5  o 14 314.997 3.64135 1780.13     60.329   1738.4      54.5516  206.175    37.6084     34.5285     217.608     
1 1 1 14 12 6  o 5  731.178 6.55729 9477.8      235.004  9508.16     245.448  495.424    80.88       71.4714     260.88      
1 1 1 14 12 7  o 17 555.546 5.05363 5459.56     140.694  5491.46     140.699  432.037    329.799     61.3499     329.799     
1 1 1 14 12 8  o 14 422.834 4.05151 3177.96     85.852   3163.04     85.8504  278.846    33.1301     50.1249     213.13      
1 1 1 14 12 9  o 8  176.869 2.53591 556.966     22.4737  551.957     22.4808  136.888    234.833     87.6218     234.833     
1 1 1 14 12 10 o 10 288.562 3.21795 1471.17     47.5349  1481.2      45.5053  189.702    58.5946     27.7984     238.595     
1 1 1 14 12 11 o 14 304.876 3.31493 1652.13     49.5337  1643.68     51.7316  231.476    129.243     33.1524     129.243     
1 1 1 14 12 12 o 1  118.555 2.58504 246.455     15.3207  252.296     15.3584  3.64137    19.8186     161.488     19.8187     
1 1 1 14 12 13 o 17 306.949 3.2503  1682.04     50.002   1658.82     49.9919  164.491    289.274     107.848     109.274     
1 1 1 14 12 14 o 11 94.4041 2.40635 160.705     11.361   155.649     11.3682  17.8383    114.501     63.933      294.501     
1 1 1 14 12 15 o 12 486.402 4.52481 4181.7      110.296  4213.06     110.293  398.214    99.3718     98.3596     99.3718     
1 1 1 14 12 16 o 1  29.2553 4.47671 11.7519     6.43233  20.0561     6.39192  46.3609    19.2579     102.375     19.2579     
1 1 1 14 12 17 o 15 288.713 3.7125  1467.04     55.2456  1489.6      52.1117  172.026    112.706     63.802      292.706     
1 1 1 14 12 18 o 16 96.753  2.59159 167.364     12.5378  164.997     12.548   28.4017    14.5452     12.1193     194.545     
1 1 1 14 12 19 o 15 289.276 3.44257 1479.32     49.9011  1488.62     49.9112  218.991    356.357     32.8945     356.357     
1 1 1 14 12 20 o 7  446.097 4.74095 3565        108.768  3499.34     103.178  278.8      261.172     80.4555     81.172      
1 1 1 14 12 21 o 1  338.943 3.7937  2055.89     64.4365  2019.89     64.438   270.478    2.64985     63.4472     2.64985     
1 1 1 14 12 22 o 2  214.88  2.89503 807.194     31.8934  830.241     30.4141  173.499    357.417     59.1177     357.417     
1 1 1 14 12 23 o 8  257.258 3.12606 1188.26     39.3254  1159.02     41.2276  128.231    296.539     103.634     116.539     
1 1 1 14 12 24 o 5  589.481 5.52882 6176.72     163.325  6170.26     163.332  427.552    1.98542     12.4497     1.98542     
1 1 1 14 12 25 o 3  274.276 3.17898 1338.64     43.6865  1329.58     43.7037  231.048    286.722     82.488      286.722     
1 1 1 14 12 26 o 5  418.805 4.09902 3108.45     84.1324  3116.78     87.8921  325.669    291.843     57.7563     291.843     
1 1 1 14 12 27 o 13 169.421 2.64901 528.719     22.4561  489.49      22.4994  93.1418    104.993     42.937      284.993     
1 1 1 14 12 28 o 13 102.709 2.45853 192.178     12.3063  182.362     12.9348  53.8244    113.526     10.5908     293.526     
1 1 1 14 12 29 o 14 350.117 3.90761 2194.87     65.0146  2155.98     71.8717  233.115    120.959     28.2904     300.959     
1 1 1 14 12 30 o 7  120.872 2.55587 260.556     15.0522  258.002     15.8619  89.097     166.418     31.0245     166.418     
1 1 1 14 12 31 o 14 285.838 3.27022 1438.52     44.6581  1460.29     48.9618  213.146    216.261     26.5894     216.261     
1 1 1 14 12 32 o 11 408.723 4.16179 2976.13     81.2538  2955.69     89.0301  300.891    269.676     25.8287     269.676     
1 1 1 14 12 33 o 17 129.714 2.89058 293.918     17.1077  303.553     20.3336  92.216     48.3856     20.2712     48.3856     
1 1 1 14 12 34 o 9  128.513 2.77052 288.315     17.8163  298.087     17.8245  42.3565    279.195     86.5138     99.1952     
1 1 1 14 12 35 o 11 183.975 2.6737  598.025     24.6552  602.5       24.6463  92.1389    91.9555     67.1499     271.956     
1 1 1 14 12 36 o 5  147.812 2.6151  390.779     19.8534  384.425     18.8671  98.0728    245.556     2.01737     245.556     
1 1 1 14 12 37 o 7  43.2216 3.66607 29.8664     7.50192  37.6329     8.02603  4.37961    61.3311     18.6875     61.3311     
1 1 1 14 12 38 o 8  310.252 3.68325 1706.51     58.7926  1711.13     55.6956  244.089    245.223     59.4628     245.223     
1 1 1 14 12 39 o 18 177.013 2.7288  540.322     23.5991  571.465     24.8189  149.319    251.796     66.5618     251.796     
1 1 1 14 12 40 o 6  407.593 4.08193 2954.71     81.5375  2947.41     85.1742  304.419    95.3935     43.5915     95.3935     
1 1 1 14 12 41 o 10 70.6822 2.58317 86.5527     8.80719  91.1738     9.43171  13.2083    183.541     0.849242    3.54146     
1 1 1 14 12 42 o 4  94.2369 2.38651 151.956     11.1107  163.545     11.3911  43.5789    8.78637     25.8422     188.786     
1 1 1 14 12 43 o 12 364.6   3.67845 2304.98     64.3691  2417.5      70.0399  287.142    346.897     73.0364     346.897     
1 1 1 14 12 44 o 8  364.155 3.64331 2341.62     62.4229  2369.31     70.3587  293.127    42.6916     86.7246     42.6916     
1 1 1 14 12 45 o 6  180.713 2.52119 576.699     22.3788  582.056     23.2813  88.0539    209.174     67.5812     29.1739     
1 1 1 14 12 46 o 17 259.306 2.96889 1171.85     36.9377  1215.82     40.2042  190.567    41.8867     28.7984     41.8868     
1 1 1 14 12 47 o 19 102.73  2.65659 190.498     13.6439  184.641     13.6606  39.3079    267.287     54.6494     87.2869     
1 1 1 14 12 48 f 0  161.944 2.57952 469.909     20.4869  461.115     21.3633  84.0395    263.496     0           0           
1 1 1 14 12 49 o 4  143.514 2.56389 359.638     18.0247  372.175     18.8261  101.389    309.642     13.7865     309.642     
1 1 1 14 12 50 o 18 181.77  2.46871 602.417     22.9294  571.004     22.0499  142.409    168.972     42.9381     168.972     
1 1 1 14 12 51 o 6  111.992 2.36604 224.076     13.4745  221.68      13.0525  80.6363    174.969     18.3687     174.969     
1 1 1 14 12 52 o 19 161.274 2.52398 470.559     19.9066  453.571     20.8575  116.056    77.1594     18.8909     77.1594     
1 1 1 14 12 53 o 12 34.8409 4.88699 18.2385     7.73085  27.1167     8.76267  0.389236   38.5033     21.6907     38.5032     
1 1 1 14 12 54 o 10 171.721 2.58241 514.397     22.3872  534.166     22.0455  129.521    292.017     32.2311     292.017     
1 1 1 14 12 55 o 11 65.3021 2.85901 73.7498     9.12739  78.6753     9.4943   30.2731    280.943     17.2576     100.943     
1 1 1 14 12 56 o 6  55.7314 3.11149 53.4092     8.29771  58.0532     8.94534  25.7452    137.335     8.96732     317.335     
1 1 1 14 12 57 o 9  166.191 2.37989 484.22      19.5149  498.399     20.128   113.038    34.785      8.0355      34.785      
1 1 1 14 12 58 o 15 143.427 2.35617 348.966     16.539   383.431     17.3319  103.265    196.634     19.9704     196.634     
1 1 1 14 12 59 o 4  96.0361 2.65174 168.216     12.8835  161.013     12.592   61.2597    274.582     0.110437    94.5815     
1 1 1 14 12 60 o 12 50.3561 3.48273 47.4536     8.7028   44.2416     8.64294  23.7206    200.744     12.8921     20.7442     
1 1 1 14 12 61 o 14 95.6868 2.58572 160.419     12.4723  166.679     12.2721  74.6805    167.303     27.104      167.303     
1 1 1 14 12 62 o 2  47.6349 3.94063 38.1752     9.37998  44.7836     8.97237  33.0474    127.178     14.3487     127.178     
1 1 1 14 12 63 o 6  29.3474 5.69103 18.9109     9.25119  13.9587     8.03854  8.36843    246.035     2.31969     66.0348     
1 1 1 14 12 64 o 5  40.9573 4.62992 33.3419     9.41618  29.2412     8.9465   24.9368    143.486     7.09324     143.486     
1 1 1 14 12 65 o 11 74.7322 3.20285 96.7037     12.2422  104.89      11.5795  35.1765    204.108     24.2527     24.108      
1 1 1 14 12 66 o 14 27.4175 5.35966 4.45983     8.72299  22.6406     8.32243  4.33245    71.9837     19.492      251.984     
1 1 1 14 12 67 o 8  107.289 2.8229  218.274     15.1182  195.663     15.1473  80.0859    60.1159     24.0902     60.1159     
1 1 1 14 12 68 o 5  83.2347 3.10612 140.937     12.848   110.108     12.818   51.1973    26.5959     2.21364     206.596     
1 1 1 14 12 69 o 9  34.1225 5.47275 17.7242     9.31958  27.4993     9.10771  9.97116    105.398     19.1027     285.398     
1 1 1 14 12 70 f 0  53.8148 4.06921 54.1972     10.5571  52.7756     11.0336  45.8267    217.399     0           0           
1 1 1 14 12 71 o 4  85.382  3.29522 134.841     14.1695  130.261     13.923   56.5162    146.49      6.32972     146.49      
1 1 1 14 12 72 o 11 18.5934 5.5799  2.24913     8.66271  0.429308    9.46235  2.21628    33.1557     5.61753     213.156     
1 1 1 14 12 73 o 11 63.7885 3.94364 73.0082     11.7372  78.0934     13.2139  38.4436    34.1365     1.37944     214.137     
1 1 1 14 12 74 o 4  17.0974 5.4562  -8.44653    9.56261  0.367968    10.4969  0.669139   55.7298     9.59805     235.73      
1 1 1 14 12 75 o 6  55.7781 4.73321 60.5489     12.5428  58.5405     13.3467  36.7339    353.205     6.8004      353.205     
1 1 1 14 12 76 o 11 28.3468 6.96382 21.6616     12.6831  9.47772     12.278   8.6609     280.648     3.63416     280.648     
1 1 1 14 12 77 o 11 26.4007 6.82132 3.75092     12.7627  19.7892     12.3007  8.81773    147.509     0.36294     147.509     
1 1 1 14 12 78 o 8  19.3933 5.95304 5.69821     10.7843  -7.71654    11.6969  1.02137    63.9768     2.52194     243.977     
1 1 1 14 12 79 o 14 22.4498 6.21613 14.0686     11.1023  -2.25152    10.7207  5.77308    136.526     3.16778     316.526     
1 1 1 14 12 80 o 12 28.131  7.01561 12.7482     12.5313  18.6538     12.321   12.6121    236.722     2.57944     56.722      
1 1 1 14 12 81 o 7  22.8724 6.27337 18.2883     12.177   -11.5558    12.0809  7.47437    171.476     3.7229      351.476     
1 1 1 14 12 82 o 19 80.6182 4.59753 126.694     18.6254  124.644     18.2086  50.9997    102.448     5.8833      102.448     
1 1 1 14 12 83 o 5  29.1863 7.31297 22.644      13.6533  14.6179     13.4401  12.7547    316.951     1.39575     136.951     
1 1 1 14 12 84 o 4  18.8275 6.07292 -0.351216   12.5383  -5.70004    12.9875  0.869281   61.0356     4.76896     241.036     
1 1 1 14 12 85 o 18 40.435  7.82818 45.5854     16.6936  34.757      16.1836  19.9194    176.511     2.41238     356.511     
1 1 1 14 12 86 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 13 0  o 6  181.43  2.5403  584.019     23.0765  584.019     23.0765  54.1458    180         157.285     8.65806e-06 
1 1 1 14 13 1  o 5  501.439 4.74518 4466.94     121.807  4455.1      116.628  351.542    240.125     23.7506     60.1249     
1 1 1 14 13 2  o 18 38.9878 3.39321 28.9743     6.46576  25.7895     6.491    4.0236     276.286     9.81246     276.286     
1 1 1 14 13 3  o 15 240.942 2.92185 1023.32     36.0332  1034.93     34.501   185.747    293.653     37.2168     293.653     
1 1 1 14 13 4  o 14 413.499 4.00044 3024.41     82.8981  3040.4      82.8969  355.714    232.395     117.526     232.395     
1 1 1 14 13 5  o 8  574.623 5.56578 5836.86     164.023  5886.17     156.405  408.567    213.08      17.3212     33.0801     
1 1 1 14 13 6  o 19 165.955 2.55543 483.403     20.8055  492.961     21.6976  42.6526    292.693     143.09      112.693     
1 1 1 14 13 7  f 0  190.855 2.60861 647.528     24.9498  643.816     24.9504  163.808    103.136     0           0           
1 1 1 14 13 8  o 15 222.857 2.75005 875.014     30.7083  885.8       30.7176  125.455    293.4       60.6859     113.4       
1 1 1 14 13 9  o 17 377.16  3.99679 2514.16     77.3071  2531.93     73.724   154.344    200.752     235.602     20.7525     
1 1 1 14 13 10 o 15 348.503 3.98502 2160.81     67.7296  2147.67     71.4062  353.553    250.065     217.41      250.065     
1 1 1 14 13 11 o 3  439.129 4.95957 3444.22     112.328  3400.75     105.901  323.166    69.9635     13.9098     69.9635     
1 1 1 14 13 12 o 4  319.081 3.96981 1783.88     61.598   1828.11     65.3436  266.47     349.871     81.5531     349.871     
1 1 1 14 13 13 o 14 70.7178 2.91243 87.2996     10.2502  90.6419     10.3016  10.7003    0.708208    81.8904     0.708208    
1 1 1 14 13 14 o 9  575.494 6.00183 5847.04     173.087  5920.95     173.099  376.398    328.31      79.5898     148.31      
1 1 1 14 13 15 o 7  178.449 2.93974 565.48      26.3076  563.699     26.2715  78.9799    229.849     86.1465     49.8493     
1 1 1 14 13 16 o 17 353.068 4.11484 2211.84     72.8066  2211.46     72.8071  303.658    249.855     106.803     249.855     
1 1 1 14 13 17 o 19 139.868 2.81089 344.139     19.6929  350.118     19.6708  46.0541    312.993     92.3782     132.993     
1 1 1 14 13 18 o 12 240.162 2.95302 1008.24     35.534   1037.24     35.543   191.915    59.9779     53.4322     59.9779     
1 1 1 14 13 19 o 18 488.153 4.74512 4191.55     116.072  4269.29     116.084  365.43     123.563     30.6179     123.563     
1 1 1 14 13 20 o 10 558.585 5.30065 5546.31     148.38   5537.93     148.383  399.626    118.701     3.64565     298.701     
1 1 1 14 13 21 o 2  273.154 3.1717  1319.85     43.4172  1326.58     43.4167  156.95     186.343     71.3815     6.34338     
1 1 1 14 13 22 o 17 263.623 3.10673 1219.41     41.0343  1245.57     41.0498  105.293    185.41      162.423     5.4102      
1 1 1 14 13 23 o 11 281.36  3.14574 1396.67     43.3749  1411.25     45.3234  152.717    149.538     92.5634     329.538     
1 1 1 14 13 24 o 2  343.885 3.50497 2105.99     60.4002  2089.67     60.4049  290.768    216.663     95.2373     216.663     
1 1 1 14 13 25 o 9  223.505 2.89835 882.353     32.4556  889.354     32.4715  151.295    239.968     8.69053     59.9677     
1 1 1 14 13 26 o 18 310.769 3.38982 1696.11     52.7809  1730.45     52.8009  168.136    112.095     104.831     292.095     
1 1 1 14 13 27 o 8  207.617 2.8133  777.425     28.5858  751.476     29.9126  125.321    160.213     39.015      340.213     
1 1 1 14 13 28 o 9  84.7056 2.65917 132.529     11.2277  122.53      11.2767  27.4236    130.564     46.2711     310.564     
1 1 1 14 13 29 o 12 219.101 3.00323 850.928     32.9683  851.982     32.9829  128.888    279.855     47.9471     99.8551     
1 1 1 14 13 30 o 12 195.104 2.72187 674.707     26.5971  675.399     26.629   108.742    163.979     52.6987     343.979     
1 1 1 14 13 31 o 3  295.194 3.32648 1563.07     49.2206  1529.18     49.1949  212.637    126.696     11.1823     126.696     
1 1 1 14 13 32 f 0  64.1812 2.82306 70.4518     9.25821  76.2911     8.77303  41.2994    39.4142     0           0           
1 1 1 14 13 33 o 5  107.514 2.71086 200.479     14.1573  210.115     15.0096  71.4415    143.075     36.5684     143.075     
1 1 1 14 13 34 o 1  301.3   3.22447 1620.85     48.6636  1600.77     48.7098  208.117    76.4579     4.68629     256.458     
1 1 1 14 13 35 f 0  129.884 2.37072 301.712     15.4123  296.97      15.4232  96.7205    207.775     0           0           
1 1 1 14 13 36 o 17 159.018 2.45952 440.449     19.215   456.476     19.9864  58.3356    69.6794     99.5581     249.679     
1 1 1 14 13 37 o 5  88.2254 2.51911 138.126     10.9202  138.411     11.3066  25.2613    201.972     56.791      21.9718     
1 1 1 14 13 38 o 7  98.9737 2.5667  178.379     12.6693  169.622     12.7411  50.7206    288.561     17.6436     108.561     
1 1 1 14 13 39 o 17 41.7542 3.4905  30.6353     7.14122  32.1325     7.18134  8.0589     325.873     33.1789     325.873     
1 1 1 14 13 40 o 5  199.208 2.70135 686.412     26.997   721.759     26.924   130.371    264.829     9.85469     84.8286     
1 1 1 14 13 41 o 18 154.436 2.56484 406.853     19.4755  439.61      20.225   124.855    116.268     49.1981     116.268     
1 1 1 14 13 42 o 19 129.915 2.55247 297.493     16.6961  301.793     16.5051  53.7285    249.173     64.4522     69.1727     
1 1 1 14 13 43 o 4  244.816 3.24538 1019.22     39.7927  1110.15     39.7857  195.123    233.995     56.7577     233.995     
1 1 1 14 13 44 o 10 261.106 3.02823 1210.28     39.6607  1210.58     39.5887  216.242    309.416     76.3962     309.416     
1 1 1 14 13 45 o 4  86.4826 2.51401 131.253     10.9987  134.645     10.74    59.7298    160.645     29.2362     160.645     
1 1 1 14 13 46 o 14 160.005 2.45624 449.35      20.0292  459.336     19.3463  123.896    199.468     34.4988     199.468     
1 1 1 14 13 47 o 18 200.208 2.55942 719.75      25.7122  703.417     25.6447  119.066    66.1825     33.3489     246.183     
1 1 1 14 13 48 o 10 16.9153 4.31455 -9.15755    5.96212  9.52833     6.01714  15.6274    64.006      35.5272     64.006      
1 1 1 14 13 49 o 3  82.4046 2.62875 118.475     10.4902  123.257     11.165   47.4434    335.824     6.52515     155.824     
1 1 1 14 13 50 o 15 188.879 2.65298 634.694     25.0986  632.987     25.1249  146.121    331.037     39.4204     331.037     
1 1 1 14 13 51 o 7  84.006  2.78067 120.194     11.7036  131.387     11.622   57.7568    239.369     13.522      239.369     
1 1 1 14 13 52 o 14 233.469 2.82226 962.394     32.3232  976.636     33.7123  165.456    189.489     17.006      189.489     
1 1 1 14 13 53 o 9  340.052 3.44238 2072.05     62.1174  2051.85     55.0229  278.254    62.0683     98.4108     62.0683     
1 1 1 14 13 54 o 17 111.109 2.29015 217.727     12.7435  221.501     12.7323  94.7114    137.371     49.3837     137.371     
1 1 1 14 13 55 o 1  69.459  2.64174 89.402      9.12561  82.9063     9.18506  43.7852    251.352     6.5891      251.352     
1 1 1 14 13 56 o 6  83.5534 2.55559 125.833     10.3972  123.184     10.9396  45.9263    34.9348     12.9519     214.935     
1 1 1 14 13 57 o 13 26.5905 5.05674 14.6157     6.49097  11.6626     7.38128  5.49898    25.933      29.3012     25.9331     
1 1 1 14 13 58 o 17 51.0469 3.65483 39.0617     8.8284   56.0122     9.45868  17.1511    93.8371     27.3754     273.837     
1 1 1 14 13 59 o 2  25.6547 5.24269 6.41169     7.5341   17.4025     7.51571  3.46868    358.019     9.38287     178.019     
1 1 1 14 13 60 o 18 73.0548 2.85594 87.3476     10.3905  104.311     10.3724  35.4959    275.31      22.6116     95.3097     
1 1 1 14 13 61 o 16 62.4262 3.15038 79.1846     9.76291  61.7003     9.70025  34.6263    213.594     9.0657      33.5937     
1 1 1 14 13 62 o 18 62.6976 3.30248 78.6495     9.76173  63.6837     10.6228  45.7268    132.516     14.5075     132.516     
1 1 1 14 13 63 o 6  40.1999 4.59401 33.3802     9.01674  27.0551     8.81344  14.6888    305.686     18.0373     125.686     
1 1 1 14 13 64 o 14 30.3034 5.17578 23.6089     8.57788  12.0444     7.24719  7.60633    27.3258     17.1766     207.326     
1 1 1 14 13 65 o 1  36.2836 5.17788 28.4987     9.08711  21.809      9.08685  18.239     134.948     2.7527      314.948     
1 1 1 14 13 66 o 13 106.194 2.87407 207.195     15.2609  198.398     15.2674  78.5999    289.424     21.7872     289.424     
1 1 1 14 13 67 o 11 82.4519 3.14345 111.864     12.9469  134.281     12.8356  59.3119    233.697     14.9747     233.697     
1 1 1 14 13 68 o 7  46.6856 4.46509 41.8573     10.5065  39.467      9.85334  24.9124    97.7838     6.26619     277.784     
1 1 1 14 13 69 o 13 34.1172 5.72697 21.5875     9.93547  23.9048     9.37244  14.6249    260.512     9.48751     80.5116     
1 1 1 14 13 70 o 18 74.2173 3.7481  107.858     14.2002  94.5021     13.488   44.2912    351.513     4.3354      171.513     
1 1 1 14 13 71 o 13 91.1284 3.58362 153.901     16.3256  150.415     16.2758  66.7184    200.647     19.2961     200.647     
1 1 1 14 13 72 o 5  34.9939 6.27697 24.2004     10.9184  25.4679     11.1299  13.9302    344.244     12.7376     164.244     
1 1 1 14 13 73 o 7  79.7463 3.68573 118.917     14.3102  116.173     14.9679  58.5309    63.913      18.4988     63.913      
1 1 1 14 13 74 o 11 21.2387 6.02647 3.59625     9.13783  7.88668     10.4545  0.320367   326.724     20.7999     146.724     
1 1 1 14 13 75 o 11 52.3515 5.34905 48.7037     12.8889  59.1373     14.3721  36.7158    165.377     11.9282     165.377     
1 1 1 14 13 76 o 7  61.3815 4.75309 80.3911     14.9889  64.9292     13.7459  34.7814    159.891     4.37952     339.891     
1 1 1 14 13 77 o 19 16.9094 5.43298 -11.7381    10.589   0.727451    10.1647  1.32807    52.0834     13.2032     52.0834     
1 1 1 14 13 78 o 18 27.1944 6.72295 10.2771     11.5182  18.5033     11.4901  11.3112    270.911     1.85611     270.911     
1 1 1 14 13 79 f 0  16.2012 5.34859 -10.8646    10.6822  -5.11577    10.8286  11.8564    24.739      0           0           
1 1 1 14 13 80 o 5  36.3096 7.709   27.4404     15.533   31.7176     14.8821  19.8341    291.592     0.186212    291.592     
1 1 1 14 13 81 o 12 32.4438 7.82499 25.4155     15.1961  22.1877     15.3711  18.3274    38.9415     8.55677     38.9415     
1 1 1 14 13 82 o 12 26.3888 7.21939 1.93904     14.3732  22.2586     14.623   9.84955    239.611     3.08517     59.6109     
1 1 1 14 13 83 o 17 21.9289 6.75621 0.117781    14.1107  7.40731     13.9948  2.36144    19.8118     13.4453     199.812     
1 1 1 14 13 84 o 6  33.7761 7.21846 6.30661     17.5917  43.3755     14.7887  16.3029    243.219     2.96019     243.219     
1 1 1 14 13 85 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 14 14 0  f 0  490.084 7.09778 4264.83     174.157  4264.83     174.157  580.866    2.42854e-06 0           0           
1 1 1 14 14 1  o 14 290.756 3.49385 1499.83     50.8756  1499.83     50.8756  142.152    30          141.916     210         
1 1 1 14 14 2  o 10 423.775 4.73398 3186.91     100.48   3186.91     100.48   395.578    60          169.995     60          
1 1 1 14 14 3  o 4  585.135 6.13606 6078.81     179.842  6078.81     179.842  415.476    90          26.6097     270         
1 1 1 14 14 4  o 18 157.99  2.88712 443.28      22.8244  443.28      22.8244  90.2129    300         67.1156     300         
1 1 1 14 14 5  o 15 152.201 2.83153 411.417     21.5635  411.417     21.5635  134.026    150         62.7697     150         
1 1 1 14 14 6  o 5  326.156 4.44533 1888.32     72.5981  1888.32     72.5981  173.464    180         130.722     8.6518e-06  
1 1 1 14 14 7  o 13 89.1203 2.99725 141.725     13.317   141.725     13.317   16.2308    210         8.44927     30.0001     
1 1 1 14 14 8  o 4  112.306 2.94672 224.467     16.5325  224.467     16.5325  16.1457    240         195.796     240         
1 1 1 14 14 9  o 7  223.788 3.3857  888.963     37.9313  888.963     37.9313  155.803    270         15.7129     90          
1 1 1 14 14 10 o 4  224.206 3.2059  892.122     35.988   892.122     35.988   169.439    120         11.1274     120         
1 1 1 14 14 11 o 4  147.5   2.66425 386.343     19.6646  386.343     19.6646  63.013     330         88.9472     150         
1 1 1 14 14 12 f 0  94.8872 2.53002 160.248     11.9919  160.248     11.9919  131.084    180         0           0           
1 1 1 14 14 13 o 13 116.115 2.48014 239.603     14.4021  239.603     14.4021  2.47874    30          163.45      210         
1 1 1 14 14 14 o 18 442.602 4.19453 3475.46     92.9996  3475.46     92.9996  349.341    240         53.3579     240         
1 1 1 14 14 15 o 6  57.6783 2.87592 59.8401     8.21615  59.8401     8.21615  32.5476    270         119.964     270         
1 1 1 14 14 16 o 9  303.32  3.38141 1632.17     51.3708  1632.17     51.3708  203.178    120         35.1591     300         
1 1 1 14 14 17 o 19 35.9616 3.98541 24.5523     6.65613  24.5523     6.65613  53.6056    330         129.849     330         
1 1 1 14 14 18 o 16 136.226 2.54116 329.591     17.3209  329.591     17.3209  94.4013    360         6.13643     180         
1 1 1 14 14 19 o 9  166.906 2.51209 494.403     20.9905  494.403     20.9905  103.151    30          35.8671     210         
1 1 1 14 14 20 o 7  288.676 3.43375 1478.63     49.6436  1478.63     49.6436  284.546    60          150.562     60          
1 1 1 14 14 21 o 18 36.8351 4.2071  25.8624     7.15876  25.8624     7.15876  2.25953    270         6.18239     270         
1 1 1 14 14 22 o 1  501.992 5.09263 4473.7      128.056  4473.7      128.056  351.163    300         23.7886     120         
1 1 1 14 14 23 o 6  644.03  6.21373 7368.43     200.464  7368.43     200.464  484.595    330         38.7798     330         
1 1 1 14 14 24 o 18 749.586 7.20501 9989.8      270.543  9989.8      270.543  660.431    360         239.367     360         
1 1 1 14 14 25 o 4  16.9521 6.09236 7.4812      6.47704  7.4812      6.47704  62.9083    30          133.418     30          
1 1 1 14 14 26 o 10 125.615 2.51704 280.352     15.8162  280.352     15.8162  21.0731    240         138.582     60          
1 1 1 14 14 27 o 19 371.638 3.83717 2450.88     71.4304  2450.88     71.4304  298.039    90          62.1441     90          
1 1 1 14 14 28 o 16 201.69  2.76326 721.903     27.906   721.903     27.906   205.077    120         120.89      120         
1 1 1 14 14 29 o 4  270.146 3.16858 1294.96     42.8701  1294.96     42.8701  238.53     330         90.1403     330         
1 1 1 14 14 30 o 17 383.433 3.94755 2609.29     75.8177  2609.29     75.8177  284.131    360         19.9798     360         
1 1 1 14 14 31 o 13 44.1739 3.32305 35.7573     7.147    35.7573     7.147    15.4231    30          63.1684     30          
1 1 1 14 14 32 f 0  114.669 2.82384 233.953     16.1827  233.953     16.1827  113.261    240         0           0           
1 1 1 14 14 33 f 0  12.6534 5.26393 3.24228     5.66305  3.24228     5.66305  66.022     270         0           0           
1 1 1 14 14 34 o 9  229.472 2.97325 934.547     34.1659  934.547     34.1659  142.708    300         40.4006     120         
1 1 1 14 14 35 o 8  109.783 2.47506 214.294     13.5856  214.294     13.5856  91.8191    330         46.9938     330         
1 1 1 14 14 36 o 9  129.005 2.48532 295.669     16.0406  295.669     16.0406  49.541     180         83.3574     8.09513e-06 
1 1 1 14 14 37 o 9  494.931 5.06968 4351.96     125.684  4351.96     125.684  358.319    30          18.0352     30          
1 1 1 14 14 38 o 12 82.5874 2.60865 121.641     10.7475  121.641     10.7475  40.0313    60          14.9789     60          
1 1 1 14 14 39 o 9  213.649 2.58905 809.955     27.7022  809.955     27.7022  190.727    270         81.15       270         
1 1 1 14 14 40 o 3  428.363 3.96424 3257.71     85.0676  3257.71     85.0676  319.002    120         37.2129     120         
1 1 1 14 14 41 o 3  10.7741 4.86944 0.348321    5.87295  0.348321    5.87295  24.1569    150         49.8168     150         
1 1 1 14 14 42 o 13 149.56  2.36851 397.163     17.732   397.163     17.732   141.047    180         73.4023     180         
1 1 1 14 14 43 f 0  331.808 3.49906 1954.89     58.1542  1954.89     58.1542  197.783    30          0           0           
1 1 1 14 14 44 o 10 245.765 2.80689 1072.12     34.5501  1072.12     34.5501  237.162    60          132.817     60          
1 1 1 14 14 45 f 0  41.8917 3.95954 32.7837     7.89685  32.7837     7.89685  28.6669    90          0           0           
1 1 1 14 14 46 o 6  193.723 2.57189 666.345     24.9488  666.345     24.9488  132.199    120         3.45728     300         
1 1 1 14 14 47 o 16 37.6249 4.40935 27.13       7.62826  27.13       7.62826  0.60527    150         26.0741     330         
1 1 1 14 14 48 o 5  134.723 2.3878  322.545     16.0984  322.545     16.0984  114.315    1.98717e-06 43.3214     1.98717e-06 
1 1 1 14 14 49 o 9  72.7073 2.70343 94.5824     9.78782  94.5824     9.78782  38.9445    210         21.1895     30          
1 1 1 14 14 50 o 5  46.2133 3.45157 39.1905     7.76991  39.1905     7.76991  17.2299    60          10.5163     240         
1 1 1 14 14 51 o 3  10.7898 4.89762 0.193332    6.02134  0.193332    6.02134  12.1938    90.0001     26.0034     90.0001     
1 1 1 14 14 52 o 1  103.751 2.91086 192.086     15.0804  192.086     15.0804  59.1333    300         22.8736     120         
1 1 1 14 14 53 o 7  20.1719 6.73574 10.6991     7.69435  10.6991     7.69435  9.21754    150         25.0251     150         
1 1 1 14 14 54 o 4  132.54  2.49455 312.594     16.5426  312.594     16.5426  104.7      360         30.1466     360         
1 1 1 14 14 55 o 10 8.91651 4.26888 -2.81038    5.64915  -2.81038    5.64915  6.30878    29.9999     13.2747     29.9999     
1 1 1 14 14 56 o 12 117.871 2.36045 247.321     13.9179  247.321     13.9179  42.6345    240         73.1782     60          
1 1 1 14 14 57 o 3  16.4828 5.9887  7.16053     6.2999   7.16053     6.2999   4.17376    270         12.5737     270         
1 1 1 14 14 58 o 17 40.4624 4.87284 31.6951     9.0209   31.6951     9.0209   0.0653424  300.002     53.8685     120         
1 1 1 14 14 59 f 0  12.4132 5.53467 1.34357     7.29323  1.34357     7.29323  18.9535    150         0           0           
1 1 1 14 14 60 o 7  13.4477 5.77542 3.101       7.24806  3.101       7.24806  12.9688    180         34.9838     180         
1 1 1 14 14 61 o 11 94.6771 2.66443 160.308     12.5962  160.308     12.5962  70.4913    30          15.7551     30          
1 1 1 14 14 62 o 14 38.0431 5.09579 28.6166     8.7003   28.6166     8.7003   24.8805    60          2.32375     59.9999     
1 1 1 14 14 63 o 12 36.0518 5.84197 26.7932     9.19236  26.7932     9.19236  11.8301    90          23.3134     270         
1 1 1 14 14 64 o 18 26.1934 6.55455 16.3334     7.82169  16.3334     7.82169  8.47161    120         2.48366     300         
1 1 1 14 14 65 f 0  19.3152 6.80926 10.0954     8.01019  10.0954     8.01019  6.98618    330         0           0           
1 1 1 14 14 66 o 13 11.6497 5.50672 -2.70803    8.85577  -2.70803    8.85577  8.58737    360         23.281      360         
1 1 1 14 14 67 o 3  29.8463 7.57052 21.5819     10.3512  21.5819     10.3512  7.03718    30          24.0018     210         
1 1 1 14 14 68 o 11 99.6703 3.35143 179.209     16.6534  179.209     16.6534  78.4731    240         28.3637     240         
1 1 1 14 14 69 o 11 15.5689 6.69328 4.57746     9.7564   4.57746     9.7564   25.1787    270         69.9699     270         
1 1 1 14 14 70 o 7  101.581 3.05419 185.939     15.4838  185.939     15.4838  73.9739    120         17.8957     120         
1 1 1 14 14 71 o 5  77.2372 3.41014 108.587     13.0802  108.587     13.0802  46.9957    330         4.50879     150         
1 1 1 14 14 72 o 16 112.903 2.95967 229.701     16.6936  229.701     16.6936  69.6538    180         4.10934     8.65522e-06 
1 1 1 14 14 73 f 0  45.1154 5.47156 40.5086     11.2795  40.5086     11.2795  6.30891    210         0           0           
1 1 1 14 14 74 o 7  10.4264 5.11142 -6.97575    9.25531  -6.97575    9.25531  6.15305    240         17.1905     240         
1 1 1 14 14 75 o 10 45.4846 6.43278 42.7949     13.0109  42.7949     13.0109  23.2407    270         10.5873     90          
1 1 1 14 14 76 o 12 24.4216 8.53974 17.4856     12.5528  17.4856     12.5528  1.59887    120         32.9752     120         
1 1 1 14 14 77 o 15 11.6826 5.69067 -6.84262    11.0268  -6.84262    11.0268  11.3467    330         33.0666     330         
1 1 1 14 14 78 o 10 17.9888 7.65952 7.54039     12.5228  7.54039     12.5228  3.26697    180         6.6171      7.81708e-06 
1 1 1 14 14 79 o 5  13.3052 6.38362 -4.70491    12.7686  -4.70491    12.7686  2.45528    210         13.4935     210         
1 1 1 14 14 80 o 15 66.3816 5.26922 85.2205     16.9621  85.2205     16.9621  40.3952    60          0.745129    240         
1 1 1 14 14 81 o 8  14.5479 6.74279 0.51195     12.2609  0.51195     12.2609  2.57175    90          14.8412     90          
1 1 1 14 14 82 o 4  10.4287 5.23209 -13.0107    11.5252  -13.0107    11.5252  4.7901     300         12.8291     300         
1 1 1 14 14 83 o 1  24.1389 8.92669 18.881      14.1684  18.881      14.1684  4.0812     150         17.0591     330         
1 1 1 14 14 84 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 0  0  o 1  137.335 4.86998 336.725     33.3241  336.725     33.3241  71.9015    360         270.819     360         
1 1 1 15 0  1  o 14 2462.09 36.4843 108653      4497.17  108653      4497.17  1794.48    60          24.589      59.9999     
1 1 1 15 0  2  o 8  513.631 5.13156 4678.07     132.028  4678.07     132.028  312.183    120         119.157     300         
1 1 1 15 0  3  o 2  333.169 3.74582 1968.43     62.5063  1968.43     62.5063  64.0716    9.07133e-05 55.9366     9.07133e-05 
1 1 1 15 0  4  o 11 1056.55 8.95739 19799.2     474.122  19799.2     474.122  783.461    60          37.9915     60          
1 1 1 15 0  5  o 17 122.909 2.18929 268.178     13.4655  268.178     13.4655  100.041    120         369.531     120         
1 1 1 15 0  6  o 16 370.107 3.2576  2428.32     60.3995  2428.32     60.3995  261.085    180         13.1055     1.95811e-06 
1 1 1 15 0  7  o 12 409.322 3.54903 2970.18     72.776   2970.18     72.776   330.261    60          68.7382     60          
1 1 1 15 0  8  f 0  1085.23 9.38042 20890       509.985  20890       509.985  890.237    300         0           0           
1 1 1 15 0  9  o 11 341.115 3.3082  2062.99     56.5286  2062.99     56.5286  279.362    360         66.1902     360         
1 1 1 15 0  10 o 9  804.152 6.99418 11467       281.765  11467       281.765  517.376    240         126.24      60          
1 1 1 15 0  11 o 5  670.172 6.13546 7963.97     205.982  7963.97     205.982  554.226    300         141.455     300         
1 1 1 15 0  12 o 16 1052.28 8.76165 19638.9     461.896  19638.9     461.896  754.208    180         8.96912     9.94944e-06 
1 1 1 15 0  13 f 0  383.208 3.55204 2603.47     68.1876  2603.47     68.1876  62.6008    240         0           0           
1 1 1 15 0  14 f 0  636.611 5.54744 7185.65     176.92   7185.65     176.92   514.209    300         0           0           
1 1 1 15 0  15 o 12 130.563 2.26809 302.592     14.82    302.592     14.82    28.541     180         41.1115     360         
1 1 1 15 0  16 o 1  1147.68 9.81571 23366.4     564.365  23366.4     564.365  918.832    240         187.832     240         
1 1 1 15 0  17 o 4  1269.58 10.4587 28596.2     665.215  28596.2     665.215  1032.56    300         241.718     300         
1 1 1 15 0  18 o 10 425.243 4.29324 3206.44     91.4499  3206.44     91.4499  183.834    2.44957e-06 242.485     180         
1 1 1 15 0  19 o 16 321.54  3.5196  1833.35     56.6833  1833.35     56.6833  201.107    240         58.6491     60          
1 1 1 15 0  20 o 12 530.856 4.74527 4996.46     126.195  4996.46     126.195  390.992    120         21.8906     120         
1 1 1 15 0  21 o 12 1935.84 16.4387 66589.5     1594.25  66589.5     1594.25  1493.83    180         219.016     180         
1 1 1 15 0  22 o 18 817.654 7.15974 11856.7     293.277  11856.7     293.277  582.034    240         3.95626     59.9997     
1 1 1 15 0  23 o 17 456.299 4.22713 3691.59     96.6246  3691.59     96.6246  234.856    120         181.302     300         
1 1 1 15 0  24 o 3  1348.83 11.5524 32294       780.634  32294       780.634  1219.08    6.18795e-07 516.248     6.18795e-07 
1 1 1 15 0  25 f 0  264.665 3.11645 1242.27     41.3091  1242.27     41.3091  287.005    60          0           0           
1 1 1 15 0  26 o 16 94.4668 2.49516 158.788     11.7749  158.788     11.7749  106.18     300         321.489     300         
1 1 1 15 0  27 o 11 480.615 4.51051 4095.89     108.595  4095.89     108.595  385.485    1.79307e-06 89.0424     1.79307e-06 
1 1 1 15 0  28 f 0  605.151 5.30887 6493.89     160.945  6493.89     160.945  365.582    240         0           0           
1 1 1 15 0  29 o 16 420.925 3.70821 3141.32     78.1947  3141.32     78.1947  331.813    300         68.2364     300         
1 1 1 15 0  30 o 5  180.544 2.47749 578.247     22.3968  578.247     22.3968  32.8034    180         20.0463     180         
1 1 1 15 0  31 o 9  507.193 4.47821 4561.59     113.785  4561.59     113.785  402.215    240         89.3905     240         
1 1 1 15 0  32 o 14 68.029  2.46839 82.6533     8.36443  82.6533     8.36443  71.1295    120         211.437     120         
1 1 1 15 0  33 o 4  402.874 3.60181 2877.92     72.6933  2877.92     72.6933  307.058    5.05306e-06 48.1499     5.05307e-06 
1 1 1 15 0  34 f 0  349.561 3.40175 2166.81     59.5663  2166.81     59.5663  202.705    240         0           0           
1 1 1 15 0  35 o 3  706.401 5.85963 8852.43     207.371  8852.43     207.371  360.524    300         267.593     120         
1 1 1 15 0  36 o 15 839.948 6.91802 12521.5     291.113  12521.5     291.113  705.029    180         236.816     180         
1 1 1 15 0  37 o 9  89.9186 2.26429 143.822     10.1739  143.822     10.1739  18.1478    240         46.2676     60          
1 1 1 15 0  38 o 14 34.9029 3.20513 22.6585     5.34559  22.6585     5.34559  27.207     300         62.6298     300         
1 1 1 15 0  39 o 6  110.363 2.175   216.343     12.0083  216.343     12.0083  35.7615    180         6.42167     180         
1 1 1 15 0  40 o 8  191.361 2.6744  649.75      25.6246  649.75      25.6246  71.5498    240         121.943     60          
1 1 1 15 0  41 o 17 112     2.24661 222.837     12.5868  222.837     12.5868  53.2523    300         26.8564     120         
1 1 1 15 0  42 o 17 246.571 3.03159 1078.6      37.4349  1078.6      37.4349  110.283    360         119.42      180         
1 1 1 15 0  43 o 5  66.4959 2.27372 78.9098     7.53636  78.9098     7.53636  3.14609    60          65.2163     60          
1 1 1 15 0  44 o 8  138.154 2.29767 338.819     15.888   338.819     15.888   12.4514    120         164.678     300         
1 1 1 15 0  45 o 10 136.954 2.25005 332.946     15.424   332.946     15.424   127.434    360         80.5742     360         
1 1 1 15 0  46 o 17 32.1812 3.41989 19.5602     5.14796  19.5602     5.14796  8.52684    240         21.8717     240         
1 1 1 15 0  47 o 16 300.254 3.15456 1599.26     47.443   1599.26     47.443   211.803    300         14.6602     300         
1 1 1 15 0  48 o 18 629.458 5.67444 7036.85     178.933  7036.85     178.933  436.246    360         17.4183     360         
1 1 1 15 0  49 o 7  115.682 2.31544 237.754     13.399   237.754     13.399   58.5937    240         38.4984     60          
1 1 1 15 0  50 o 6  141.812 2.43096 357.082     17.2534  357.082     17.2534  130.632    120         77.3654     120         
1 1 1 15 0  51 o 4  52.4914 2.98682 49.7893     7.73633  49.7893     7.73633  2.12367    180         29.8322     180         
1 1 1 15 0  52 o 10 516.374 5.42464 4737.16     140.307  4737.16     140.307  366.449    60          39.1541     60          
1 1 1 15 0  53 o 8  117.426 2.5277  245.104     14.8436  245.104     14.8436  94.7685    300         42.4363     300         
1 1 1 15 0  54 o 18 143.151 2.67735 364.041     19.1767  364.041     19.1767  99.969     0           8.93633     0           
1 1 1 15 0  55 o 12 84.87   2.57131 128.392     10.8905  128.392     10.8905  40.2736    60          25.2199     240         
1 1 1 15 0  56 o 14 39.3116 3.94359 29.0218     7.31843  29.0218     7.31843  32.3524    300         103.199     300         
1 1 1 15 0  57 o 1  129.551 2.7812  298.426     18.0188  298.426     18.0188  74.5442    180         22.3416     8.65057e-06 
1 1 1 15 0  58 o 2  181.457 2.85996 584.804     25.978   584.804     25.978   125.51     240         11.6416     240         
1 1 1 15 0  59 o 3  311.897 3.78577 1728.29     59.134   1728.29     59.134   249.111    120         88.092      120         
1 1 1 15 0  60 o 7  107.292 2.70405 204.956     14.4973  204.956     14.4973  77.4352    1.58203e-07 14.453      1.58203e-07 
1 1 1 15 0  61 o 11 89.8229 2.61617 143.838     11.7309  143.838     11.7309  60.3615    60          4.14976     60          
1 1 1 15 0  62 o 11 189.59  2.75368 638.566     26.1382  638.566     26.1382  139.006    300         31.2004     300         
1 1 1 15 0  63 o 17 58.8706 3.07229 62.5238     8.948    62.5238     8.948    29.2296    180         11.9409     8.59351e-06 
1 1 1 15 0  64 f 0  148.598 2.53054 392.522     18.8199  392.522     18.8199  44.4661    240         0           0           
1 1 1 15 0  65 o 3  113.927 2.59301 231.109     14.7697  231.109     14.7697  92.9352    300         39.1448     300         
1 1 1 15 0  66 o 4  40.1728 5.13129 31.4314     9.33036  31.4314     9.33036  6.54778    1.54924e-08 25.2504     180         
1 1 1 15 0  67 o 4  51.5436 2.9838  48.1493     7.58451  48.1493     7.58451  22.885     240         15.5118     60          
1 1 1 15 0  68 o 9  39.5854 5.56956 31.0952     9.8122   31.0952     9.8122   14.3453    300         3.36229     120         
1 1 1 15 0  69 o 11 96.1719 3.30119 165.766     15.8245  165.766     15.8245  73.9631    360         25.8606     360         
1 1 1 15 0  70 o 10 45.1008 4.9037  38.8559     10.3051  38.8559     10.3051  26.891     60          1.92389     240         
1 1 1 15 0  71 o 2  198.569 3.22542 703.542     32.0583  703.542     32.0583  137.089    120         24.087      120         
1 1 1 15 0  72 o 8  179.58  3.29046 576.161     29.5675  576.161     29.5675  111.509    360         2.26352     180         
1 1 1 15 0  73 o 10 43.5285 5.25915 36.8703     10.4676  36.8703     10.4676  31.3511    240         11.8662     240         
1 1 1 15 0  74 o 10 16.0225 6.56396 5.89528     8.5864   5.89528     8.5864   5.60475    300         20.2045     300         
1 1 1 15 0  75 o 10 38.5497 5.54537 29.8345     9.48007  29.8345     9.48007  2.60894    180         1.76104     180         
1 1 1 15 0  76 o 11 12.2282 5.63185 -0.472172   8.35918  -0.472172   8.35918  9.7858     60          26.1417     60          
1 1 1 15 0  77 o 8  10.8926 5.1499  -2.46295    7.75222  -2.46295    7.75222  4.52392    300         11.7534     300         
1 1 1 15 0  78 o 3  23.6295 7.49468 14.8844     9.46894  14.8844     9.46894  3.7245     180         18.7157     8.66174e-06 
1 1 1 15 0  79 o 11 68.3649 3.96317 85.7599     13.361   85.7599     13.361   41.3429    60          0.608439    240         
1 1 1 15 0  80 o 18 16.0102 6.66653 5.81171     9.09753  5.81171     9.09753  6.60859    120         29.5334     120         
1 1 1 15 0  81 o 19 55.8466 4.58095 58.8211     12.3717  58.8211     12.3717  41.618     1.86831e-06 15.7973     1.86831e-06 
1 1 1 15 0  82 o 5  37.5762 6.67405 30.432      10.8702  30.432      10.8702  27.2161    60          10.6851     60          
1 1 1 15 0  83 o 8  65.754  4.23886 80.4161     13.6872  80.4161     13.6872  58.6979    120         38.7268     120         
1 1 1 15 0  84 o 12 20.4733 8.02305 11.7102     12.0835  11.7102     12.0835  2.03452    360         25.561      360         
1 1 1 15 0  85 o 9  17.7037 7.69091 6.25277     13.185   6.25277     13.185   2.29589    60          18.5401     60          
1 1 1 15 0  86 o 15 80.9242 4.38363 121.444     17.5315  121.444     17.5315  52.9109    120         10.3234     120         
1 1 1 15 0  87 o 4  95.2525 5.19464 170.33      24.4484  170.33      24.4484  54.3481    2.53405e-06 3.1749      180         
1 1 1 15 0  88 f 0  15.2917 7.2349  -2.79013    15.3486  -2.79013    15.3486  1.12973    60.0003     0           0           
1 1 1 15 0  89 o 1  14.4707 6.95403 -5.3772     15.2781  -5.3772     15.2781  1.38519    120         9.3282      120         
1 1 1 15 0  90 o 14 15.8109 7.45524 -1.33877    16.0577  -1.33877    16.0577  0.308149   360         2.76854     360         
1 1 1 15 0  91 o 1  38.5242 12.4178 49.7673     26.0153  49.7673     26.0153  23.436     240         10.343      240         
1 1 1 15 0  92 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 1  0  o 11 123.419 2.68609 270.668     16.578   270.668     16.578   11.6445    180         74.6731     360         
1 1 1 15 1  1  o 9  1413.37 13.5857 35535.4     936.584  35449.5     987.219  1108.03    253.461     175.619     253.461     
1 1 1 15 1  2  o 14 706.699 6.50434 8826.99     240.551  8881.96     219.615  320.223    346.379     374.048     166.379     
1 1 1 15 1  3  o 15 999.179 8.89005 17638.9     473.144  17781.5     415.011  837.313    246.987     238.138     246.987     
1 1 1 15 1  4  o 12 1136.79 9.82222 22729.6     582.14   23131.9     535.573  830.429    234.817     22.6582     234.817     
1 1 1 15 1  5  o 8  514.92  4.41032 4666.71     115.866  4731.79     111.677  297.687    242.153     135.6       62.1526     
1 1 1 15 1  6  o 15 568.593 4.79225 5717.35     141.325  5743.06     131.585  306.485    283.885     197.58      103.885     
1 1 1 15 1  7  o 17 1227.38 9.77124 26577.4     621.943  26883.8     579.072  884.613    171.017     0.652045    171.015     
1 1 1 15 1  8  o 13 356.766 3.37742 2272.61     63.6722  2238.61     56.9592  314.947    45.6817     152.679     45.6817     
1 1 1 15 1  9  o 15 788.172 6.6766  10957.8     273.594  11070.8     253.339  607.541    130.362     87.4679     130.362     
1 1 1 15 1  10 o 12 353.596 3.30925 2232.91     60.7122  2198.48     56.5237  217.865    44.9579     52.8478     224.958     
1 1 1 15 1  11 o 15 509.706 4.67141 4500.55     126.074  4710.1      111.773  309.174    56.4027     103.319     236.403     
1 1 1 15 1  12 o 3  490.547 4.19711 4239.04     106.764  4290.65     99.4161  317.541    31.4219     57.2707     211.422     
1 1 1 15 1  13 o 9  921.198 7.28365 14922.4     353.017  15175.3     318.272  710.772    108.607     102.665     108.607     
1 1 1 15 1  14 o 9  775.365 6.43234 10741.5     254.547  10577.2     245.307  595.079    38.5592     83.9408     38.5592     
1 1 1 15 1  15 o 16 1445.4  11.6844 37356.7     861.949  36847.3     830.67   1130.21    352.987     185.469     352.987     
1 1 1 15 1  16 o 1  691.638 5.90059 8518.39     204.514  8443.12     204.522  503.363    58.9214     23.4756     58.9213     
1 1 1 15 1  17 o 2  330.208 3.28787 1949.18     54.4037  1915.48     54.4091  177.513    359.064     98.6283     179.064     
1 1 1 15 1  18 o 7  825.264 7.3863  12130.3     298.725  12026.9     312.025  625.073    154.303     75.958      154.303     
1 1 1 15 1  19 f 0  35.5888 2.87734 18.3759     4.91637  27.5816     4.98337  24.4533    301.86      0           0           
1 1 1 15 1  20 o 12 875.547 7.20291 13710.9     310.081  13480.6     321.783  717.106    313.813     191.494     313.813     
1 1 1 15 1  21 f 0  682.593 5.71766 8281.93     199.179  8239.44     191.946  661.75     317.786     0           0           
1 1 1 15 1  22 o 10 786.309 6.59596 10991.1     269.737  10937.7     249.756  683.485    199.801     258.195     199.801     
1 1 1 15 1  23 o 12 284.305 2.92412 1453.42     42.43    1411.53     40.8957  222.925    1.99308     96.314      1.99308     
1 1 1 15 1  24 o 4  1174.09 9.65504 24555.3     568.086  24394       568.082  950.833    96.8153     237.249     96.8153     
1 1 1 15 1  25 o 1  151.683 2.43758 395.995     18.5262  419.589     18.5203  42.1999    338.68      38.5156     158.68      
1 1 1 15 1  26 o 14 565.606 5.09417 5657.44     138.25   5686.29     150.314  417.745    260.746     47.2296     260.746     
1 1 1 15 1  27 o 2  1031.7  8.69403 18766.7     440.455  19028.9     458.483  733.764    219.032     10.3686     219.032     
1 1 1 15 1  28 o 18 670.32  5.84605 7993.56     192.4    7944.81     200.262  481.833    263.731     24.34       263.731     
1 1 1 15 1  29 o 15 546.833 5.00367 5268.38     137.113  5336.54     137.125  403.962    237.446     46.6187     237.446     
1 1 1 15 1  30 o 2  682.394 6.04257 8283.99     197.813  8238.29     215.059  518.853    87.5843     82.7383     87.5843     
1 1 1 15 1  31 o 6  486.107 4.37325 4161.39     102.37   4218.32     110.595  418.089    86.795      165.203     86.795      
1 1 1 15 1  32 o 8  148.361 2.4096  383.751     16.8151  396.471     18.9816  1.882      24.1794     185.803     204.179     
1 1 1 15 1  33 o 10 668.264 5.7364  7912.62     188.213  7935.75     195.938  467.428    163.694     2.49274     163.693     
1 1 1 15 1  34 o 11 475.143 4.23871 3991.65     96.9696  4015.5      104.761  412.869    358.653     171.534     358.653     
1 1 1 15 1  35 o 6  100.546 2.26504 180.748     10.9332  177.962     11.8379  25.3727    26.0923     17.9183     206.092     
1 1 1 15 1  36 f 0  445.749 4.14137 3427.94     90.6341  3621.36     94.4015  290.386    0.946619    0           0           
1 1 1 15 1  37 o 4  261.692 2.82897 1225.54     35.628   1202.51     38.488   210.76     235.921     75.7496     235.921     
1 1 1 15 1  38 o 2  143.849 2.22205 359.399     15.7217  374.187     16.3168  91.2836    246.33      30.7659     246.33      
1 1 1 15 1  39 o 9  148.198 2.36575 389.349     17.9291  389.25      17.2036  52.9809    132.279     80.513      312.279     
1 1 1 15 1  40 o 13 338.991 3.45861 2046.34     56.2458  2029.67     61.1423  231.087    2.23015     3.0723      2.23015     
1 1 1 15 1  41 o 9  351.152 3.43161 2215.21     59.1734  2158.79     61.5418  221.39     206.771     34.1635     26.7709     
1 1 1 15 1  42 o 19 309.526 3.28981 1688.54     53.0937  1709.71     48.8503  210.476    214.421     3.30993     214.421     
1 1 1 15 1  43 o 1  134.309 2.33682 320.566     15.3782  319.186     16.0569  95.4068    307.717     55.391      307.717     
1 1 1 15 1  44 o 6  299.45  3.04794 1558.51     45.7224  1622.26     45.7431  227.191    340.405     51.2085     340.405     
1 1 1 15 1  45 o 14 287.212 2.99723 1434.91     43.1232  1491.24     43.1458  185.994    111.739     14.7098     291.739     
1 1 1 15 1  46 o 15 42.8778 2.92018 31.3019     6.27974  34.5527     6.08858  28.1348    73.2872     88.4341     73.2872     
1 1 1 15 1  47 o 10 286.086 3.02341 1433.34     41.5223  1470.09     45.1356  225.022    77.555      68.8598     77.555      
1 1 1 15 1  48 o 3  226.923 2.81278 943.635     31.9795  883.355     31.9689  152.344    164.124     5.5486      164.124     
1 1 1 15 1  49 o 19 339.43  3.38464 2030.45     55.1023  2058.21     59.9725  277.208    39.1405     101.922     39.1405     
1 1 1 15 1  50 o 6  344.931 3.33719 2114.02     56.5884  2108.27     58.7607  265.774    136.978     72.0364     136.978     
1 1 1 15 1  51 o 15 215.018 2.75621 814.916     28.8479  825.118     30.5363  119.205    202.674     43.4571     22.6743     
1 1 1 15 1  52 o 1  45.5574 3.16181 37.954      7.51405  36.4111     6.72816  32.1203    23.1049     104.707     23.1049     
1 1 1 15 1  53 o 19 304.269 3.55011 1667.32     55.4828  1619.72     52.7795  209.317    147.254     16.9847     147.254     
1 1 1 15 1  54 o 7  181.347 2.84447 565.159     27.4508  602.025     24.0069  133.188    231.52      35.7592     231.52      
1 1 1 15 1  55 o 16 375.276 4.14284 2484.91     79.9253  2520.71     75.8127  242.199    290.503     11.5046     110.503     
1 1 1 15 1  56 o 13 205.495 3.22676 730.966     34.195   768.719     32.1661  93.7407    259.689     80.221      79.6893     
1 1 1 15 1  57 f 0  85.7819 2.95207 129.192     12.5872  132.689     12.7175  64.741     65.2567     0           0           
1 1 1 15 1  58 o 10 216.19  3.01153 838.207     32.6088  821.711     32.6435  131.306    349.771     18.2485     169.771     
1 1 1 15 1  59 o 17 193.949 2.88765 675.144     28.061   660.964     28.0699  136.526    310.091     23.524      310.091     
1 1 1 15 1  60 o 13 285.105 3.33483 1462.21     44.1277  1428.38     50.8427  202.856    47.8838     35.4124     47.8838     
1 1 1 15 1  61 o 4  144.013 2.86388 371.169     18.8294  366.477     22.2953  100.733    333.736     20.2961     333.736     
1 1 1 15 1  62 o 14 161.13  2.6982  455.61      20.5989  467.132     22.9397  97.5768    258.608     9.89511     78.6081     
1 1 1 15 1  63 o 1  243.819 2.95742 1038.35     33.5761  1076.83     38.6018  173.358    45.7538     33.6133     45.7538     
1 1 1 15 1  64 o 9  85.1947 2.47895 126.528     10.4342  131.953     10.6884  37.8139    192.585     27.5509     12.5853     
1 1 1 15 1  65 o 2  40.2685 4.2169  29.109      9.2243   30.1564     7.07135  3.73126    20.1274     27.4693     200.127     
1 1 1 15 1  66 o 1  195.935 2.90085 683.07      29.3203  684.814     27.6193  141.733    24.0111     35.8335     24.0111     
1 1 1 15 1  67 o 11 60.7259 3.45527 70.9781     10.6283  61.7984     10.2095  35.3475    117.563     6.14031     117.563     
1 1 1 15 1  68 o 11 173.307 2.88007 548.473     26.5966  523.012     23.3922  117.807    179.289     17.2116     179.289     
1 1 1 15 1  69 o 6  13.9412 4.51592 -3.07947    7.00883  -7.19503    7.34694  15.7209    214.29      40.0326     214.29      
1 1 1 15 1  70 o 15 37.1008 4.92088 23.593      9.84465  27.8378     7.57362  13.775     224.449     10.8831     44.4486     
1 1 1 15 1  71 o 16 84.3192 3.17233 119.786     14.5959  135.899     11.711   62.479     258.554     23.1136     258.554     
1 1 1 15 1  72 o 9  79.3412 3.54802 113.099     14.9448  114.298     13.0412  46.1779    148.893     3.96022     328.893     
1 1 1 15 1  73 o 9  53.628  4.09052 56.0474     11.0251  49.3662     10.6002  22.3674    284.457     18.4333     104.457     
1 1 1 15 1  74 o 2  43.7127 4.84955 40.2721     10.7647  31.4739     9.76797  16.4117    145.284     16.9746     325.284     
1 1 1 15 1  75 o 5  72.0053 3.56533 93.9161     13.0541  94.1644     12.5065  41.593     206.794     3.00654     26.7945     
1 1 1 15 1  76 o 4  39.2007 5.38173 26.791      10.1776  31.9671     10.1919  23.0336    291.645     7.54753     291.645     
1 1 1 15 1  77 o 8  90.073  3.46579 143.022     15.6462  151.29      15.5099  60.0955    251.53      11.7619     251.53      
1 1 1 15 1  78 o 14 70.7616 3.91714 91.7058     13.7081  91.9893     13.852   44.9832    287.932     5.8498      287.932     
1 1 1 15 1  79 o 18 36.5891 5.68456 20.3369     9.85079  32.5856     10.5568  20.7553    254.419     2.85297     254.419     
1 1 1 15 1  80 o 9  24.1518 6.07017 7.10894     9.12389  13.1756     9.57306  3.90733    259.301     33.7197     259.301     
1 1 1 15 1  81 o 3  44.9949 5.33917 43.8116     10.7793  35.0469     12.1608  25.4724    194.221     0.368288    194.221     
1 1 1 15 1  82 o 2  32.6027 5.77833 34.1615     10.0628  7.47344     11.24    15.4652    264.751     2.40895     84.751      
1 1 1 15 1  83 o 17 37.6735 5.97933 25.4793     10.6692  32.0394     11.3899  19.3402    169.916     1.12792     349.916     
1 1 1 15 1  84 o 16 22.0923 6.32611 8.14323     10.639   3.40051     11.3301  0.0826747  156.552     20.007      156.552     
1 1 1 15 1  85 o 8  31.9406 6.59099 31.1085     11.9836  9.98855     12.4371  13.175     356.699     4.96591     176.699     
1 1 1 15 1  86 o 15 41.4356 6.67483 40.9268     13.5023  30.6548     13.7066  25.3521    280.556     7.21817     280.556     
1 1 1 15 1  87 o 6  48.1951 7.119   50.7238     18.5726  47.5828     14.6587  27.2682    127.372     1.40823     127.372     
1 1 1 15 1  88 o 6  32.334  8.14881 31.6158     17.3981  12.4869     17.3949  10.1849    80.0453     13.1669     260.045     
1 1 1 15 1  89 o 5  24.2559 7.39154 8.48948     16.3257  2.68504     16.4348  4.6122     356.032     0.249533    176.032     
1 1 1 15 1  90 o 15 23.701  7.33601 5.19283     16.5611  4.5168      16.6305  2.81967    359.01      1.34886     179.01      
1 1 1 15 1  91 o 11 20.6726 6.89971 -26.4155    22.1788  -1.21719    17.0684  0.853616   115.359     6.51169     295.359     
1 1 1 15 1  92 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 2  0  o 18 897.16  7.23632 14272.5     325.253  14272.5     325.253  529.464    5.37297e-06 241.45      180         
1 1 1 15 2  1  o 6  200.649 2.46352 723.371     24.2999  703.485     25.2183  36.2729    15.3477     190.392     195.348     
1 1 1 15 2  2  o 16 619.937 5.49    6837.66     180.545  6787.56     160.033  470.202    157.552     56.5085     157.552     
1 1 1 15 2  3  o 2  1221.03 10.4344 26394.6     664.479  26526.8     611.253  1006.89    8.40965     252.373     8.40965     
1 1 1 15 2  4  o 4  674.964 6.13015 8031.91     202.814  8121.48     211.841  450.231    88.1416     65.86       268.142     
1 1 1 15 2  5  o 12 945.91  8.18248 15695.1     387.847  16045.2     387.874  656.149    124.234     49.3862     304.234     
1 1 1 15 2  6  o 1  792.776 6.95208 11094.7     276.193  11193.7     276.206  645.029    19.0292     154.122     19.0292     
1 1 1 15 2  7  f 0  452.964 4.36703 3597.04     101.227  3676.01     96.9332  267.297    46.5453     0           0           
1 1 1 15 2  8  o 19 568.329 5.3878  5729.57     153.446  5721.51     153.457  479.974    47.0181     155.546     47.0181     
1 1 1 15 2  9  o 1  1172.4  10.1256 24602.2     569.349  24186.9     618.992  1004.81    335.4       322.495     335.4       
1 1 1 15 2  10 o 3  93.9393 2.23221 152.91      10.6779  160.221     10.2922  79.924     101.746     257.949     101.746     
1 1 1 15 2  11 o 13 988.125 8.746   17225.6     442.352  17418.1     423.515  750.133    158.409     81.1457     158.409     
1 1 1 15 2  12 o 16 398.731 4.06016 2810.65     77.3576  2824.79     84.7528  284.403    243.458     13.6178     243.458     
1 1 1 15 2  13 o 14 111.967 2.1935  225.905     12.3102  218.752     12.2802  105.876    335.943     348.451     335.943     
1 1 1 15 2  14 o 7  421.115 3.79434 3145.42     81.54    3140.29     78.5853  323.878    300.795     62.2923     300.795     
1 1 1 15 2  15 o 17 322.922 3.23735 1854.13     54.3724  1841.78     50.3429  207.879    75.4952     24.2917     255.495     
1 1 1 15 2  16 o 7  336.982 3.33733 2015.11     58.4839  2009.7      54.1575  262.052    25.5063     70.3561     25.5064     
1 1 1 15 2  17 f 0  610.455 5.27933 6559.79     164.659  6652.49     158.242  505.82     278.791     0           0           
1 1 1 15 2  18 o 2  608.353 5.38125 6577.08     167.301  6544.71     160.767  370.507    89.4873     120.491     269.487     
1 1 1 15 2  19 o 7  184.487 2.49995 610.334     22.6303  595.944     23.5727  89.7425    317.171     14.7327     137.171     
1 1 1 15 2  20 o 1  605.876 5.24067 6523.43     159.111  6491.83     159.132  387.174    124.298     80.5429     304.298     
1 1 1 15 2  21 o 6  252.352 2.77682 1131.58     35.1092  1125.41     35.1243  95.5406    80.5901     141.785     260.59      
1 1 1 15 2  22 o 9  571.849 4.89762 5823.24     137.71   5770.91     142.925  492.112    270.596     188.505     270.596     
1 1 1 15 2  23 o 14 963.852 8.16795 16591.2     386.512  16380.1     402.284  772.909    225.893     180.019     225.893     
1 1 1 15 2  24 o 16 79.9319 2.25057 114.437     8.97776  112.36      9.01555  27.8532    214.231     85.7289     214.231     
1 1 1 15 2  25 o 19 687.072 5.85831 8464.05     201.706  8279.59     201.703  521.142    341.14      76.2451     341.14      
1 1 1 15 2  26 o 14 561.324 4.80819 5557.29     137.706  5615.34     132.731  408.209    237.735     31.8602     237.735     
1 1 1 15 2  27 f 0  815.089 6.81    11827.9     278.15   11747.8     278.191  555.289    47.9501     0           0           
1 1 1 15 2  28 o 11 122.129 2.22726 260.413     13.8359  268.44      13.4022  28.9698    310.507     37.6859     130.507     
1 1 1 15 2  29 o 10 432.45  3.90289 3296.65     86.109   3334.02     83.0088  226.654    30.9692     148.66      210.969     
1 1 1 15 2  30 o 14 641.438 5.69163 7421.54     182.92   7177.73     182.958  439.297    322.35      20.3288     142.35      
1 1 1 15 2  31 o 16 381.382 3.69398 2571.14     69.1793  2586.08     72.0033  288.19     311.313     52.763      311.313     
1 1 1 15 2  32 o 14 599.914 5.3767  6411.85     161.64   6358.4      161.65   449.76     196.634     62.5139     196.634     
1 1 1 15 2  33 o 8  392.144 3.65752 2706.95     69.0654  2745.99     74.6189  281.064    52.9279     22.0901     52.9279     
1 1 1 15 2  34 o 14 557.503 4.86693 5506.09     130.634  5521.92     141.13   467.614    103.367     161.489     103.367     
1 1 1 15 2  35 o 10 405.752 3.70943 2916.5      72.4617  2922.25     78.2857  296.737    324.763     34.8099     324.763     
1 1 1 15 2  36 o 2  497.865 4.52906 4332.47     106.062  4463.1      119.709  448.089    300.701     210.684     300.701     
1 1 1 15 2  37 o 10 513.15  4.63723 4647.08     111.88   4698.04     126.262  374.547    28.9315     40.4325     28.9315     
1 1 1 15 2  38 o 19 714.615 6.2766  8972.85     215.267  9177.26     234.086  543.219    152.704     96.706      152.704     
1 1 1 15 2  39 o 8  272.402 3.1263  1316.56     40.6883  1314.93     44.5758  197.145    111.748     30.4945     111.748     
1 1 1 15 2  40 o 12 260.666 3.031   1201.32     36.8871  1208.3      42.1412  194.859    160.138     43.1195     160.138     
1 1 1 15 2  41 o 18 431.502 4.40821 3368.78     86.1044  3241.01     103.392  240.286    355.714     110.868     175.714     
1 1 1 15 2  42 o 9  208.368 2.59874 729.984     26.4679  810.558     27.8028  125.82     275.868     24.4894     95.8683     
1 1 1 15 2  43 o 7  190.908 2.54782 630.27      22.8577  662.24      25.8635  120.423    177.25      10.9055     357.25      
1 1 1 15 2  44 o 18 140.723 2.36978 344.969     15.6568  357.231     17.7353  40.0548    70.0777     103.737     250.078     
1 1 1 15 2  45 o 12 185.544 2.51932 585.769     21.422   635.526     25.3932  70.9701    56.4657     104.64      236.466     
1 1 1 15 2  46 o 18 118.588 2.40144 243.18      13.8855  255.98      14.6307  24.0888    47.712      103.025     227.712     
1 1 1 15 2  47 o 8  111.098 2.38156 221.643     12.6173  216.449     13.827   48.5745    231.954     37.7406     51.9542     
1 1 1 15 2  48 o 3  120.291 2.46133 249.787     14.0834  263.89      15.556   22.4726    219.155     108.132     39.1553     
1 1 1 15 2  49 o 6  172.19  2.62527 542.474     23.2741  509.395     22.0389  116.521    272.91      12.4231     272.91      
1 1 1 15 2  50 o 14 125.636 2.34076 262.578     14.6804  297.946     14.7385  90.7546    246.344     56.8459     246.344     
1 1 1 15 2  51 o 6  54.0964 3.00487 63.8876     8.52501  41.7673     7.52979  0.530565   252.63      12.8411     72.6295     
1 1 1 15 2  52 o 14 223.44  2.9694  893.38      34.92    878.128     31.52    152.358    282.298     12.8756     282.298     
1 1 1 15 2  53 o 4  126.448 2.68828 294.299     18.0302  273.64      15.9976  62.7873    230.61      31.4838     50.6099     
1 1 1 15 2  54 o 7  164.347 2.60355 496.049     23.0034  462.481     19.8576  123.469    62.5636     40.5252     62.5636     
1 1 1 15 2  55 o 9  215.334 2.76029 835.875     31.1316  809.717     28.418   125.957    41.7222     28.9824     221.722     
1 1 1 15 2  56 o 11 90.0303 2.57365 151.784     11.9393  136.517     11.2384  33.0113    9.968       42.0825     189.968     
1 1 1 15 2  57 o 16 157.935 2.72619 441.538     20.7422  444.185     22.3669  124.375    46.0142     48.8892     46.0142     
1 1 1 15 2  58 o 16 73.8324 3.03693 98.434      11.4748  95.8671     10.9004  27.0837    96.9168     31.4647     276.917     
1 1 1 15 2  59 o 8  162.469 2.95985 451.554     25.3718  486.996     22.5833  86.993     192.617     34.8445     12.617      
1 1 1 15 2  60 o 14 115.807 2.70322 232.046     15.2558  244.975     16.0808  74.6369    32.8525     5.89747     32.8525     
1 1 1 15 2  61 o 14 252.201 2.97582 1116.88     37.5944  1144.75     37.6233  151.897    105.317     22.9793     285.317     
1 1 1 15 2  62 o 6  30.5491 4.88142 20.1834     7.65224  14.6915     6.9858   20.6172    268.95      68.5225     268.95      
1 1 1 15 2  63 o 4  232.198 3.24629 953.105     36.7828  967.415     38.7545  175.247    246.136     52.5976     246.136     
1 1 1 15 2  64 o 2  104.599 2.85927 194.709     14.5757  195.355     15.3351  75.8591    300.811     25.3022     300.811     
1 1 1 15 2  65 o 10 144.549 2.81148 374.754     19.8251  369.91      20.8481  94.365     214.779     7.24982     214.779     
1 1 1 15 2  66 o 13 148.589 2.88903 398.267     20.932   389.205     22.0237  125.577    216.139     66.8094     216.139     
1 1 1 15 2  67 o 10 85.7375 2.76475 132.944     12.0391  129.598     11.6571  36.8297    60.4906     31.7537     240.491     
1 1 1 15 2  68 o 17 118.425 2.63384 251.447     16.5438  248.912     14.6284  81.6007    51.5157     15.2588     51.5157     
1 1 1 15 2  69 o 11 37.4006 4.50033 31.1851     9.24716  21.1453     7.07563  1.08365    42.1767     45.1828     42.1766     
1 1 1 15 2  70 o 7  128.754 2.69743 306.023     18.4597  286.632     16.3002  72.9758    351.86      15.0511     171.86      
1 1 1 15 2  71 o 8  100.665 2.78406 185.647     15.0012  177.316     13.0007  75.0887    62.1958     26.6829     62.1958     
1 1 1 15 2  72 o 19 77.8519 2.98868 104.329     12.4988  113.643     10.5368  37.3677    238.317     20.3176     58.317      
1 1 1 15 2  73 o 4  36.7888 4.65077 28.7663     9.49663  22.2048     7.05116  16.1101    60.411      6.31951     240.411     
1 1 1 15 2  74 o 14 53.5236 3.63618 58.7629     10.0619  46.0104     9.1769   36.5721    47.6198     12.6014     47.6198     
1 1 1 15 2  75 o 1  36.371  5.40896 18.1066     9.24452  33.331      9.97907  8.61202    316.545     23.3032     136.545     
1 1 1 15 2  76 o 4  84.7243 3.43438 132.566     14.0227  127.603     14.9769  51.1733    113.913     0.0182174   113.903     
1 1 1 15 2  77 o 12 119.226 3.34566 242.552     18.7812  272.628     21.1358  71.6991    35.1234     1.87764     215.123     
1 1 1 15 2  78 o 1  39.4475 5.61244 31.4727     10.0369  28.9448     11.3493  23.658     155.647     4.64778     155.647     
1 1 1 15 2  79 o 7  36.8799 5.99886 21.756      10.0067  32.6684     11.8178  22.1234    327.958     5.78799     327.958     
1 1 1 15 2  80 o 7  22.5085 6.10164 4.59183     8.93664  10.5871     10.4622  5.89898    326.766     5.59927     146.766     
1 1 1 15 2  81 o 18 55.6691 4.63044 57.2846     11.8683  60.3225     13.4474  31.8694    50.8893     0.752329    230.889     
1 1 1 15 2  82 o 5  51.6418 4.93488 55.0556     11.4551  47.5851     13.11    35.7566    91.0962     13.7534     91.0962     
1 1 1 15 2  83 o 9  29.445  6.73201 17.9654     11.2824  17.2468     11.3724  10.1296    311.053     8.44129     131.053     
1 1 1 15 2  84 o 3  55.6505 5.15139 70.1388     13.6107  50.8263     13.9577  23.7263    120.158     16.1602     300.158     
1 1 1 15 2  85 o 12 22.9986 6.53434 0.635082    11.3039  12.317      12.3358  4.8426     130.745     2.35534     310.745     
1 1 1 15 2  86 o 14 25.8745 7.20219 19.5385     15.7031  0.688609    12.6887  9.20595    130.391     4.42943     310.391     
1 1 1 15 2  87 o 14 19.26   6.22839 -7.08261    15.0869  -3.11634    11.9004  2.75451    198.826     5.3876      18.8262     
1 1 1 15 2  88 o 8  35.5289 8.48293 30.6187     17.7457  28.1555     18.1413  11.047     286.268     15.7336     106.268     
1 1 1 15 2  89 o 5  27.4336 7.83104 20.9752     17.103   4.97012     17.1794  8.8206     151.246     0.540943    151.246     
1 1 1 15 2  90 o 15 39.4675 9.07515 57.5134     23.2336  25.6678     19.3492  20.5691    310.576     3.67444     310.576     
1 1 1 15 2  91 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 3  0  o 15 128.956 2.25517 295.197     14.554   295.197     14.554   25.5971    180         80.678      6.70101e-07 
1 1 1 15 3  1  o 10 1008.11 8.2235  18064.9     423.095  17987.7     407.704  874.236    6.59639     296.201     6.59639     
1 1 1 15 3  2  o 17 949.148 7.58561 15958.3     360.813  15995.3     360.817  733.818    131.764     100.1       131.764     
1 1 1 15 3  3  o 6  1195.47 9.65614 25332.2     567.684  25387.9     589.133  876.285    226.419     25.7435     226.419     
1 1 1 15 3  4  o 6  645.169 5.44158 7379.8      179.165  7377.36     172.651  419.61     254.335     84.9384     74.3354     
1 1 1 15 3  5  o 2  452.516 4.02485 3671.65     91.2744  3586.8      91.2633  266.791    145.958     107.218     325.958     
1 1 1 15 3  6  f 0  320.874 3.18476 1823.68     53.1434  1825.43     49.2027  146.186    223.614     0           0           
1 1 1 15 3  7  o 12 351.138 3.56098 2202.38     65.2411  2167.8      60.013   203.591    197.292     81.8139     17.2916     
1 1 1 15 3  8  o 6  1164.1  10.4865 24252.2     583.035  23858.6     638.717  923.139    160.191     168.089     160.191     
1 1 1 15 3  9  o 1  998.843 8.64413 17701.9     432.684  17697.7     432.7    691.736    124.947     54.7316     304.947     
1 1 1 15 3  10 o 11 446.54  4.33958 3536.39     94.9687  3531.78     99.2041  242.029    209.644     147.572     29.6442     
1 1 1 15 3  11 o 8  805.152 7.55212 11364.5     311.784  11631.2     297.293  651.923    332.677     151.152     332.677     
1 1 1 15 3  12 o 5  488.55  4.71844 4237.02     115.514  4224.21     115.532  342.284    210.658     4.69805     30.6581     
1 1 1 15 3  13 o 5  341.351 3.54437 2048.98     56.56    2081.04     64.5022  183.459    174.713     105.517     354.713     
1 1 1 15 3  14 o 8  914.801 7.97781 14774.2     333.965  14915.2     395.217  767.96     244.925     227.158     244.925     
1 1 1 15 3  15 o 10 406.427 3.84757 2955.51     79.9211  2899.66     76.8048  247.992    305.144     70.8051     125.144     
1 1 1 15 3  16 o 2  495.079 4.35231 4299.64     109.929  4389.22     105.951  462.969    278.564     240.918     278.564     
1 1 1 15 3  17 o 7  498.314 4.301   4410.73     109.373  4391.86     105.414  398.783    130.602     101.78      130.602     
1 1 1 15 3  18 o 4  533.619 4.71279 5008.7      126.009  5086.4      126.043  412.909    280.268     77.9099     280.268     
1 1 1 15 3  19 o 4  358.654 3.54399 2284.16     64.9517  2275.27     62.4247  261.615    151.695     38.0489     151.695     
1 1 1 15 3  20 o 6  393.858 3.77137 2779.59     75.9165  2719.29     72.9574  339.05     13.8226     149.151     13.8226     
1 1 1 15 3  21 o 11 374.158 3.59105 2461.18     68.6353  2501.21     65.9826  128.77     28.0599     261.62      208.06      
1 1 1 15 3  22 o 19 229.716 2.74435 932.107     32.847   938.173     30.2782  111.537    105.012     69.4026     285.012     
1 1 1 15 3  23 o 17 312.124 3.29119 1748.87     51.4612  1704.46     51.4926  139.25     177.843     147.017     357.843     
1 1 1 15 3  24 f 0  414.656 4.05383 3056        86.0379  3039.62     82.4107  217.51     65.1978     0           0           
1 1 1 15 3  25 o 2  404.149 3.84952 2911.17     76.3652  2879.4      79.517   175.925    138.434     211.325     318.434     
1 1 1 15 3  26 o 13 932.891 7.93122 15492.6     363.255  15408.6     378.138  765.011    69.3875     210.248     69.3875     
1 1 1 15 3  27 o 2  458.34  4.32053 3752.71     99.2289  3696.43     99.2459  243.079    192.763     154.904     12.7625     
1 1 1 15 3  28 o 4  221.184 2.75554 864.177     31.1739  869.94      29.8956  151.352    121.2       18.7835     121.2       
1 1 1 15 3  29 o 11 127.91  2.3947  292.901     15.3287  287.422     15.3437  49.2937    90.3557     23.0775     270.356     
1 1 1 15 3  30 o 17 356.141 3.52636 2288.04     61.6365  2209.32     64.1544  271.035    182.408     53.8054     182.408     
1 1 1 15 3  31 o 19 576.052 4.99358 5893.41     144.135  5879.35     144.178  425.717    60.8656     46.0684     60.8655     
1 1 1 15 3  32 o 14 159.428 2.36808 450.017     18.8902  450.926     18.9498  95.7252    259.327     0.183068    79.327      
1 1 1 15 3  33 o 12 649.701 5.50924 7500.77     179.349  7482.36     179.404  482.665    228.472     57.2166     228.472     
1 1 1 15 3  34 o 14 799.774 6.78786 11460       277.458  11269.7     266.625  664.842    328.789     211.83      328.789     
1 1 1 15 3  35 o 16 68.7258 2.32762 83.4096     7.72403  84.4075     8.2565   23.3858    152.792     106.163     152.792     
1 1 1 15 3  36 o 4  42.074  2.86973 28.8005     5.73742  34.6867     6.20779  9.86647    68.1796     24.9908     68.1796     
1 1 1 15 3  37 o 5  467.028 4.24394 3853.98     97.3178  3885.69     101.314  346.004    315.493     48.0475     315.493     
1 1 1 15 3  38 f 0  583.318 5.17468 5995.55     151.247  6087.93     151.284  327.497    294.287     0           0           
1 1 1 15 3  39 o 14 48.2812 2.82862 36.6995     6.16914  46.835      7.41524  37.3047    305.616     105.515     305.616     
1 1 1 15 3  40 o 2  80.6826 2.46672 122.243     9.73277  109.174     10.1169  14.5591    307.078     37.0785     127.078     
1 1 1 15 3  41 o 12 341.474 3.32816 2053.3      54.7243  2082.99     59.1272  240.626    182.227     16.1007     182.227     
1 1 1 15 3  42 o 19 92.6398 2.25319 149.17      10.1738  155.49      10.717   38.4002    123.581     24.7307     303.581     
1 1 1 15 3  43 o 11 74.8748 2.36369 93.7668     8.23825  105.582     9.46238  22.8501    174.537     14.6259     354.537     
1 1 1 15 3  44 o 17 137.522 2.38512 326.155     15.6852  344.562     17.1879  55.0322    258.914     67.7989     78.9138     
1 1 1 15 3  45 o 17 267.34  2.84961 1267.89     37.3989  1267.11     38.9406  199.115    241.494     40.0913     241.494     
1 1 1 15 3  46 o 5  325.924 3.41211 1822.52     52.0689  1948.06     59.3514  242.044    149.933     45.0837     149.933     
1 1 1 15 3  47 o 5  337.88  3.37359 1991.01     54.7463  2060.58     59.4713  211.367    294.899     32.827      114.899     
1 1 1 15 3  48 o 1  145.321 2.57833 361.05      17.3947  388.461     20.1229  78.8381    95.4417     27.3118     275.442     
1 1 1 15 3  49 o 10 111.433 2.4853  223.204     13.5301  217.64      14.1753  59.2841    240.345     13.4698     60.3451     
1 1 1 15 3  50 o 9  233.102 3.32899 983.065     34.9817  945.616     42.2946  159.747    151.966     12.7295     151.966     
1 1 1 15 3  51 o 4  310.044 3.28667 1621.08     48.6819  1792.89     53.4838  209.197    173.124     5.88028     173.124     
1 1 1 15 3  52 o 1  162.695 2.5335  444.898     20.2463  494.682     21.058   93.9459    146.128     20.8482     326.128     
1 1 1 15 3  53 o 3  347.053 3.80761 2159.79     66.1847  2118.86     66.2559  260.962    208.81      61.6478     208.81      
1 1 1 15 3  54 o 2  133.66  2.57933 321.624     16.8799  312.72      17.6206  55.187     78.8257     59.7294     258.826     
1 1 1 15 3  55 o 12 61.3979 2.949   71.7656     9.04766  62.8225     8.96532  6.13512    353.99      52.9882     173.99      
1 1 1 15 3  56 o 3  57.1391 3.09382 70.7735     9.23485  47.0658     8.2358   6.1986     252.026     0.321367    72.0263     
1 1 1 15 3  57 f 0  118.474 2.60324 256.697     16.2397  242.132     14.6297  81.5922    120.847     0           0           
1 1 1 15 3  58 o 13 142.197 2.64765 374.951     19.7314  343.87      17.979   88.49      152.371     4.14491     332.371     
1 1 1 15 3  59 o 16 224.098 3.01656 927.983     37.2634  857.633     30.3701  125.378    92.1438     40.9351     272.144     
1 1 1 15 3  60 o 6  287.042 3.38256 1495.3      50.9132  1437        46.371   191.722    189.654     9.54734     189.654     
1 1 1 15 3  61 o 10 235.502 3.04889 974.486     34.0314  998.537     37.8735  156.933    0.835226    9.09267     0.835225    
1 1 1 15 3  62 o 8  208.72  3.09475 771.322     34.1204  779.453     30.4976  129.518    232.347     9.85495     52.3469     
1 1 1 15 3  63 o 9  81.1033 3.07109 123.982     12.4147  111.129     12.4283  38.8877    201.348     19.7833     21.3479     
1 1 1 15 3  64 o 18 129.353 2.92306 295.351     18.9511  301.272     18.8953  96.1425    210.862     31.5428     210.862     
1 1 1 15 3  65 o 18 32.1131 5.05308 15.3974     8.23558  23.2914     7.69416  8.69853    98.9158     44.5248     98.9158     
1 1 1 15 3  66 o 5  118.693 2.92697 260.566     17.3983  242.552     17.3531  81.6271    103.416     15.6762     103.416     
1 1 1 15 3  67 o 13 96.5326 2.8545  167.364     14.186   165.607     13.3624  35.3548    342.08      50.1252     162.08      
1 1 1 15 3  68 o 13 16.195  4.75695 3.60669     6.45847  -2.35889    6.62535  0.215847   199.678     0.698953    199.678     
1 1 1 15 3  69 o 8  88.4629 2.78433 154.064     12.1659  126.642     12.3473  62.2833    214.073     15.9828     214.073     
1 1 1 15 3  70 o 17 34.8566 4.40586 22.3895     7.63811  22.8519     7.18045  5.81608    210.842     26.7577     30.8422     
1 1 1 15 3  71 o 15 28.0512 5.1836  16.2937     8.01023  13.6438     6.73175  2.4084     80.8523     0.382355    260.852     
1 1 1 15 3  72 o 1  67.3097 3.09424 84.9869     10.2273  78.3678     10.5057  23.4136    46.9431     35.1689     226.943     
1 1 1 15 3  73 o 3  38.9169 4.25082 30.9761     8.21609  25.4064     7.80648  22.347     281.65      7.05888     281.65      
1 1 1 15 3  74 o 7  30.7434 5.22387 21.2372     8.51417  15.1545     7.44304  8.86508    358.84      2.47539     358.84      
1 1 1 15 3  75 o 18 73.5637 3.25868 114.631     11.9829  82.4455     11.7041  42.7745    32.6161     2.99756     212.616     
1 1 1 15 3  76 o 7  64.6141 3.53499 76.1329     11.7592  75.8715     10.94    42.4944    269.594     8.44156     269.594     
1 1 1 15 3  77 o 5  90.6697 3.72339 148.201     15.0621  151.92      18.4729  65.1274    195.64      20.8283     195.64      
1 1 1 15 3  78 o 14 56.2333 4.43554 49.7382     11.4116  69.138      13.1129  33.8063    338.101     1.63894     338.101     
1 1 1 15 3  79 o 15 87.7355 3.5511  147.945     14.8611  134.141     16.1058  41.7619    211.331     22.219      31.3307     
1 1 1 15 3  80 o 7  44.5685 5.27982 31.2671     10.7657  46.596      11.8859  27.2847    324.546     4.61691     324.546     
1 1 1 15 3  81 o 10 24.8166 6.21118 6.63554     9.29258  15.6178     10.4194  5.11041    277.476     13.9962     97.4758     
1 1 1 15 3  82 o 8  16.0362 5.18398 -5.45635    9.47388  -3.94736    9.17748  0.533582   12.2614     6.77855     12.2614     
1 1 1 15 3  83 o 13 26.0172 6.50278 19.3329     11.4547  4.79018     10.878   2.54137    115.06      20.8493     295.06      
1 1 1 15 3  84 o 4  57.3052 4.9644  65.0124     13.9246  61.8647     13.982   24.1836    246.527     17.5646     66.527      
1 1 1 15 3  85 o 4  20.3558 6.15958 -2.33887    10.9437  5.74497     11.6838  2.50936    87.174      2.29263     267.174     
1 1 1 15 3  86 o 4  30.2001 7.61823 14.8129     16.4295  21.3728     13.3618  13.7901    2.39104     1.27166     182.391     
1 1 1 15 3  87 o 18 20.0539 6.38096 6.92154     15.4659  -13.2748    11.692   2.36365    263.135     11.4478     83.1349     
1 1 1 15 3  88 o 5  22.7944 7.07725 8.2424      16.0283  -4.68043    15.5814  5.43198    28.784      5.10282     208.784     
1 1 1 15 3  89 o 5  28.1208 8.05947 13.1389     17.2052  18.1667     18.1879  9.49533    207.78      1.34827     27.7796     
1 1 1 15 3  90 o 10 23.4106 7.5678  -6.1225     23.254   3.90584     17.2562  2.89022    43.2824     3.93112     223.282     
1 1 1 15 3  91 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 4  0  o 2  877.993 7.30571 13670.3     321.35   13670.3     321.35   733.086    180         191.735     180         
1 1 1 15 4  1  o 7  143.766 2.1965  369.393     16.1247  363.099     15.5241  44.617     195.666     47.3888     15.6657     
1 1 1 15 4  2  o 17 479.787 4.14467 4066.62     99.654   4093.06     99.6554  397.58     332.413     118.695     332.413     
1 1 1 15 4  3  o 16 300.127 2.9738  1579.97     44.7252  1612.56     44.7269  171.491    112.451     69.1097     292.451     
1 1 1 15 4  4  o 8  686.532 5.60009 8363.07     192.67   8348        192.672  503.579    19.3601     22.6167     19.3601     
1 1 1 15 4  5  o 17 310.004 3.0969  1705.27     48.9957  1700.8      47.2144  276.995    108.834     151.224     108.834     
1 1 1 15 4  6  o 8  596.422 5.04878 6319.66     148.075  6291.29     153.667  443.057    318.532     35.0713     318.532     
1 1 1 15 4  7  o 2  713.056 5.93994 8993.13     216.139  9035.51     208.287  416.627    159.92      191.03      339.92      
1 1 1 15 4  8  o 17 609.909 5.1764  6587.9      155.259  6600.19     161.127  397.992    301.332     75.6283     121.332     
1 1 1 15 4  9  o 4  602.604 5.12173 6339.14     157.442  6535.6      151.734  495.448    163.861     134.274     163.861     
1 1 1 15 4  10 o 13 1190.72 9.61822 24843.4     584.268  25484.2     563.069  873.224    332.947     29.8281     332.947     
1 1 1 15 4  11 f 0  148.908 2.4203  395.913     18.4573  389.923     17.6617  173.218    9.2751      0           0           
1 1 1 15 4  12 o 16 695.661 6.4865  8574.2      245.807  8588.44     204.537  602.963    67.2521     215.823     67.2521     
1 1 1 15 4  13 o 16 627.935 5.9241  7140.28     177.553  6843.24     194.482  337.049    312.468     222.14      132.468     
1 1 1 15 4  14 o 14 1180.65 10.3089 24797.6     596.501  24701.6     623.054  864.821    82.2096     32.66       82.2096     
1 1 1 15 4  15 o 14 449.588 4.18371 3646.14     92.3109  3519.63     96.0866  320.061    22.5814     12.4031     22.5813     
1 1 1 15 4  16 o 13 359.031 3.5294  2284.92     62.207   2284.09     64.7722  266.963    352.365     46.4584     352.365     
1 1 1 15 4  17 o 16 266.649 2.96747 1307.17     38.798   1213.73     40.3938  160.018    107.785     27.014      287.785     
1 1 1 15 4  18 f 0  791.435 6.7807  11150.8     263.466  11068.2     274.256  561.405    104.233     0           0           
1 1 1 15 4  19 o 9  183.828 2.42277 599.673     21.4143  597.97      23.1869  73.2276    265.185     63.4993     85.1847     
1 1 1 15 4  20 o 8  159.385 2.22513 451.579     17.4218  448.74      18.1154  56.5493    359.712     25.4613     179.712     
1 1 1 15 4  21 o 14 724.109 5.89068 9259        213.741  9337.97     213.78   516.859    271.937     6.74934     271.937     
1 1 1 15 4  22 o 14 373.045 3.41937 2446.59     65.0682  2486.43     62.7376  287.643    175.432     65.9444     175.432     
1 1 1 15 4  23 o 11 470.012 4.20258 3871.44     98.9562  3961.09     99.0121  359.355    225.922     63.6003     225.922     
1 1 1 15 4  24 o 7  723.976 6.09114 9244.16     220.957  9351.16     221.029  548.43     205.969     72.4073     205.969     
1 1 1 15 4  25 o 1  202.42  2.53742 728.336     25.7047  723.939     25.7747  142.582    83.28       45.4426     83.28       
1 1 1 15 4  26 f 0  595.42  5.36759 6307.5      160.124  6268.7      160.201  362.939    224.496     0           0           
1 1 1 15 4  27 o 7  74.6298 2.39299 93.0077     9.00724  104.99      8.8067   15.2915    175.263     69.8309     175.263     
1 1 1 15 4  28 o 12 391.664 3.70163 2733.61     72.6251  2705.48     72.6835  258.585    225.967     26.9915     45.9666     
1 1 1 15 4  29 o 4  300.21  3.17514 1604.89     46.7751  1590.31     48.7336  207.411    228.14      5.35629     228.139     
1 1 1 15 4  30 o 12 147.01  2.40635 384.419     17.7053  381.643     17.7509  38.3009    116.994     109.935     296.994     
1 1 1 15 4  31 o 16 721.004 6.37532 9240.21     230.331  9220.85     230.381  553.363    300.182     93.7306     300.182     
1 1 1 15 4  32 o 16 648.671 5.91871 7452.25     196.503  7488.37     188.191  513.052    138.678     117.378     138.678     
1 1 1 15 4  33 o 12 269.1   2.95822 1284.68     39.859   1282.82     39.9283  198.873    110.264     34.5391     110.264     
1 1 1 15 4  34 o 15 296.395 3.19867 1519.97     47.4647  1595.69     47.5396  167.058    157.007     71.9428     337.007     
1 1 1 15 4  35 o 12 253.211 2.87314 1114.52     36.4191  1159.07     36.4888  135.482    289.99      72.2189     109.99      
1 1 1 15 4  36 o 4  249.2   2.972   1088.16     37.8564  1114.02     36.3378  201.081    118.932     72.7645     118.932     
1 1 1 15 4  37 o 6  226.571 2.77364 915.124     31.4587  905.115     31.5262  189.648    152.987     87.1149     152.987     
1 1 1 15 4  38 o 14 242.226 2.7772  1010.91     34.2847  1070.02     33.0742  160.248    118.501     3.87682     298.501     
1 1 1 15 4  39 o 11 159.418 2.50628 440.175     18.5471  461.02      21.4522  96.0615    221.315     10.8844     41.3151     
1 1 1 15 4  40 o 7  150.824 2.47514 413.895     19.3986  392.801     18.0187  72.9755    109.257     49.2609     289.257     
1 1 1 15 4  41 o 10 449.345 4.14037 3495.3      91.3274  3672.83     95.1554  342.519    336.7       67.65       336.7       
1 1 1 15 4  42 o 16 77.1827 2.40708 107.859     8.8636   103.797     9.67461  21.7962    68.1176     138.014     68.1176     
1 1 1 15 4  43 o 9  209.249 2.93349 762.051     29.1937  791.118     32.3006  150.704    152.298     23.5077     152.298     
1 1 1 15 4  44 o 13 90.9297 2.42754 148.442     10.8584  145.176     11.2177  41.8085    106.327     12.8609     286.327     
1 1 1 15 4  45 o 6  428.541 4.26103 3222.22     89.3161  3300.07     93.6933  348.843    342.418     115.295     342.418     
1 1 1 15 4  46 o 14 196.083 2.73737 682.153     25.6503  681.603     28.0908  117.636    88.0617     23.5775     268.062     
1 1 1 15 4  47 o 3  74.9847 2.55505 102.022     9.14562  97.8796     9.96179  19.5686    55.7452     33.4686     235.745     
1 1 1 15 4  48 o 3  197.211 2.55047 669.13      24.0997  710.594     26.3139  109.901    310.056     40.0317     130.056     
1 1 1 15 4  49 o 1  137.294 2.5521  346.905     15.6969  322.19      19.0879  28.0165    79.2769     121.75      259.277     
1 1 1 15 4  50 o 15 190.582 2.46351 621.63      23.0475  667.019     24.012   79.6064    338.824     91.7641     158.824     
1 1 1 15 4  51 o 12 141.808 2.38157 357.083     16.5498  356.155     17.2908  102.995    10.9838     31.4087     10.9838     
1 1 1 15 4  52 o 14 54.0645 2.924   51.4883     8.11232  52.8465     7.59409  2.83778    278.2       23.0482     98.2003     
1 1 1 15 4  53 o 3  83.1546 2.14073 109.031     8.80916  137.346     8.92532  18.7814    314.98      60.5236     134.98      
1 1 1 15 4  54 o 19 236.677 3.05315 980.903     37.9266  1007.96     34.3569  133.18     274.959     45.6313     94.9593     
1 1 1 15 4  55 o 5  86.7256 2.575   127.031     11.6737  140.535     10.5497  53.1325    357.34      10.1445     357.34      
1 1 1 15 4  56 o 11 207.929 2.77207 756.5       28.9388  778.593     28.8258  107.481    23.969      57.758      203.969     
1 1 1 15 4  57 o 5  214.02  2.86042 823.309     32.1007  803.702     29.2211  127.938    236.324     23.9389     56.3235     
1 1 1 15 4  58 o 4  291.033 3.21736 1547.36     49.0993  1464.67     44.7419  207.95     24.9052     34.3959     24.9051     
1 1 1 15 4  59 o 19 185.762 2.88009 645.557     30.4858  581.759     22.9389  114.625    250.128     11.202      70.128      
1 1 1 15 4  60 o 5  41.5652 4.54517 45.2539     11.3444  20.3566     7.12038  3.70858    60.9295     25.8848     240.93      
1 1 1 15 4  61 o 5  89.3766 3.34118 155.311     15.5069  130.538     14.3118  56.2166    279.035     5.09308     279.035     
1 1 1 15 4  62 o 7  66.2793 2.4451  76.4029     8.4785   80.1967     7.66212  17.2861    339.235     44.3633     159.235     
1 1 1 15 4  63 o 10 81.9522 3.00959 137.27      13.3535  103.808     11.3025  56.7677    166.755     19.4077     166.755     
1 1 1 15 4  64 o 16 129.75  3.07947 307.847     20.0933  293.188     19.8926  109.217    7.17985     58.8642     7.17985     
1 1 1 15 4  65 o 1  89.0724 3.03304 143.689     12.2938  139.958     14.5692  57.4293    133.49      7.13633     133.49      
1 1 1 15 4  66 o 16 16.3942 4.91118 -2.10968    6.2349   2.79469     7.79632  8.57721    235.465     22.6351     235.465     
1 1 1 15 4  67 o 11 94.622  2.81324 166.635     12.6597  153.513     13.8634  51.5269    142.26      15.3887     322.26      
1 1 1 15 4  68 f 0  76.0794 3.02937 96.7372     10.9546  111.113     12.0605  33.728     139.406     0           0           
1 1 1 15 4  69 o 3  80.049  3.08674 118.061     12.002   112.083     12.6366  43.796     67.2866     11.0853     247.287     
1 1 1 15 4  70 o 12 77.8026 3.02873 105.495     11.149   112.095     12.3743  50.663     191.503     6.45212     191.503     
1 1 1 15 4  71 o 2  65.7449 3.18514 85.6527     10.1728  70.6373     10.5626  40.5914    217.079     2.28476     217.079     
1 1 1 15 4  72 o 19 60.8879 3.48755 62.401      10.7519  72.2396     10.2509  41.6531    42.21       11.7679     42.21       
1 1 1 15 4  73 o 19 95.5871 2.81798 173.37      12.9929  155.056     13.8476  63.3451    162.777     9.50445     162.777     
1 1 1 15 4  74 o 5  83.3262 3.02937 128.159     12.244   122.12      12.9369  54.4227    150.38      7.6912      150.38      
1 1 1 15 4  75 o 17 38.8336 4.57882 27.2251     8.67068  29.447      8.50883  22.4681    147.238     3.83187     147.238     
1 1 1 15 4  76 o 19 48.5652 3.89786 39.3354     9.44608  47.8023     9.04576  22.534     243.289     11.9338     63.2892     
1 1 1 15 4  77 o 9  16.1377 4.77889 -1.83789    7.268    3.1771      6.06382  0.635029   307.958     9.57907     307.958     
1 1 1 15 4  78 o 7  17.1506 5.03045 4.1035      8.26455  0.416699    5.84043  0.669868   222.417     7.46483     42.4173     
1 1 1 15 4  79 o 9  36.6597 5.48873 27.9244     10.0529  25.0205     9.49152  15.1816    48.1225     10.7166     228.122     
1 1 1 15 4  80 o 14 40.5545 5.57298 28.1941     10.5644  37.0807     11.275   21.1728    123.965     2.90151     303.965     
1 1 1 15 4  81 o 15 48.2027 4.94444 49.1529     11.1698  40.6534     11.824   24.8813    57.7489     5.42623     237.749     
1 1 1 15 4  82 o 8  71.6538 4.2046  90.2509     14.87    102.869     15.0048  41.4301    351.371     1.18149     171.371     
1 1 1 15 4  83 o 1  24.2517 6.3494  2.45181     10.8161  16.1149     10.8601  4.19596    47.6704     1.25686     227.67      
1 1 1 15 4  84 o 5  35.925  6.64299 24.2569     12.1407  29.799      12.1324  14.1536    106.289     10.2245     286.289     
1 1 1 15 4  85 o 17 26.9777 7.41912 14.0223     15.965   11.2857     12.8216  10.9527    317.985     1.64887     317.985     
1 1 1 15 4  86 o 2  22.9288 7.09037 -0.982993   15.6216  4.90015     15.4607  5.01919    114.447     0.372041    294.447     
1 1 1 15 4  87 o 14 42.6661 8.21466 51.804      18.3415  32.8784     18.5732  19.7814    59.1192     7.02696     239.119     
1 1 1 15 4  88 o 19 22.5574 7.11132 -4.27801    15.9308  6.12075     16.8732  4.39816    47.0782     3.88989     227.078     
1 1 1 15 4  89 o 2  19.8746 6.56043 -11.8652    15.5789  -2.46655    16.6663  0.803147   133.943     3.28884     313.943     
1 1 1 15 4  90 x 7  ?       ?       ?           ?        ?           ?        13.4212    187.382     0           0           
1 1 1 15 4  91 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 5  0  o 7  75.9423 2.26941 102.735     8.60172  102.735     8.60172  241.776    7.73966e-06 585.731     7.73967e-06 
1 1 1 15 5  1  o 19 391.484 3.62284 2709.18     72.3733  2723.05     69.7475  385.329    301.445     245.425     301.445     
1 1 1 15 5  2  o 9  142.469 2.25092 361.56      15.7575  357.768     16.3748  38.1808    280.952     27.5831     100.952     
1 1 1 15 5  3  o 15 683.227 5.6141  8250.75     192.218  8300.36     192.227  558.266    304.406     138.301     304.406     
1 1 1 15 5  4  o 14 431.931 3.83072 3304.76     82.9157  3308.14     82.923   250.047    148.573     110.567     328.573     
1 1 1 15 5  5  o 9  522.908 4.53671 4839.75     116.664  4853.31     121.07   372.752    189.427     2.55465     189.428     
1 1 1 15 5  6  o 11 902.902 7.52899 14547.2     340.669  14372.4     340.668  661.119    95.7965     21.2463     95.7965     
1 1 1 15 5  7  o 13 1584.6  12.7117 44601.8     1027.94  44648.4     990.59   1131.56    353.709     30.5151     173.709     
1 1 1 15 5  8  o 3  220.474 2.558   859.04      27.7259  863.68      28.7928  94.8275    12.8549     96.2857     192.855     
1 1 1 15 5  9  o 7  664.856 5.58003 7741.15     189.258  7932.86     182.413  531.403    348.37      113.92      348.37      
1 1 1 15 5  10 o 15 679.797 5.65587 8197.93     196.211  8188.32     189.089  568.621    146.173     168.024     146.173     
1 1 1 15 5  11 o 4  767.897 6.35921 10468.3     235.087  10444.3     253.962  555.393    292.168     10.5612     292.168     
1 1 1 15 5  12 o 5  372.793 3.64528 2484.94     73.596   2441.23     62.229   266.103    294.391     19.2221     294.391     
1 1 1 15 5  13 o 2  761.684 6.53162 10229.9     254.214  10347.6     244.262  573.695    99.6549     58.6423     99.6549     
1 1 1 15 5  14 o 5  674.841 5.91146 8063.77     191.411  8086.53     208.103  592.706    216.687     228.514     216.687     
1 1 1 15 5  15 o 19 317.032 3.26736 1770.94     52.9174  1791.61     50.8717  192.97     244.679     42.5514     64.6786     
1 1 1 15 5  16 o 5  660.168 5.9112  7823.5      187.137  7633.48     203.429  454.907    170.57      28.9079     350.57      
1 1 1 15 5  17 f 0  444.496 4.32177 3568.32     94.1058  3436.79     98.2844  376.541    41.8593     0           0           
1 1 1 15 5  18 o 4  559.484 5.03419 5517.77     141.129  5581.71     141.165  415.84     283.975     42.178      283.975     
1 1 1 15 5  19 o 5  659.69  5.74955 7751.7      186.204  7683.35     193.84   451.442    183.223     34.3062     3.22333     
1 1 1 15 5  20 f 0  713.094 6.33445 9170.39     216.566  8870.44     235.415  382.178    118.74      0           0           
1 1 1 15 5  21 o 13 760.863 6.69906 10480.7     244.299  10063.2     265.61   501.165    323.018     81.0436     143.018     
1 1 1 15 5  22 o 2  252.719 2.86775 1149.37     35.5445  1114.55     37.0494  183.469    352.005     38.0644     352.005     
1 1 1 15 5  23 o 13 322.547 3.30999 1884.37     52.3728  1804.1      54.5455  206.194    87.7353     31.1386     267.735     
1 1 1 15 5  24 o 19 829.423 6.90856 12243.2     287.132  12177.4     287.187  608.156    359.465     37.2406     359.465     
1 1 1 15 5  25 o 4  369.693 3.51838 2430.42     65.168   2415.1      65.2007  252.909    253.157     7.79718     73.1571     
1 1 1 15 5  26 o 11 438.025 4.00341 3412.63     87.8572  3390.91     87.9017  392.623    342.335     177.04      342.335     
1 1 1 15 5  27 o 17 359.916 3.54531 2337.92     62.5979  2255.4      65.2056  313.158    138.428     132.382     138.428     
1 1 1 15 5  28 o 15 294.58  3.2131  1619.86     45.2437  1458.83     49.2335  179.83     120.289     45.1774     300.289     
1 1 1 15 5  29 o 17 154.623 2.42684 454.707     18.2899  393.864     19.174   91.1598    221.868     3.51609     41.8684     
1 1 1 15 5  30 o 4  347.779 3.37161 2078.98     57.5432  2210.75     59.99    226.839    110.64      28.5648     290.64      
1 1 1 15 5  31 o 5  453.593 4.10276 3665.03     89.546   3633.26     96.8021  336.775    135.308     40.5846     135.308     
1 1 1 15 5  32 o 3  219.104 2.61721 851.366     27.5463  850.55      29.8801  140.062    325.617     12.2032     145.617     
1 1 1 15 5  33 o 12 178.958 2.54609 578.185     21.783   557.292     23.7977  141.728    84.1865     69.0759     84.1865     
1 1 1 15 5  34 f 0  214.989 2.63411 797.981     27.7584  841.016     29.0057  147.386    330.097     0           0           
1 1 1 15 5  35 o 2  475.858 4.60007 4093.43     102.153  3944.84     116.479  366.16     6.22319     72.3707     6.22319     
1 1 1 15 5  36 o 2  113.007 2.3586  217.253     12.9508  236.083     13.7385  51.2947    353.704     10.5987     173.704     
1 1 1 15 5  37 o 2  149.203 2.52681 397.268     18.8482  392.041     18.9374  103.628    119.131     29.9619     119.131     
1 1 1 15 5  38 o 5  195.22  2.75807 686.054     25.6258  665.451     28.2325  152.856    101.309     52.4837     101.309     
1 1 1 15 5  39 o 8  166.849 2.64241 488.002     21.5474  499.174     22.6383  95.4425    105.533     27.9539     285.533     
1 1 1 15 5  40 o 18 169.176 2.56451 506.425     21.2291  508.449     22.2455  87.0628    322.514     50.7543     142.514     
1 1 1 15 5  41 f 0  482.327 4.45546 4171.56     103.056  4089.88     112.047  312.031    106.512     0           0           
1 1 1 15 5  42 o 10 191.067 2.72752 628.363     26.0074  666.646     26.2143  80.4638    347.066     95.7446     167.066     
1 1 1 15 5  43 o 4  169.73  2.75846 494.111     22.0962  527.932     24.8218  65.2364    139.295     95.3209     319.295     
1 1 1 15 5  44 f 0  320.314 3.61137 1766.78     59.1455  1875.62     56.6555  227.868    195.559     0           0           
1 1 1 15 5  45 o 9  281.84  3.16238 1377.6      43.6252  1441.17     45.7124  223.346    164.085     68.2197     164.085     
1 1 1 15 5  46 o 12 287.53  3.20025 1427.24     45.0367  1506.92     47.1982  173.29     322.904     41.2317     142.904     
1 1 1 15 5  47 o 3  341.471 3.39769 2000.12     56.9242  2139.58     59.3692  250.009    152.935     39.5202     152.935     
1 1 1 15 5  48 o 8  183.222 2.53914 582.989     22.7736  607.838     23.8575  123.679    62.9955     8.97083     62.9955     
1 1 1 15 5  49 o 13 85.5856 2.51581 125.736     10.4589  134.597     11.0777  12.6802    189.827     76.1538     9.82728     
1 1 1 15 5  50 o 18 257.616 3.02852 1112.85     41.3206  1244.1      36.3492  163.816    178.059     15.0892     358.059     
1 1 1 15 5  51 f 0  94.4369 2.43897 151.537     11.6661  165.38      11.3472  35.305     90.0857     0           0           
1 1 1 15 5  52 o 19 160.798 2.50511 437.086     19.6493  480.721     20.7269  86.0608    330.949     36.2254     150.949     
1 1 1 15 5  53 o 16 272.549 3.0717  1255.03     41.8756  1383.9      41.9635  189.148    132.837     17.1432     132.837     
1 1 1 15 5  54 o 15 146.876 2.65108 378.12      19.8168  387.828     19.1762  113.313    205.804     40.6561     205.804     
1 1 1 15 5  55 o 9  192     2.84936 660.179     28.7183  648.806     26.0714  129.555    59.4784     8.10767     59.4784     
1 1 1 15 5  56 o 6  95.2166 2.87134 161.072     14.4843  161.533     12.7987  65.9588    335.174     19.7916     335.174     
1 1 1 15 5  57 o 13 115.686 2.55737 249.739     15.9475  226.252     13.6659  65.4796    57.8456     15.051      237.846     
1 1 1 15 5  58 o 7  61.274  3.02682 68.1736     9.98475  65.957      8.44246  19.077     183.042     30.3168     3.04235     
1 1 1 15 5  59 o 9  163.374 2.74581 501.394     23.8361  448.045     21.1431  108.161    34.1293     5.91438     34.1293     
1 1 1 15 5  60 o 12 154.325 2.63422 429.55      22.5049  417.395     18.0296  84.5241    187.437     29.6618     7.43662     
1 1 1 15 5  61 o 9  188.687 2.7305  699.18      27.3555  570.544     24.3033  105.677    39.9473     32.7176     219.947     
1 1 1 15 5  62 o 14 138.752 2.46447 360.378     18.1295  324.938     16.1393  103.553    29.7482     32.0446     29.7482     
1 1 1 15 5  63 o 7  164.673 2.46606 503.41      21.422   461.757     19.2876  107.367    17.5358     4.51611     17.5358     
1 1 1 15 5  64 o 17 38.9843 4.24392 24.9601     8.71758  30.918      6.96205  6.49509    108.428     4.88603     288.428     
1 1 1 15 5  65 o 18 72.6262 2.67441 108.604     10.5959  80.8673     8.82616  43.9673    198.302     1.14054     198.302     
1 1 1 15 5  66 o 8  81.035  2.89161 127.907     11.9616  107.483     11.4208  58.2893    296.232     17.3787     296.232     
1 1 1 15 5  67 o 11 90.6554 3.01301 145.829     13.4013  148.581     13.8981  64.3205    329.869     16.2027     329.869     
1 1 1 15 5  68 o 18 79.859  3.08846 123.914     11.578   105.415     12.8397  42.5016    286.124     13.9415     106.124     
1 1 1 15 5  69 o 12 123.629 2.89714 278.011     16.3226  269.62      19.3407  85.118     266.557     15.1605     266.557     
1 1 1 15 5  70 o 18 36.873  5.23387 17.9597     8.29518  34.7803     10.5144  10.4199    339.66      20.1608     159.66      
1 1 1 15 5  71 o 5  112.013 3.02668 211.451     14.853   239.978     19.0137  68.5678    175.673     2.33755     355.673     
1 1 1 15 5  72 o 13 84.025  3.13721 138.822     12.0821  116.179     13.9153  58.5515    243.002     14.5539     243.002     
1 1 1 15 5  73 o 13 137     2.81853 330.586     18.5247  343.354     20.1269  75.0513    337.724     20.2804     157.724     
1 1 1 15 5  74 o 18 71.8235 3.14617 100.544     11.2224  86.2175     11.2568  44.0497    301.445     1.3113      301.445     
1 1 1 15 5  75 o 12 28.0627 5.42762 19.8879     8.00874  10.2407     8.21076  6.90108    121.93      2.32773     121.93      
1 1 1 15 5  76 o 8  58.7023 3.70157 67.5733     10.3084  58.9596     11.1111  30.5724    336.716     9.12189     156.716     
1 1 1 15 5  77 o 15 14.4696 4.58384 -4.25492    7.19326  -1.10513    6.61962  2.04275    41.4275     11.3658     41.4275     
1 1 1 15 5  78 o 5  49.4297 4.08345 45.2493     9.91972  46.0002     9.92935  22.8652    124.855     12.4577     304.855     
1 1 1 15 5  79 o 5  108.231 2.96409 209.869     15.8276  215.808     16.2663  62.7296    306.449     5.6169      126.449     
1 1 1 15 5  80 o 11 20.1944 5.91073 3.15839     7.93     4.82209     11.5028  1.85537    221.681     13.0238     41.6808     
1 1 1 15 5  81 o 11 68.3472 4.48634 87.7386     13.1289  89.0962     16.9469  51.6276    206.187     23.9835     206.187     
1 1 1 15 5  82 o 17 26.4265 6.82019 17.3379     11.2616  6.54164     13.3642  4.86248    146.813     16          326.813     
1 1 1 15 5  83 o 19 52.7113 5.86005 58.6933     13.4718  52.2985     16.0737  34.4273    208.061     9.91129     208.061     
1 1 1 15 5  84 o 17 28.9434 7.06587 20.4377     11.7352  12.0115     13.9804  12.9508    339.707     0.192647    159.707     
1 1 1 15 5  85 o 19 31.0243 7.35628 6.4106      16.5626  29.394      13.6651  15.7755    173.512     6.96121     173.512     
1 1 1 15 5  86 o 19 24.3082 7.191   5.37942     16.545   8.54128     13.0472  7.00644    176.451     7.57119     356.451     
1 1 1 15 5  87 o 14 68.1407 5.93755 115.099     21.4423  76.7929     18.1111  48.4093    282.896     19.6786     282.896     
1 1 1 15 5  88 o 2  42.3406 8.22331 44.1326     20.8245  42.7782     15.5282  23.7348    156.926     3.97055     156.926     
1 1 1 15 5  89 o 9  28.9465 8.20539 17.7267     17.379   19.4272     18.8317  2.86029    273.981     0.586963    273.981     
1 1 1 15 5  90 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 6  0  o 17 89.6643 2.17298 142.955     9.73813  142.955     9.73813  172.08     180         462.762     180         
1 1 1 15 6  1  o 13 676.318 6.00748 8057.45     194.98   8163.19     211.992  417.18     120.447     137.708     300.447     
1 1 1 15 6  2  o 4  1206.68 9.55166 25700.5     577.575  25992.6     577.621  851.919    114.257     43.5032     294.257     
1 1 1 15 6  3  o 13 1584.2  12.472  44460.1     990.114  44754.9     990.204  1170.74    142.87      44.1798     142.87      
1 1 1 15 6  4  o 3  818.344 6.87222 11839.7     270.795  11914.3     292.519  576.924    264.692     25.0281     84.6917     
1 1 1 15 6  5  o 7  568.052 4.8715  5755.89     136.066  5684.44     141.208  427.313    162.744     45.9525     162.744     
1 1 1 15 6  6  o 6  381.507 3.60191 2571.51     68.8551  2587.53     68.8738  233.68     220.889     65.1332     40.8892     
1 1 1 15 6  7  o 16 843.219 7.17791 12677.7     297.15   12545.5     309.294  510.397    91.7518     194.483     271.752     
1 1 1 15 6  8  o 6  519.75  4.79404 4787.89     119.548  4789.52     129.975  324.192    335.228     90.2781     155.228     
1 1 1 15 6  9  o 5  266.742 2.83013 1275.42     37.1075  1246.41     38.5228  198.612    181.814     62.2224     181.814     
1 1 1 15 6  10 o 15 220.813 2.58613 881.709     28.069   846.539     29.1263  130.226    56.2259     67.6263     56.2259     
1 1 1 15 6  11 o 13 997.329 8.40468 17597.9     411.571  17705.9     428.445  737.389    205.902     39.0639     205.902     
1 1 1 15 6  12 o 6  804.137 7.01467 11476.4     282.658  11464.1     282.706  745.322    264.745     342.509     264.745     
1 1 1 15 6  13 o 7  703.812 6.23762 8720.25     228.897  8849.62     210.59   572.747    262.927     141.772     262.927     
1 1 1 15 6  14 o 5  738.354 6.23685 9680.81     221.688  9656.35     239.496  599.473    2.35282     144.726     2.35282     
1 1 1 15 6  15 o 5  668.148 5.81706 7879.48     182.751  7953.79     206.201  508.073    55.9809     64.0004     55.9809     
1 1 1 15 6  16 o 2  544.904 4.72907 5241.75     129.122  5286.29     129.154  282.536    326.521     210.164     146.521     
1 1 1 15 6  17 o 13 151.821 2.28608 413.393     17.3759  403.546     17.4087  41.8286    24.4293     87.2232     204.429     
1 1 1 15 6  18 o 2  686.188 5.8288  8356.66     200.42   8345.25     200.458  507.4      331.674     36.7662     331.674     
1 1 1 15 6  19 f 0  669.831 5.708   7942.3      191.588  7973.12     191.624  354.08     308.203     0           0           
1 1 1 15 6  20 o 6  228.545 2.79463 930.062     31.9977  921.359     32.0174  135.277    283.971     29.9331     103.971     
1 1 1 15 6  21 o 9  217.035 2.6811  864.151     28.5204  805.966     29.721   153.657    184.004     31.698      184.004     
1 1 1 15 6  22 o 12 315.33  3.18198 1766.28     48.2888  1758.57     52.193   127.659    330.18      184.759     150.18      
1 1 1 15 6  23 o 5  281.907 3.06029 1454.9      42.303   1363.05     44.0561  181.679    94.5414     22.3771     274.541     
1 1 1 15 6  24 o 9  629.423 5.61848 7003.74     177.177  7053.97     177.269  473.345    122.1       54.2522     122.1       
1 1 1 15 6  25 o 6  591.515 5.23789 6275.66     152.07   6138.9      158.32   400.195    84.3205     37.4237     264.32      
1 1 1 15 6  26 o 7  343.139 3.36145 2086.29     56.6067  2088.4      58.9778  294.863    316.531     117.831     316.531     
1 1 1 15 6  27 o 8  449.18  4.10347 3607.13     92.3486  3548.9      92.387   266.47     303.26      99.1565     123.26      
1 1 1 15 6  28 o 2  508.618 4.65404 4544.37     118.586  4633.92     118.659  374.885    296.903     34.0853     296.903     
1 1 1 15 6  29 o 11 106.426 2.24828 199.729     12.1662  202.124     11.7835  55.9478    263.352     249.073     263.352     
1 1 1 15 6  30 f 0  65.6315 2.63079 90.956      8.37042  63.4856     8.60094  27.2711    45.5635     0           0           
1 1 1 15 6  31 o 10 372.339 3.64062 2523.99     66.4727  2394.07     69.2535  257.526    9.00876     2.41263     189.009     
1 1 1 15 6  32 o 9  429.327 3.98933 3251        84.0603  3288.32     87.5851  287.442    280.378     23.9434     100.378     
1 1 1 15 6  33 o 1  122.186 2.31682 264.632     13.7806  265.01      14.5566  53.3687    250.945     33.9368     70.9447     
1 1 1 15 6  34 o 10 343.566 3.32081 2072.35     54.8942  2114.32     59.4096  209.578    188.147     55.5093     8.14744     
1 1 1 15 6  35 o 13 351.826 3.36525 2192.31     58.1903  2198.26     60.4595  307.23     82.6483     132.829     82.6483     
1 1 1 15 6  36 o 13 26.9428 4.54368 11.0002     6.26212  15.8057     5.92337  55.4454    223.917     122.26      223.917     
1 1 1 15 6  37 f 0  344.106 3.6125  2105.99     59.3583  2095.07     65.0863  190.186    308.708     0           0           
1 1 1 15 6  38 f 0  183.768 2.96555 614.673     25.6725  583.266     28.766   92.5378    326.596     0           0           
1 1 1 15 6  39 o 10 343.625 3.81232 2112.32     65.6209  2078.25     65.6754  263.777    258.055     54.902      258.055     
1 1 1 15 6  40 o 18 106.781 2.53244 199.164     13.1394  205.645     13.9242  64.3066    225.529     5.52576     225.529     
1 1 1 15 6  41 o 13 334.759 3.4949  1969.7      54.6154  2006.97     62.4527  260.428    249.363     63.0309     249.363     
1 1 1 15 6  42 o 16 404.509 4.19276 2828.64     78.691   2982.86     91.1248  317.779    197.983     81.0811     197.983     
1 1 1 15 6  43 o 19 348.139 3.62837 2107.9      60.2888  2194.43     66.2761  243.452    317.891     11.7576     317.891     
1 1 1 15 6  44 o 4  126.017 2.41397 287.826     14.0654  275.64      16.2701  59.4783    281.911     40.918      101.911     
1 1 1 15 6  45 o 16 274.207 3.03017 1329.55     38.9589  1338.17     44.1727  197.448    113.522     25.5864     113.522     
1 1 1 15 6  46 o 4  145.375 2.43213 374.238     16.4238  375.528     18.9135  84.2659    40.9717     17.7418     220.972     
1 1 1 15 6  47 o 15 143.419 2.47668 363.398     16.7981  366.382     18.741   25.3094    276.915     137.618     96.9149     
1 1 1 15 6  48 o 1  289.984 3.2401  1435.79     45.9481  1549.85     48.2322  215.414    218.191     42.264      218.191     
1 1 1 15 6  49 o 10 428.02  4.0637  3170.19     83.4847  3339.9      90.8384  316.217    332.072     54.481      332.072     
1 1 1 15 6  50 o 2  204.485 2.82241 720.986     28.8855  763.032     28.9445  106.173    275.108     58.3772     95.1076     
1 1 1 15 6  51 o 16 51.1079 3.22879 52.0625     7.91008  41.705      8.3113   1.10869    65.5151     31.1258     245.515     
1 1 1 15 6  52 o 3  40.2842 4.10864 23.262      8.1118   36.3466     7.51454  11.1319    126.75      49.6599     126.75      
1 1 1 15 6  53 o 11 108.333 2.72171 197.04      15.143   220.391     14.2634  50.4495    317.338     35.5936     137.338     
1 1 1 15 6  54 o 18 185.044 2.60228 616.999     24.6629  598.505     23.6008  143.049    125.269     44.7606     125.269     
1 1 1 15 6  55 o 19 232.905 3.16689 960.894     39.1664  966.815     34.6037  158.162    233.417     9.12539     233.417     
1 1 1 15 6  56 o 12 44.5273 3.59353 32.9971     8.09386  38.5688     7.54557  6.07338    125.939     18.3856     305.939     
1 1 1 15 6  57 o 5  112.253 2.4578  225.719     14.4277  222.188     13.1716  62.3749    204.107     17.1611     24.1071     
1 1 1 15 6  58 o 5  44.7452 3.39262 36.4216     7.63641  35.6594     7.3407   4.84982    331.398     57.5563     331.398     
1 1 1 15 6  59 o 7  107.677 2.55821 212.152     14.7317  200.46      12.8165  85.7781    194.534     40.5595     194.534     
1 1 1 15 6  60 o 12 175.849 2.97303 564.218     29.5506  537.047     22.497   92.0205    35.3789     44.1085     215.379     
1 1 1 15 6  61 o 19 74.0019 2.34939 94.4404     9.11431  100.673     8.20504  28.7948    224.454     31.9994     44.4543     
1 1 1 15 6  62 o 17 114.034 2.70154 239.611     16.9513  223.999     13.8115  90.1511    212.102     39.9584     212.102     
1 1 1 15 6  63 o 4  85.1928 2.87567 130.471     13.279   128.783     11.118   46.7726    36.7947     10.3726     216.795     
1 1 1 15 6  64 o 6  31.8392 4.85755 17.848      8.385    19.9834     6.64358  3.24481    230.345     12.7301     50.3451     
1 1 1 15 6  65 o 9  66.4997 3.11949 84.5816     11.3332  74.2644     9.34002  46.9794    58.301      15.3416     58.301      
1 1 1 15 6  66 o 13 34.0416 4.91316 20.3547     8.7733   23.0517     7.38079  6.07196    172.289     24.8226     352.289     
1 1 1 15 6  67 o 19 57.5165 3.34354 68.4203     10.3834  51.5621     8.73823  23.8791    286.98      22.1376     106.98      
1 1 1 15 6  68 f 0  113.878 2.57344 258.272     15.0295  206.726     14.2444  77.7079    105.509     0           0           
1 1 1 15 6  69 o 19 40.1701 5.18595 31.9933     9.61585  28.8499     10.4451  20.2988    0.506571    2.54726     180.507     
1 1 1 15 6  70 o 7  85.6042 3.20444 132.119     12.3721  131.968     14.8944  67.2491    324.678     29.8815     324.678     
1 1 1 15 6  71 o 9  79.639  3.3457  110.871     12.0222  118.434     14.5101  54.7506    42.9588     12.158      42.9588     
1 1 1 15 6  72 o 3  117.233 3.05576 246.466     16.4088  248.235     19.3185  73.6799    89.8864     1.52274     89.8864     
1 1 1 15 6  73 o 14 27.763  5.87161 9.67542     7.79174  20.1012     10.115   7.72712    235.044     10.6131     55.0444     
1 1 1 15 6  74 f 0  58.9209 3.61391 66.6885     10.0077  60.1239     11.0074  37.7124    53.3391     0           0           
1 1 1 15 6  75 o 11 56.8725 3.6015  53.6202     10.0395  65.0582     10.2043  32.8648    47.0167     2.20895     227.017     
1 1 1 15 6  76 o 8  70.1539 3.45183 85.4482     11.4736  94.4124     12.6534  50.0031    139.938     15.7487     139.938     
1 1 1 15 6  77 o 2  16.9735 5.0322  2.88162     7.35826  0.0625423   7.1239   0.804752   98.6697     5.20943     278.67      
1 1 1 15 6  78 o 3  18.4109 5.28154 2.2969      7.66029  4.4198      7.58723  0.790229   223.169     1.23174     43.1691     
1 1 1 15 6  79 o 4  73.8066 3.3824  107.431     12.1686  92.986      12.6198  36.1892    110.093     16.2638     290.094     
1 1 1 15 6  80 o 9  19.6719 5.75494 4.58529     8.63093  2.1579      9.96963  1.39573    347.41      12.6055     167.41      
1 1 1 15 6  81 o 5  82.6141 3.79038 121.749     14.6995  132.119     16.5148  54.2877    307.793     10.6524     307.793     
1 1 1 15 6  82 o 12 23.8273 6.34694 9.97494     9.37028  9.26998     11.3432  4.37015    16.7482     1.39474     196.748     
1 1 1 15 6  83 o 6  18.6948 5.65385 5.47423     8.95901  -6.52703    10.9871  0.563367   66.351      12.9197     246.351     
1 1 1 15 6  84 o 8  42.1421 6.24907 15.9379     13.7693  60.0053     13.2847  21.0349    233.03      5.00286     53.0302     
1 1 1 15 6  85 o 19 27.9905 6.97407 4.11863     12.3985  25.5069     13.7955  8.49562    93.7531     11.5362     273.753     
1 1 1 15 6  86 o 7  24.5488 7.03832 20.8667     16.0323  -6.68276    12.9512  8.07665    72.2535     0.825253    252.253     
1 1 1 15 6  87 o 3  31.0247 7.98027 22.0027     18.0427  21.8893     14.3196  13.8571    96.615      2.71217     96.615      
1 1 1 15 6  88 o 12 21.3599 6.74751 -0.862469   16.4004  2.69643     13.2635  1.58609    326.939     2.88079     146.939     
1 1 1 15 6  89 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 7  0  o 16 150.663 2.44824 402.851     18.463   402.851     18.463   0.722763   180         203.438     360         
1 1 1 15 7  1  o 16 987.106 8.69489 17132.1     420.722  17456.2     439.458  811.6      328.406     197.451     328.406     
1 1 1 15 7  2  o 16 400.245 4.0555  2808.54     81.3348  2870.47     81.3479  288.839    303.745     20.5281     303.745     
1 1 1 15 7  3  o 10 584.023 5.26641 6017.96     154.132  6076.44     154.138  460.552    351.969     89.4556     351.969     
1 1 1 15 7  4  o 15 247.681 2.88122 1082.93     35.7524  1091.36     35.7726  128.082    42.4209     68.0427     222.421     
1 1 1 15 7  5  f 0  329.338 3.3248  1897.66     53.7772  1947.01     55.9705  155.963    16.4742     0           0           
1 1 1 15 7  6  o 8  517.798 4.75787 4742.48     118.217  4763.56     128.515  297.055    353.903     143.808     173.903     
1 1 1 15 7  7  o 7  333.507 3.4863  1974.5      56.9901  1968.1      59.5143  237.497    328.119     20.8779     328.119     
1 1 1 15 7  8  o 8  1294.52 11.1822 29754.5     662.275  29809.1     783.553  982.294    55.1219     90.9559     55.1219     
1 1 1 15 7  9  f 0  249.905 2.79598 1127.71     34.3048  1085.99     35.6791  78.807     322.644     0           0           
1 1 1 15 7  10 o 8  663.616 5.63249 7706.94     180.04   7911.91     194.481  442.276    99.0401     66.806      279.04      
1 1 1 15 7  11 o 18 173.437 2.46388 535.551     20.0912  530.56      22.6503  69.2484    58.9298     62.6088     238.93      
1 1 1 15 7  12 o 8  696.049 6.25522 8493.58     213.431  8693.36     222.942  484.492    163.8       29.0496     343.8       
1 1 1 15 7  13 o 17 621.479 5.48069 6835.71     160.137  6862.5      180.673  399.556    174.396     90.0905     354.396     
1 1 1 15 7  14 o 8  188.935 2.56619 630.814     24.2984  634.365     24.2963  113.252    44.1383     13.0537     44.1382     
1 1 1 15 7  15 o 14 153.49  2.41151 415.674     17.4089  419.324     19.6326  46.7237    141.782     86.2816     321.782     
1 1 1 15 7  16 f 0  548.851 4.78495 5335.2      126.451  5347.25     136.586  410.312    96.846      0           0           
1 1 1 15 7  17 o 17 109.48  2.28997 211.509     12.0713  213.672     13.0155  13.501     101.848     27.8378     281.848     
1 1 1 15 7  18 o 14 791.539 6.63066 11051.8     252.738  11184.8     273.023  493.236    134.829     148.805     314.829     
1 1 1 15 7  19 o 1  392.181 3.69846 2716.94     69.8444  2736.14     75.4443  332.856    108.237     118.864     108.237     
1 1 1 15 7  20 o 2  459.213 4.2936  3723.24     94.6157  3754.86     102.863  346.895    235.953     45.1404     235.953     
1 1 1 15 7  21 o 3  274.586 2.93524 1345.44     39.5671  1327.34     41.1858  175.001    189.865     26.8553     9.86483     
1 1 1 15 7  22 f 0  215.408 2.6559  826.144     28.0686  818.629     29.254   97.4128    227.529     0           0           
1 1 1 15 7  23 f 0  269.935 2.97568 1289.69     39.4361  1293.44     41.0575  155.37     137.699     0           0           
1 1 1 15 7  24 o 14 219.725 2.65718 871.015     28.6098  840.536     29.8656  127.497    275.125     41.1077     95.1254     
1 1 1 15 7  25 o 6  327.489 3.29347 1916.93     52.9235  1885.8      55.1366  262.937    359.421     72.7534     359.421     
1 1 1 15 7  26 o 2  201.334 2.6438  738.744     25.441   698.512     27.7767  133.208    99.4764     0.187898    279.477     
1 1 1 15 7  27 o 4  310.649 3.19308 1706.73     46.5932  1715.07     52.6552  165.759    311.806     101.895     131.806     
1 1 1 15 7  28 o 15 402.909 3.79974 2912.3      75.1242  2845.77     78.2443  307.812    187.96      51.799      187.96      
1 1 1 15 7  29 o 7  327.768 3.26977 1909.91     51.5537  1899.85     55.7693  283.608    155.773     116.401     155.773     
1 1 1 15 7  30 o 1  321.582 3.3155  1867.49     52.2998  1800.39     54.4883  254.113    143.727     64.9999     143.727     
1 1 1 15 7  31 o 14 621.386 5.39558 6769.77     164.612  6944.24     171.425  432.419    170.011     10.2722     350.011     
1 1 1 15 7  32 o 5  340.614 3.53634 2082.96     61.6762  2032.61     59.0483  235.207    47.9771     1.13973     227.977     
1 1 1 15 7  33 o 11 277.728 3.2561  1366.69     44.2008  1369.07     46.4117  178.261    279.934     24.2088     99.9336     
1 1 1 15 7  34 o 7  223.442 3.00272 901.249     33.571   869.499     33.6658  197.264    268.661     102.37      268.661     
1 1 1 15 7  35 o 4  209.645 3.01946 819.603     30.7627  740.162     32.5082  171.7      288.964     66.8211     288.964     
1 1 1 15 7  36 o 4  349.839 4.06183 2191.54     71.197   2152.35     71.2217  239.723    60.7695     5.02652     240.769     
1 1 1 15 7  37 o 16 78.6021 2.73948 109.099     10.5483  110.535     10.9655  11.7987    294.172     65.643      114.172     
1 1 1 15 7  38 o 6  148.285 2.45706 395.023     17.769   384.702     18.7213  123.505    269.64      63.3402     269.64      
1 1 1 15 7  39 o 2  126.028 2.48539 291.924     15.8682  271.91      15.4917  70.1186    279.166     20.0856     99.1659     
1 1 1 15 7  40 o 14 317     3.24277 1769.85     50.4222  1795.49     52.5989  173.612    172.123     89.0659     352.123     
1 1 1 15 7  41 o 10 191.961 2.6306  640.591     24.1252  666.429     26.4718  97.3904    32.5759     63.4525     212.576     
1 1 1 15 7  42 o 19 278.291 3.29534 1346.05     44.7568  1402.4      47.1624  265.577    73.8988     158.076     73.8988     
1 1 1 15 7  43 o 12 268.564 3.2604  1261.56     40.5126  1298.05     47.0893  210.447    117.217     58.2871     117.217     
1 1 1 15 7  44 o 1  368.986 3.65216 2383.23     64.5967  2450.48     70.4159  220.562    38.9348     63.312      218.935     
1 1 1 15 7  45 o 16 216.103 2.84241 827.639     28.525   829.145     32.8889  155.568    288.181     23.6465     288.181     
1 1 1 15 7  46 o 2  467.786 4.46579 3840.62     102.323  3936.74     107.05   387.421    65.0438     137.759     65.0438     
1 1 1 15 7  47 o 8  90.7487 2.75947 155.536     11.2406  137.451     13.5122  30.714     122.699     45.6182     302.699     
1 1 1 15 7  48 o 17 124.384 2.64425 261.211     16.0893  288.491     16.8367  74.8887    222.98      4.99969     42.9797     
1 1 1 15 7  49 o 7  229.776 2.97442 902.77      33.3566  971.644     35.1523  194.598    136.613     86.4987     136.613     
1 1 1 15 7  50 o 7  181.894 2.64098 571.281     22.8728  602.892     25.2664  144.406    352.289     52.8697     352.289     
1 1 1 15 7  51 o 4  156.918 2.60948 420.081     20.3961  454.05      20.6301  110.278    36.3664     17.7246     36.3664     
1 1 1 15 7  52 o 14 75.4029 2.76745 95.9436     10.0003  106.568     10.8489  23.6195    256.568     142.447     256.568     
1 1 1 15 7  53 o 8  289.275 3.01845 1436.94     42.802   1536.04     44.72    223.385    303.282     61.3344     303.282     
1 1 1 15 7  54 o 9  114.405 2.35855 226.542     13.4491  238.479     13.5627  85.355     150.183     28.7413     150.183     
1 1 1 15 7  55 o 10 62.6967 2.99743 76.2537     9.3003   64.3326     9.36368  27.6232    200.545     10.2151     20.5455     
1 1 1 15 7  56 o 14 65.0603 2.8016  76.9532     9.05818  74.0296     9.12001  32.2296    203.573     12.6641     203.573     
1 1 1 15 7  57 o 13 39.318  3.81085 27.5169     7.45583  28.5972     7.15348  0.497429   92.2438     30.7515     272.244     
1 1 1 15 7  58 o 2  81.4674 2.59167 115.362     10.764   121.047     10.3232  60.557     225.846     34.0072     225.846     
1 1 1 15 7  59 o 17 60.6351 3.0486  61.3368     9.64859  70.3715     8.61272  18.4307    218.907     34.1023     38.9067     
1 1 1 15 7  60 o 14 186.984 2.52422 633.072     24.0192  610.536     23.2893  122.676    159.961     2.65581     159.961     
1 1 1 15 7  61 o 9  100.683 2.76284 200.113     15.2733  162.392     12.5912  68.7438    277.754     13.2092     277.754     
1 1 1 15 7  62 o 18 197.56  3.02907 713.662     28.4178  678.486     31.3942  133.334    53.2521     11.4096     53.2521     
1 1 1 15 7  63 o 7  66.9682 3.12437 79.7652     10.6053  81.025      10.2415  43.8782    191.215     10.6746     191.215     
1 1 1 15 7  64 o 7  69.8401 3.06637 91.4708     10.8675  83.4924     10.488   45.5715    21.8926     6.60181     21.8926     
1 1 1 15 7  65 o 1  177.91  2.81452 560.386     24.3828  569.596     25.7946  121.728    116.312     14.8106     116.312     
1 1 1 15 7  66 o 19 68.8387 3.0617  94.3922     10.6162  76.3098     10.3345  52.8026    183.502     23.0045     183.502     
1 1 1 15 7  67 o 4  51.8431 3.6295  56.3668     9.47777  41.7755     9.0165   37.6478    244.582     18.4576     244.582     
1 1 1 15 7  68 o 13 20.1337 5.1984  4.30292     7.91034  7.36319     6.01493  3.01909    87.1656     20.1911     87.1656     
1 1 1 15 7  69 o 15 77.8896 2.88795 119.351     11.869   99.1646     10.6067  57.7122    121.399     20.1399     121.399     
1 1 1 15 7  70 o 6  91.8062 2.96606 156.746     13.4146  146.487     13.7776  62.5836    201.941     11.2866     201.941     
1 1 1 15 7  71 o 17 39.4801 4.69259 27.2703     9.68331  31.2477     8.0266   20.9534    137.116     1.09334     317.116     
1 1 1 15 7  72 o 18 27.9358 5.56214 5.13974     8.9709   23.4777     8.99812  5.34125    304.54      17.7814     124.54      
1 1 1 15 7  73 o 2  87.0162 3.40317 142.3       13.5882  132.318     15.7814  52.7741    153.233     1.61076     333.233     
1 1 1 15 7  74 o 15 88.7781 3.47136 146.748     13.6484  139.877     16.8387  65.8305    249.615     22.9821     249.615     
1 1 1 15 7  75 o 7  52.1095 4.60198 57.4993     10.8033  44.746      12.2184  36.9736    270.125     13.1946     270.125     
1 1 1 15 7  76 o 11 35.7858 5.30061 29.7853     8.96563  20.4139     9.44999  22.2957    22.8675     6.95873     22.8675     
1 1 1 15 7  77 o 16 33.9794 5.39282 28.5231     8.88815  17.3008     9.20227  15.3189    25.4509     6.98301     205.451     
1 1 1 15 7  78 o 19 65.0568 3.58842 73.8093     11.3803  82.6611     11.8244  35.4956    222.74      6.9638      42.7404     
1 1 1 15 7  79 o 14 61.6842 3.95736 69.4002     11.2199  72.806      12.943   40.5326    252.253     8.37115     252.253     
1 1 1 15 7  80 f 0  37.0292 6.32821 29.0588     10.1529  27.3139     13.1709  11.8884    37.8785     0           0           
1 1 1 15 7  81 o 9  44.0033 5.93971 42.8067     10.9306  35.3994     13.9895  17.641     189.44      14.5741     9.44045     
1 1 1 15 7  82 o 12 76.266  4.0714  116.564     14.3065  101.908     16.2748  37.3282    7.51647     15.7678     187.516     
1 1 1 15 7  83 o 12 25.366  6.52134 0.0142381   11.4954  20.2197     12.0431  8.06983    0.942451    2.06154     0.942451    
1 1 1 15 7  84 o 3  21.3644 6.37177 7.07699     11.8739  0.109823    11.7175  5.22964    117.159     3.10517     297.159     
1 1 1 15 7  85 f 0  14.2933 4.88818 -11.2102    10.6314  -18.5967    10.8419  10.6907    320.974     0           0           
1 1 1 15 7  86 o 1  24.9982 7.07111 13.1022     13.0795  7.88211     13.9983  7.74501    145.095     4.34942     325.095     
1 1 1 15 7  87 o 19 20.0126 6.32845 -4.9108     12.6359  4.05622     13.5635  0.160455   260.949     15.504      260.949     
1 1 1 15 7  88 o 8  35.8571 7.73249 33.7471     14.6529  28.637      15.9205  17.5445    342.873     5.1349      342.873     
1 1 1 15 7  89 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 8  0  o 13 461.389 4.33723 3774.75     100.246  3774.75     100.246  306.253    180         59.7108     8.75924e-06 
1 1 1 15 8  1  o 3  349.893 3.60829 2145.81     61.8859  2194.07     64.6486  221.102    78.5963     45.3279     258.596     
1 1 1 15 8  2  o 18 362.12  3.70382 2312.86     65.7367  2335.62     68.6735  267.571    100.325     32.7852     100.325     
1 1 1 15 8  3  o 1  350.864 3.62739 2169.72     65.1407  2194.22     62.3745  341.669    342.875     223.774     342.875     
1 1 1 15 8  4  o 1  542.33  4.94357 5223.69     134.359  5205.73     134.358  496.777    213.272     224.893     213.272     
1 1 1 15 8  5  o 14 181.694 2.54576 581.688     23.1869  588.369     23.173   93.3357    247.987     21.5773     67.9869     
1 1 1 15 8  6  o 1  561.819 5.09444 5642.91     143.435  5550.41     143.427  389.949    157.899     24.4398     337.899     
1 1 1 15 8  7  o 16 223.966 2.88562 904.604     32.3915  873.445     32.3769  99.7564    120.996     97.6665     300.996     
1 1 1 15 8  8  o 4  508.032 4.88937 4610.73     124.484  4541.66     124.474  448.728    286.673     178.344     286.673     
1 1 1 15 8  9  o 14 232.975 2.82984 989.522     31.5866  934.708     34.3364  159.098    336.01      18.6502     336.01      
1 1 1 15 8  10 o 11 561.996 5.20568 5621.28     149.778  5580.12     143.4    525.476    280.807     252.875     280.807     
1 1 1 15 8  11 o 10 581.616 5.13002 5959.07     146.513  6038.19     152.513  364.645    228.038     104.972     48.038      
1 1 1 15 8  12 o 5  507.585 4.76619 4575.24     118.57   4561.36     123.841  456.175    318.959     193.556     318.959     
1 1 1 15 8  13 o 6  344.126 3.64277 2151.26     62.7962  2047.69     62.8178  126.809    328.305     233.007     148.305     
1 1 1 15 8  14 o 9  440.215 4.33053 3420.79     95.5223  3450.94     95.5483  373.415    245.459     126.131     245.459     
1 1 1 15 8  15 o 11 323.412 3.35802 1843.91     52.1169  1864.11     56.6618  176.042    24.5674     101.69      204.567     
1 1 1 15 8  16 f 0  376.874 3.59828 2525.48     65.2879  2510.17     70.5142  276.807    287.887     0           0           
1 1 1 15 8  17 o 11 588.264 5.08768 6152        144.089  6123.6      155.633  514.875    206.612     190.875     206.612     
1 1 1 15 8  18 o 2  488.605 4.43922 4204.04     106.502  4262.95     110.878  373.784    350.663     53.1304     350.663     
1 1 1 15 8  19 o 15 239.451 2.79072 1011.89     32.7979  1020.61     34.17    206.548    94.5519     102.022     94.5519     
1 1 1 15 8  20 o 14 777.536 6.46839 10678.9     242.185  10786.5     261.619  583.557    88.7836     52.9025     88.7836     
1 1 1 15 8  21 o 7  374.862 3.65833 2484.24     64.4868  2498.59     72.7382  316.429    146.2       108.426     146.2       
1 1 1 15 8  22 o 17 340.364 3.34977 2032.15     54.9106  2075.56     59.3204  295.655    177.643     118.961     177.643     
1 1 1 15 8  23 o 17 291.266 3.06476 1492.88     43.8287  1514.97     45.6342  140.886    174.07      125.862     354.07      
1 1 1 15 8  24 o 18 76.8027 2.41143 103.974     9.0786   105.537     9.43662  2.6973     116.068     37.3518     296.068     
1 1 1 15 8  25 o 7  509.566 4.69321 4522.7      119.808  4691.94     119.859  310.178    286.539     103.107     106.539     
1 1 1 15 8  26 o 3  126.319 2.30606 282.402     14.296   283.606     14.8713  64.4052    162.125     15.3452     342.125     
1 1 1 15 8  27 o 4  176.924 2.45021 553.746     21.278   555.95      22.1637  100.571    140.69      31.7095     320.69      
1 1 1 15 8  28 o 12 735.95  6.58495 9632.68     237.516  9622.01     248.087  591.493    2.37538     139.265     2.37538     
1 1 1 15 8  29 o 7  75.5825 2.57728 110.304     9.45883  93.076      9.90836  5.55967    177.967     77.1569     177.967     
1 1 1 15 8  30 o 17 436.026 4.3052  3328.54     89.7165  3419.05     98.3345  335.129    123.998     59.4629     123.998     
1 1 1 15 8  31 o 18 220.698 2.9598  891.672     31.8955  836.069     33.4801  175.055    30.6669     57.3745     30.6669     
1 1 1 15 8  32 o 7  245.78  3.02653 1080.61     35.5072  1061.78     38.9372  136.675    239.111     64.0423     59.1114     
1 1 1 15 8  33 o 3  440.589 4.40084 3414.28     92.6645  3476.95     101.545  270.772    125.064     75.7844     305.064     
1 1 1 15 8  34 o 14 206.014 2.63761 753.191     27.1457  751.776     27.3163  109.655    316.803     61.2652     136.803     
1 1 1 15 8  35 o 3  160.504 2.4925  478.457     20.3943  435.508     19.6962  143.75     237.139     95.7447     237.139     
1 1 1 15 8  36 o 2  116.346 2.48134 255.871     13.9726  225.051     14.817   83.1168    202.912     32.2919     202.912     
1 1 1 15 8  37 o 4  379.294 3.75644 2510.34     69.766   2595.95     73.0407  326.768    50.5553     128.216     50.5553     
1 1 1 15 8  38 o 9  601.088 5.88498 6435.91     168.137  6418.39     185.931  482.059    51.1468     126.433     51.1469     
1 1 1 15 8  39 o 12 317.655 3.58587 1823.51     55.5918  1758        58.4717  239.754    34.7451     42.6128     34.7451     
1 1 1 15 8  40 o 8  135.825 2.49823 335.351     16.4507  319.245     17.4916  66.2801    213.536     44.1709     33.5355     
1 1 1 15 8  41 o 1  315.935 3.53864 1769.3      57.296   1773.53     54.7246  254.228    199.034     76.6263     199.034     
1 1 1 15 8  42 o 9  405.366 4.4855  2807.02     90.9186  3033.98     91.2315  370.175    254.667     185.032     254.667     
1 1 1 15 8  43 o 8  25.9709 5.20905 11.5323     6.62829  13.0902     7.55795  22.371     281.131     51.9046     281.131     
1 1 1 15 8  44 o 13 228.148 2.96882 915.438     34.6083  931.458     33.252   125.483    304.963     57.0224     124.963     
1 1 1 15 8  45 o 19 110.175 2.61848 226.945     14.7639  204.421     14.1071  50.1961    314.99      36.1796     134.99      
1 1 1 15 8  46 o 10 135.97  2.50612 328.576     16.6035  327.648     17.5075  45.5645    192.041     86.5142     12.0415     
1 1 1 15 8  47 o 14 141.694 2.58599 354.709     18.3214  358.012     18.3732  77.0433    21.9207     29.157      201.921     
1 1 1 15 8  48 o 8  106.629 2.41636 204.51      12.5562  199.234     13.2155  36.5736    247.466     61.1199     67.4659     
1 1 1 15 8  49 o 11 145.727 2.38315 374.084     16.9742  379.294     17.8289  75.2349    119.332     39.5928     299.332     
1 1 1 15 8  50 f 0  416.775 3.96511 2989.19     79.2978  3188.63     86.3477  284.326    260.698     0           0           
1 1 1 15 8  51 o 1  25.8178 4.95431 12.0565     6.21311  12.4725     6.93614  29.5974    30.9902     75.8067     30.9902     
1 1 1 15 8  52 o 12 117.712 2.35115 243.867     13.3533  248.246     14.3478  77.1531    197.553     4.54275     197.553     
1 1 1 15 8  53 o 13 233.147 2.74026 919.145     31.0752  1012.47     32.9664  130.801    96.7229     49.1935     276.723     
1 1 1 15 8  54 o 5  147.164 2.47779 368.188     17.0213  401.17      19.5224  103.831    297.172     16.8231     297.172     
1 1 1 15 8  55 o 15 78.1857 2.91759 108.454     10.2099  109.438     12.4652  36.9186    48.7801     20.565      228.78      
1 1 1 15 8  56 o 12 144.941 3.1053  381.987     20.0075  366.132     24.6913  113.711    283.313     41.1559     283.313     
1 1 1 15 8  57 o 5  101.641 2.84701 180.716     12.3874  187.336     16.3462  85.9616    349.311     51.7007     349.311     
1 1 1 15 8  58 o 3  36.4382 4.92646 26.1913     7.41582  22.9228     9.7551   2.47789    30.5077     8.11167     210.508     
1 1 1 15 8  59 o 10 49.2538 3.50482 49.4126     8.38979  38.376      8.52953  18.6194    193.996     1.69759     13.9964     
1 1 1 15 8  60 o 11 205.398 2.62595 768.544     27.5595  733.341     26.5034  160.11     299.411     53.3313     299.411     
1 1 1 15 8  61 o 19 135.765 2.65269 308.744     18.8444  348.539     17.0161  96.5126    76.5929     19.8484     76.5929     
1 1 1 15 8  62 o 7  189.944 3.04926 637.503     26.6974  650.18      31.2157  119.194    179.153     7.93359     359.153     
1 1 1 15 8  63 o 19 126.204 2.58885 293.912     16.4827  274.347     16.223   86.863     1.14812     12.1508     1.14812     
1 1 1 15 8  64 o 12 80.6184 2.85771 115.731     11.7413  116.918     11.2681  58.7546    24.6021     17.2498     24.6021     
1 1 1 15 8  65 o 2  141.165 2.55107 366.593     18.2081  345.013     17.8532  84.9211    266.118     11.3012     86.118      
1 1 1 15 8  66 o 1  33.8806 4.7975  31.024      8.44896  13.4676     7.38777  11.5602    347.348     12.1687     167.348     
1 1 1 15 8  67 o 14 166.977 2.56637 502.361     22.1142  494.022     20.8259  123.53     186.876     33.9653     186.876     
1 1 1 15 8  68 o 7  99.195  2.77841 169.918     14.4318  183.151     13.0283  64.5018    200.283     4.36743     200.283     
1 1 1 15 8  69 o 6  20.9815 5.25883 10.6201     7.88778  3.77793     6.19694  1.2585     252.736     18.9077     252.736     
1 1 1 15 8  70 o 12 94.5399 2.7074  161.261     13.4571  159.575     12.1133  49.3265    18.3583     19.6547     198.358     
1 1 1 15 8  71 o 11 55.8954 3.51377 67.41       10.5154  47.2653     8.94138  19.0713    255.22      29.9822     75.2204     
1 1 1 15 8  72 o 4  92.8131 3.01137 156.548     14.2021  154.174     13.7354  74.6035    74.5889     35.0248     74.5889     
1 1 1 15 8  73 o 7  110.134 3.18914 218.253     16.6681  220.61      18.4222  67.3998    8.41807     2.19761     188.418     
1 1 1 15 8  74 o 9  44.0259 4.20245 39.9737     9.10203  32.5975     8.89986  23.8316    257.819     3.91399     77.819      
1 1 1 15 8  75 o 2  55.2352 4.14515 61.0412     10.3026  52.6817     11.9837  27.797     126.379     10.9114     306.379     
1 1 1 15 8  76 o 18 36.0056 5.54879 23.9603     9.00055  27.3378     10.4644  23.6746    160.856     10.4518     160.856     
1 1 1 15 8  77 o 5  24.0976 5.85074 13.8474     8.18906  6.57496     9.54917  2.2308     118.691     20.7803     298.691     
1 1 1 15 8  78 o 10 44.5009 4.74837 34.1779     9.67694  42.2775     10.8481  32.6663    293.199     16.7174     293.199     
1 1 1 15 8  79 o 19 18.6747 5.60364 5.1835      8.53802  -4.26722    10.5216  1.35093    38.5473     4.61779     218.547     
1 1 1 15 8  80 o 6  51.9432 5.2392  58.7231     11.8154  47.0284     14.0433  32.1209    241.334     4.87316     241.334     
1 1 1 15 8  81 o 6  43.3192 5.867   36.132      11.216   39.689      13.3177  25.9901    55.8832     4.31737     55.8832     
1 1 1 15 8  82 o 12 38.0566 6.18021 41.3814     11.1146  18.587      12.8786  8.40285    149.522     26.5802     329.522     
1 1 1 15 8  83 o 8  31.2749 6.93259 9.41483     13.494   30.0721     12.831   9.28692    24.0507     15.3138     204.051     
1 1 1 15 8  84 o 17 18.6718 5.95261 0.157139    12.1014  -5.76765    11.5342  2.34153    332.782     8.16032     152.782     
1 1 1 15 8  85 o 18 65.137  6.0761  87.0036     21.3119  88.065      16.8161  39.9341    252.984     4.73654     252.984     
1 1 1 15 8  86 o 19 33.2467 8.36367 15.3034     17.9446  37.8212     18.7645  15.7823    227.952     5.48655     227.952     
1 1 1 15 8  87 o 4  37.0586 8.25937 32.0216     19.0851  37.068      15.8235  19.357     202.161     6.23688     202.161     
1 1 1 15 8  88 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 9  0  o 15 590.477 5.53984 6183.95     163.866  6183.95     163.866  395.965    4.98607e-06 69.3079     180         
1 1 1 15 9  1  o 19 361.511 3.61796 2318.56     65.5454  2314.55     65.5464  369.373    91.4299     254.525     91.4299     
1 1 1 15 9  2  f 0  228.366 2.83943 921.325     31.7725  927.183     33.2069  150.134    285.436     0           0           
1 1 1 15 9  3  o 15 318.541 3.39475 1803.91     55.3562  1793.1      53.0088  188.704    216.073     68.6123     36.0729     
1 1 1 15 9  4  o 11 604.46  5.4239  6479.23     164.298  6480.7      164.304  435.242    349.822     0.111247    169.824     
1 1 1 15 9  5  o 8  95.6022 2.3699  162.761     11.3235  161.577     11.3496  13.4627    302.703     109.035     302.703     
1 1 1 15 9  6  o 11 494.456 4.68675 4348.21     118.642  4321.94     113.586  219.086    327.232     273.215     147.232     
1 1 1 15 9  7  o 11 609.382 5.57862 6568.3      166.628  6605        174.038  368.836    58.1697     141.383     238.17      
1 1 1 15 9  8  o 17 922.486 8.13384 15129.7     384.118  15096.6     367.768  774.319    134.731     213.107     134.731     
1 1 1 15 9  9  o 13 201.122 2.69966 716.096     26.6041  717.67      27.8039  135.601    293.606     15.0991     293.606     
1 1 1 15 9  10 o 2  255.856 3.00282 1166.81     39.3315  1153.72     37.6632  169.499    75.1719     10.6163     255.172     
1 1 1 15 9  11 o 18 155.686 2.44648 430.289     19.0882  428.817     19.087   91.0592    89.5793     18.45       89.5793     
1 1 1 15 9  12 o 13 283.786 3.17984 1424.97     44.2297  1430        46.1976  197.954    118.955     3.17201     118.955     
1 1 1 15 9  13 o 4  272.28  3.03392 1342.24     41.3834  1286.15     41.3983  126.676    129.444     127.422     309.444     
1 1 1 15 9  14 o 13 407.541 3.94033 2936.57     77.0472  2952.91     83.7811  309.106    98.4499     40.248      98.4499     
1 1 1 15 9  15 o 16 161.692 2.53626 466.484     20.9868  460.242     20.112   74.2505    329.744     58.1984     149.744     
1 1 1 15 9  16 o 16 470.842 4.42582 3988.21     99.9154  3875.22     108.623  326.883    139.133     18.5105     319.133     
1 1 1 15 9  17 o 17 505.053 4.55288 4528.76     112.898  4519.29     117.52   423.069    285.231     126.153     285.231     
1 1 1 15 9  18 o 12 341.57  3.41377 2070.04     57.2446  2066.73     59.6001  280.488    96.9212     82.9242     96.9212     
1 1 1 15 9  19 o 1  299.496 3.12279 1575.26     45.9199  1604.99     47.8154  205.336    1.2144      7.90247     181.214     
1 1 1 15 9  20 o 19 262.994 2.91899 1228.81     37.6814  1223.33     39.2422  165.125    233.689     34.9524     53.6885     
1 1 1 15 9  21 o 18 518.889 4.67307 4723.98     114.06   4829.55     128.683  343.719    47.1425     53.5325     227.143     
1 1 1 15 9  22 o 1  270.491 2.9174  1276.98     38.0125  1317.23     41.062   158.07     283.147     61.2681     103.147     
1 1 1 15 9  23 o 14 259.992 2.85325 1188.16     35.7204  1208.49     38.5978  202.937    203.403     49.0784     203.403     
1 1 1 15 9  24 o 10 329.603 3.39242 1909.63     53.6637  1943.21     58.3464  229.495    194.992     3.20943     14.9919     
1 1 1 15 9  25 o 7  611.038 5.50023 6613.34     161.262  6646.43     175.329  443.471    357.868     16.8645     357.868     
1 1 1 15 9  26 o 19 216.737 2.84413 818.472     30.8792  847.29      30.8977  195.19     359.432     111.317     359.432     
1 1 1 15 9  27 f 0  55.0438 2.7994  55.1953     7.49832  52.8053     7.82788  91.5675    212.349     0           0           
1 1 1 15 9  28 o 12 183.586 2.6306  593.555     24.1898  601.485     24.214   123.744    271.178     7.15027     271.178     
1 1 1 15 9  29 o 7  110.755 2.46336 212.905     13.3323  222.49      13.9806  15.1331    142.501     107.353     322.501     
1 1 1 15 9  30 o 10 297.304 3.25046 1555        47.3605  1580.2      49.4887  249.623    306.708     89.5969     306.708     
1 1 1 15 9  31 o 5  126.401 2.40479 281.507     14.874   285.382     15.5608  62.1868    164.223     33.799      344.223     
1 1 1 15 9  32 o 14 21.2387 4.47784 11.461      5.1654   3.72288     5.8065   28.6115    354.782     61.5263     354.782     
1 1 1 15 9  33 o 15 481.785 4.68413 4107.56     107.843  4136.03     118.145  338.476    293.924     0.426608    113.925     
1 1 1 15 9  34 o 8  302.455 3.48092 1640.69     51.4613  1605.24     53.998   239.599    337.576     59.3784     337.576     
1 1 1 15 9  35 o 12 241.766 3.06535 1057.34     34.3059  1016.29     39.6618  157.522    118.791     18.1695     298.791     
1 1 1 15 9  36 o 2  143.296 2.72595 377.212     18.5187  351.569     20.4711  89.61      95.6661     8.24451     275.666     
1 1 1 15 9  37 o 14 132.734 2.51222 314.507     15.901   310.737     17.4446  74.3341    262.381     23.4665     82.3806     
1 1 1 15 9  38 o 6  617.775 5.77912 6735.18     186.733  6845.81     170.589  433.562    228.37      4.48228     228.369     
1 1 1 15 9  39 o 11 77.0553 2.63952 108.698     10.2028  102.434     10.1173  26.5859    179.986     18.6298     359.986     
1 1 1 15 9  40 o 11 223.955 2.91037 885.86      33.299   893.511     32.0104  154.778    25.0051     6.05506     25.0051     
1 1 1 15 9  41 o 9  78.4879 2.8561  110.703     10.3372  108.426     11.9742  5.50245    257.064     81.753      77.064      
1 1 1 15 9  42 o 16 142.427 2.6542  371.305     19.2052  348.938     18.6505  99.1268    62.2334     16.7879     62.2334     
1 1 1 15 9  43 o 2  91.3515 2.49152 153.532     10.7202  142.993     11.9587  48.2476    140.582     4.87837     140.582     
1 1 1 15 9  44 o 12 112.749 2.31902 236.717     13.3863  214.783     12.7912  30.7316    98.4069     83.3542     278.407     
1 1 1 15 9  45 o 18 297.296 3.37101 1549.16     50.1805  1588.75     50.2622  218.216    112.987     32.7388     112.987     
1 1 1 15 9  46 o 3  90.3136 2.75349 156.168     12.0664  134.197     12.6878  46.8352    19.6664     7.20677     199.666     
1 1 1 15 9  47 o 15 181.56  2.71702 587.748     24.4443  581.967     24.9921  134.333    149.963     29.7042     149.963     
1 1 1 15 9  48 o 10 157.729 2.60961 449.47      19.8312  433.419     21.3624  119.276    114.67      33.9015     114.67      
1 1 1 15 9  49 o 12 121.901 2.679   269.026     15.0403  258.954     17.5046  67.6651    320.822     21.5764     140.822     
1 1 1 15 9  50 o 18 231.191 2.8962  937.899     32.5236  960.093     34.5759  140.633    35.4801     29.2245     215.48      
1 1 1 15 9  51 o 10 56.689  3.46629 46.312      8.57529  70.0088     10.956   15.6871    226.271     28.0627     46.2713     
1 1 1 15 9  52 o 10 44.7416 3.8985  35.5017     7.31919  36.8291     9.64297  16.1334    231.842     82.1524     231.842     
1 1 1 15 9  53 o 12 122.973 2.55408 257.634     13.9586  280.127     17.4188  79.0432    272.44      0.27141     92.4403     
1 1 1 15 9  54 o 15 150.971 2.49637 381.407     17.7578  428.854     20.0324  97.7646    59.2483     1.98109     239.248     
1 1 1 15 9  55 o 4  130.405 2.44888 289.227     14.6757  315.612     17.2873  92.6536    15.881      17.3655     15.881      
1 1 1 15 9  56 o 10 95.5196 2.60247 155.075     11.6148  169.924     13.255   56.7979    95.144      6.31567     275.144     
1 1 1 15 9  57 o 2  126.422 2.38726 274.715     14.1603  293.918     16.0531  78.6358    233.585     5.91156     53.5848     
1 1 1 15 9  58 o 19 95.6018 2.4597  152.923     11.3512  172.852     12.1814  56.1884    25.1863     7.64413     205.186     
1 1 1 15 9  59 o 4  125.86  2.54599 290.937     15.8283  273.393     16.2286  100.125    206.274     40.8602     206.274     
1 1 1 15 9  60 o 13 47.7547 3.48774 35.3695     7.93814  47.4347     8.42751  19.1201    151.866     3.20233     331.866     
1 1 1 15 9  61 o 11 28.1416 5.14425 13.6924     6.64578  16.0658     7.97764  16.4514    51.1985     61.5891     51.1985     
1 1 1 15 9  62 o 15 96.316  3.11073 167.382     15.0661  164.764     14.8845  61.7744    324.568     1.16427     324.568     
1 1 1 15 9  63 o 4  78.6139 3.09368 105.181     11.8249  116.625     12.455   56.1689    26.7276     14.1724     26.7276     
1 1 1 15 9  64 o 14 24.1353 5.3867  11.7916     7.91238  9.37994     6.66435  1.61793    47.6192     4.14905     227.619     
1 1 1 15 9  65 o 1  85.2626 2.75995 129.815     12.2536  130.623     11.243   42.1147    47.0719     23.8205     227.072     
1 1 1 15 9  66 o 3  33.4106 4.86255 21.9735     8.53583  20.1906     7.20264  9.94069    40.0333     3.64425     40.0333     
1 1 1 15 9  67 o 14 84.1187 2.90994 118.784     12.728   135.786     11.5766  45.364     41.8762     15.0976     221.876     
1 1 1 15 9  68 o 3  58.3547 3.32884 70.6323     10.2901  53.3805     9.00569  34.5214    285.412     1.74405     105.412     
1 1 1 15 9  69 o 8  26.7157 5.4826  15.2469     8.66425  11.9777     6.88729  5.74643    7.95676     13.7982     187.957     
1 1 1 15 9  70 o 9  53.5474 3.6648  61.7943     10.5507  43.7361     8.86497  32.1335    105.817     0.352043    105.817     
1 1 1 15 9  71 o 6  86.9652 2.85612 144.018     13.3232  128.605     11.5093  43.1574    352.832     22.2139     172.832     
1 1 1 15 9  72 o 7  38.0125 4.86499 28.6005     9.81828  26.3498     8.01063  13.9668    260.366     16.3147     80.3662     
1 1 1 15 9  73 o 19 24.5613 5.72661 11.5648     9.27818  10.7341     7.12068  0.987671   138.065     24.5747     318.065     
1 1 1 15 9  74 o 2  82.6658 3.08033 139.62      13.7771  109.544     11.6822  50.5278    64.2595     0.850992    244.259     
1 1 1 15 9  75 o 16 87.905  3.05377 152.61      14.4218  129.023     12.4234  49.0534    288.825     10.2255     108.825     
1 1 1 15 9  76 o 3  38.4321 5.43194 25.609      9.32617  32.9173     10.8963  12.0611    139.391     20.7349     319.391     
1 1 1 15 9  77 o 11 38.6102 5.37678 32.681      9.34503  26.3481     10.629   22.1948    287.053     1.40113     287.053     
1 1 1 15 9  78 o 9  25.5668 5.5113  23.5287     9.33328  -4.8192     10.3465  9.43131    350.297     2.5158      170.297     
1 1 1 15 9  79 o 8  45.2366 6.14653 56.5444     11.4225  27.9593     14.6893  19.7832    251.57      12.4578     71.5697     
1 1 1 15 9  80 o 4  28.9568 6.57346 18.4055     9.91689  15.651      11.9471  12.2826    10.9057     1.28366     190.906     
1 1 1 15 9  81 o 16 23.7911 6.52659 11.054      10.7908  6.65239     11.6674  7.22314    261.128     5.44864     81.128      
1 1 1 15 9  82 o 14 27.9277 7.312   9.34903     15.7234  18.7785     12.5252  5.67058    226.822     18.4911     46.8223     
1 1 1 15 9  83 o 4  21.1767 6.65686 -2.54831    14.8435  1.71618     13.6295  4.80316    73.7743     7.00875     253.774     
1 1 1 15 9  84 o 6  24.3817 7.27986 8.08538     16.0979  6.96984     14.4086  6.83476    209.945     0.323077    209.945     
1 1 1 15 9  85 o 3  32.7294 8.06799 27.3886     16.8528  23.8383     15.6438  16.1904    69.28       4.42158     69.2799     
1 1 1 15 9  86 o 18 41.9012 7.9946  32.4188     15.1795  54.6952     19.468   24.271     313.394     5.97181     313.394     
1 1 1 15 9  87 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 10 0  o 17 206.705 2.67288 757.902     27.667   757.902     27.667   81.6114    180         138.536     8.66767e-06 
1 1 1 15 10 1  o 2  377.012 3.73156 2513.93     70.5074  2525.68     70.4978  282.432    343.529     29.3041     343.529     
1 1 1 15 10 2  o 15 48.8551 2.90101 42.9118     7.02272  42.2933     7.05089  67.827     285.812     165.989     285.812     
1 1 1 15 10 3  o 4  104.576 2.49652 197.823     12.4129  190.289     13.6583  3.84994    323.716     2.88611     143.716     
1 1 1 15 10 4  o 14 718.811 6.45707 9188.5      237.609  9152.02     227.5    505.691    181.073     30.8968     1.07261     
1 1 1 15 10 5  o 7  58.9592 2.66669 61.2411     7.85445  62.4844     7.82041  82.0106    50.0495     217.347     50.0495     
1 1 1 15 10 6  o 15 99.2754 2.44872 174.444     12.48    175.313     11.8377  28.0313    43.2155     172.294     43.2155     
1 1 1 15 10 7  o 12 608.941 5.57315 6563.41     166.342  6594.03     173.74   501.62     0.703246    124.74      0.703246    
1 1 1 15 10 8  f 0  562.857 5.21086 5639        150.156  5600.72     143.761  367.699    324.822     0           0           
1 1 1 15 10 9  o 2  442.271 4.26493 3511.93     96.5861  3425.36     92.4654  258.802    147.455     117.577     327.455     
1 1 1 15 10 10 o 15 440.436 4.44269 3444.78     100.37   3435.43     95.6988  303.235    172.275     24.5377     352.275     
1 1 1 15 10 11 o 5  376.95  3.73507 2505.2      70.5499  2533.29     70.5635  198.135    295.078     142.591     115.078     
1 1 1 15 10 12 o 1  302.953 3.37784 1606.81     51.2784  1647.45     51.2819  194.764    17.4099     37.0447     197.41      
1 1 1 15 10 13 o 8  176.484 2.63108 554.143     23.2631  549.957     23.2771  77.2769    319.644     81.4401     139.644     
1 1 1 15 10 14 o 7  576.679 5.20036 5885.5      150.284  5915.54     150.294  373.939    320.655     83.0221     140.655     
1 1 1 15 10 15 f 0  218.31  2.79961 850.401     29.9424  839.187     31.2906  164.837    179.312     0           0           
1 1 1 15 10 16 o 13 487.747 4.839   4249.31     121.082  4191.92     115.444  334.585    66.412      30.2949     246.412     
1 1 1 15 10 17 o 9  326.273 3.3032  1902.88     52.9038  1871.9      55.0745  213.141    199.368     35.4213     19.3685     
1 1 1 15 10 18 o 13 320.539 3.28451 1859.48     51.6646  1784.19     53.7753  230.548    282.076     8.97994     282.076     
1 1 1 15 10 19 o 8  374.52  3.71538 2508.67     69.7182  2466.24     69.7437  292.122    72.4536     53.6172     72.4536     
1 1 1 15 10 20 o 5  337.862 3.50567 2021.02     58.0488  2027.34     60.6407  223.841    334.471     30.1601     154.471     
1 1 1 15 10 21 o 10 231.247 3.01657 986.739     34.0416  910.185     35.7428  143.298    237.257     32.3321     57.257      
1 1 1 15 10 22 o 10 72.0342 2.64903 94.285      9.44794  90.2037     9.60403  26.5519    351.574     127.035     351.574     
1 1 1 15 10 23 o 18 254.865 3.10865 1144.96     38.7347  1158.55     40.6617  193.72     295.237     36.7959     295.237     
1 1 1 15 10 24 o 14 217.121 2.92167 854.934     30.9953  816.933     32.5198  109.845    260.987     79.1049     80.9865     
1 1 1 15 10 25 o 9  256.817 3.14653 1180.94     39.5026  1158.22     41.4452  192.47     135.178     31.7707     135.178     
1 1 1 15 10 26 o 6  335.594 3.60352 1985.16     57.7956  2010.28     63.3191  186.459    359.801     99.6897     179.801     
1 1 1 15 10 27 o 5  103.044 2.45368 194.235     12.4275  182.746     12.8521  41.9267    97.2659     22.8792     277.266     
1 1 1 15 10 28 o 15 145.35  2.44251 378.54      17.0602  370.537     18.4778  100.841    178.643     22.0759     178.643     
1 1 1 15 10 29 o 4  251.18  2.90833 1121.71     35.0492  1115.8      38.097   132.533    307.205     84.6604     127.205     
1 1 1 15 10 30 o 6  283.915 3.04768 1407.09     42.4892  1452.12     44.2385  119.363    25.0234     159.646     205.023     
1 1 1 15 10 31 o 14 21.6005 4.54359 9.93502     5.24898  6.68882     5.43851  15.0842    131.217     32.9939     131.217     
1 1 1 15 10 32 o 8  87.1454 2.51685 133.178     11.2681  136.577     10.6507  32.06      143.268     38.3917     323.268     
1 1 1 15 10 33 o 13 225.976 2.97162 923.241     34.4467  888.269     32.8607  167.367    178.639     23.9743     178.639     
1 1 1 15 10 34 o 18 332.448 3.72758 1929.74     58.9297  1993.3      65.206   194.802    268.596     75.6158     88.5959     
1 1 1 15 10 35 o 14 128.648 2.64348 286.495     16.5768  301.063     17.4752  59.3971    264.118     50.1158     84.1181     
1 1 1 15 10 36 o 15 151.443 2.78824 418.109     19.9543  395.877     22.2089  83.7228    112.664     34.2076     292.664     
1 1 1 15 10 37 o 18 405.355 4.56073 2869.69     79.7201  2969.12     104.318  267.106    125.056     31.1977     305.056     
1 1 1 15 10 38 o 17 163.398 2.73057 481.148     21.2339  466.263     23.3751  113.466    65.4786     11.0085     65.4787     
1 1 1 15 10 39 o 15 243.943 3.09316 1030.92     34.2941  1080.94     41.1666  145.434    307.828     43.6879     127.828     
1 1 1 15 10 40 o 7  116.511 2.89943 246.278     14.8916  235.997     18.617   84.0174    23.4805     35.7117     23.4804     
1 1 1 15 10 41 o 15 173.634 2.61282 529.79      21.7295  539.678     23.7149  105.752    92.0823     20.1698     272.082     
1 1 1 15 10 42 o 10 190.686 2.8318  618.513     27.0069  672.132     27.0828  115.894    152.174     24.4531     332.174     
1 1 1 15 10 43 o 4  208.942 2.79024 739.669     27.6174  810.079     30.828   121.362    300.107     39.7288     120.107     
1 1 1 15 10 44 o 12 26.2021 5.05499 13.2151     6.17235  11.8461     7.54148  39.293     276.954     92.73       276.954     
1 1 1 15 10 45 o 4  225.642 2.80429 889.508     30.1082  917.354     33.2765  147.616    319.05      9.35023     139.05      
1 1 1 15 10 46 o 8  37.1196 4.42006 22.8658     7.66093  27.5838     8.19464  8.25395    351.823     30.6126     351.823     
1 1 1 15 10 47 o 16 115.148 2.54428 237.169     13.4316  233.796     15.7823  54.6011    70.8727     39.2672     250.873     
1 1 1 15 10 48 o 6  59.7636 3.07269 69.6973     8.73269  58.0841     9.40453  2.44899    105.945     75.0627     105.944     
1 1 1 15 10 49 o 11 140.954 2.4492  343.218     16.749   362.031     17.8547  84.766     130.081     16.3133     310.081     
1 1 1 15 10 50 o 8  242.368 2.80721 1022.49     32.5644  1064.01     35.6106  167.619    202.88      9.01921     202.88      
1 1 1 15 10 51 o 1  222.836 2.778   855.993     28.8825  908.375     33.1225  165.123    277.725     32.045      277.725     
1 1 1 15 10 52 o 9  49.9575 3.46955 44.2891     8.23009  45.3723     8.91104  14.5611    329.554     11.8179     149.554     
1 1 1 15 10 53 o 18 189.235 2.55637 602.82      23.4912  670.283     25       124.517    134.494     2.32984     314.494     
1 1 1 15 10 54 o 15 118.635 2.42781 231.607     14.5717  269.547     14.1689  91.1102    190.496     31.0878     190.496     
1 1 1 15 10 55 o 16 47.2096 3.5666  39.5976     7.85475  40.7623     8.7448   10.0646    238.348     29.3116     58.3483     
1 1 1 15 10 56 o 8  61.6324 2.95823 60.8708     8.82532  75.383      9.30358  28.1684    231.439     14.8732     51.4392     
1 1 1 15 10 57 o 6  145.679 2.51555 364.4       17.8884  390.797     18.8456  89.5426    349.097     11.006      169.097     
1 1 1 15 10 58 o 4  76.8257 2.6074  104.126     9.6593   106.471     10.3538  23.2824    214.496     49.6667     34.4956     
1 1 1 15 10 59 o 5  22.2749 5.26747 9.34951     6.75377  7.52925     7.1217   7.28474    359.563     22.9465     359.563     
1 1 1 15 10 60 o 7  62.1319 3.06851 79.116      9.7537   60.0228     9.16401  36.4483    279.823     0.434888    99.8228     
1 1 1 15 10 61 f 0  32.5905 5.15305 20.8813     8.48408  19.1089     7.92886  22.5199    71.9956     0           0           
1 1 1 15 10 62 o 11 64.4792 3.54076 78.6557     12.4563  71.4185     10.2193  51.2834    110.998     25.6561     110.998     
1 1 1 15 10 63 o 1  28.5565 5.53059 17.7478     8.47083  13.1218     7.89474  7.16855    314.211     5.27402     134.211     
1 1 1 15 10 64 o 14 71.0279 3.31905 88.7046     11.6948  93.2        11.7976  38.8288    77.5781     11.505      257.578     
1 1 1 15 10 65 o 17 151.706 2.84975 434.253     21.6202  391.108     21.6263  118.56     182.783     42.1183     182.783     
1 1 1 15 10 66 o 3  101.141 3.01744 176.467     15.2787  191.48      15.2181  71.2992    196.501     14.3629     196.501     
1 1 1 15 10 67 o 4  63.3028 3.41199 79.9925     11.2068  65.6344     10.2693  35.0811    211.774     8.052       31.7736     
1 1 1 15 10 68 o 9  62.4202 3.41405 74.9989     11.3573  66.5325     9.84314  48.2659    353.733     21.7193     353.733     
1 1 1 15 10 69 o 17 32.4239 5.17713 18.4002     8.83481  21.8617     7.61655  13.221     179.883     7.59644     359.883     
1 1 1 15 10 70 o 2  17.9514 5.19923 4.91865     8.29693  0.181552    6.66119  0.089787   342.454     2.69606     162.454     
1 1 1 15 10 71 o 15 96.3638 2.78884 174.478     14.067   160.177     12.8174  64.2381    113.334     7.92403     113.334     
1 1 1 15 10 72 o 16 75.4787 3.08691 104.507     12.3052  102.146     10.9171  43.4653    130.693     6.70455     310.693     
1 1 1 15 10 73 o 1  64.1364 3.44733 82.536      11.5472  68.4568     10.4491  43.0996    30.8813     7.95863     30.8813     
1 1 1 15 10 74 o 6  36.6927 5.23383 26.8803     10.0298  25.7423     8.54063  25.1184    88.7901     11.9311     88.7901     
1 1 1 15 10 75 o 2  24.8697 5.9214  9.39628     9.47827  13.5776     8.27267  9.46058    298.499     2.82569     118.499     
1 1 1 15 10 76 o 7  82.3354 3.65058 111.335     14.4285  140.289     15.4921  47.3764    284.975     6.07411     104.976     
1 1 1 15 10 77 o 9  49.0253 5.68871 52.3434     14.2515  43.4107     12.747   24.4481    166.447     8.78253     346.447     
1 1 1 15 10 78 f 0  37.4418 6.25609 23.0519     11.4835  35.2101     11.8387  20.7476    95.1196     0           0           
1 1 1 15 10 79 o 1  36.5103 6.86433 30.895      11.5109  25.4494     14.4128  16.7302    95.9873     6.16476     275.987     
1 1 1 15 10 80 o 11 27.3233 7.03481 16.6783     11.0149  10.5672     14.7709  1.62066    104.615     26.3876     284.615     
1 1 1 15 10 81 o 2  54.031  6.33945 59.656      16.5696  59.8767     16.5585  34.0135    309.076     5.23833     309.076     
1 1 1 15 10 82 o 1  25.0778 7.09057 5.07829     12.4024  15.0695     14.7544  8.67281    31.7901     5.89674     211.79      
1 1 1 15 10 83 o 6  29.9858 6.99643 8.29455     13.2244  28.8497     13.2248  13.9161    334.087     2.0779      154.087     
1 1 1 15 10 84 o 7  22.6693 6.85495 0.213975    12.6672  10.7476     15.104   5.0315     20.4027     7.06379     200.403     
1 1 1 15 10 85 o 16 38.402  7.05444 20.8339     14.7663  47.8594     14.4838  22.774     207.507     10.8114     207.507     
1 1 1 15 10 86 x 16 ?       ?       ?           ?        ?           ?        11.8136    97.8681     0           0           
1 1 1 15 10 87 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 11 0  o 9  343.884 3.49637 2097.19     60.2264  2097.19     60.2264  179.909    6.73075e-06 142.962     180         
1 1 1 15 11 1  o 1  579.305 5.19943 5971.09     150.945  5936.83     150.947  483.925    219.53      129.995     219.53      
1 1 1 15 11 2  o 9  103.495 2.43511 194.005     12.8965  186.132     12.3294  58.3481    298.085     250.151     298.085     
1 1 1 15 11 3  o 14 411.889 4.25988 2988.94     85.8005  3028.34     90.0338  345.921    94.3898     102.984     94.3898     
1 1 1 15 11 4  o 11 362.764 3.71818 2327.1      69.0356  2339.43     66.1148  263.463    1.28838     9.29562     1.28837     
1 1 1 15 11 5  o 8  282.437 3.17928 1435.17     43.9976  1393.18     45.9445  157.874    329.513     83.8297     149.513     
1 1 1 15 11 6  o 3  125.855 2.43811 275.143     15.6941  286.8       15.0046  55.1561    354.078     32.9871     174.078     
1 1 1 15 11 7  o 6  283.387 3.24626 1438.54     46.097   1408.9      46.104   210.887    133.277     24.5785     133.277     
1 1 1 15 11 8  o 19 499.612 4.62923 4411.1      115.9    4444.27     115.909  309.028    16.7694     103.877     196.769     
1 1 1 15 11 9  o 14 240.998 2.84925 1037.18     34.4149  1021.89     34.4069  125.945    322.538     85.6409     142.538     
1 1 1 15 11 10 o 11 205.842 2.732   756.419     28.7862  745.684     27.5729  64.0537    189.156     158.986     9.15612     
1 1 1 15 11 11 o 16 239.12  2.90776 1029.65     34.0627  997.633     35.5796  169.29     230.13      7.73261     230.13      
1 1 1 15 11 12 o 3  267.52  3.07077 1264.76     40.2732  1272.71     42.0498  270.258    302.159     183.35      302.159     
1 1 1 15 11 13 o 12 195.289 2.71726 674.125     26.5861  677.936     26.6     133.869    60.7434     4.46424     60.7434     
1 1 1 15 11 14 o 13 357.763 3.59259 2287.36     64.4119  2252.02     64.4082  271.472    52.0368     33.6113     52.0368     
1 1 1 15 11 15 o 7  360.322 3.86771 2332.43     71.4991  2272.98     68.1758  373.287    288.168     243.036     288.168     
1 1 1 15 11 16 o 5  298.991 3.61292 1599.46     55.5534  1571.23     52.7008  226.748    178.679     32.7216     178.679     
1 1 1 15 11 17 o 13 515.462 5.32611 4707.75     133.913  4726.37     141.173  436.799    175.878     134.364     175.878     
1 1 1 15 11 18 o 15 221.788 3.0056  860.507     33.3964  883.814     33.4122  197.097    180.171     99.775      180.171     
1 1 1 15 11 19 o 15 322.623 3.76916 1861.16     62.5361  1831.25     59.3239  180.574    210.707     96.8153     30.7067     
1 1 1 15 11 20 o 15 261.156 3.24936 1233.38     42.5162  1185.68     42.5238  140.194    66.281      86.1894     246.281     
1 1 1 15 11 21 o 8  437.881 4.33863 3423.71     95.2027  3381.3      95.2087  313.046    69.2569     1.54686     69.2574     
1 1 1 15 11 22 o 19 232.975 2.935   980.298     34.2471  944.637     34.2776  114.343    275.033     95.6662     95.0333     
1 1 1 15 11 23 o 14 568.89  5.38901 5742.23     146.486  5755.16     160.484  437.897    102.18      62.4986     102.18      
1 1 1 15 11 24 o 14 646.42  5.96369 7430.19     193.181  7424.22     193.204  473.93     151.51      22.6595     151.51      
1 1 1 15 11 25 o 12 303.985 3.2924  1644.04     49.0378  1633.76     51.2429  166.926    166.108     94.9887     346.108     
1 1 1 15 11 26 o 4  500.628 4.71741 4432.03     115.748  4468.04     120.92   391.643    144.758     70.8951     144.758     
1 1 1 15 11 27 o 7  166.678 2.67129 484.43      21.7842  500.792     22.8423  107.894    96.6831     7.31865     276.683     
1 1 1 15 11 28 o 6  174.232 2.59224 548.053     22.1129  528.489     23.1201  55.9541    260.459     128.664     80.4591     
1 1 1 15 11 29 o 2  276.333 3.21919 1333.71     42.5112  1375.31     46.6093  149.064    187.1       90.6941     7.10031     
1 1 1 15 11 30 o 3  280.528 3.23085 1385.23     42.3734  1406.7      48.3161  139.826    279.917     115.164     99.9168     
1 1 1 15 11 31 o 14 108.463 2.51185 213.051     12.7108  204.613     14.4613  47.7326    274.173     43.452      94.1726     
1 1 1 15 11 32 o 6  256.418 3.19363 1126.06     38.1003  1207.39     43.9351  158.763    55.6411     40.125      235.641     
1 1 1 15 11 33 o 18 60.3314 3.26565 65.4596     9.45883  64.4473     10.1198  4.17635    17.625      42.4462     197.625     
1 1 1 15 11 34 o 1  201.284 2.97383 695.113     29.2778  742.607     30.723   198.525    199.278     133.555     199.278     
1 1 1 15 11 35 o 17 133.211 2.52114 310.934     16.0826  318.888     17.533   80.3018    319.597     12.5855     139.597     
1 1 1 15 11 36 o 7  189.413 2.73755 619.119     26.0218  653.765     25.9322  162.675    112.113     73.4904     112.113     
1 1 1 15 11 37 o 18 223.426 2.95428 880.63      32.3448  890.5       33.8036  201.255    57.9206     101.403     57.9206     
1 1 1 15 11 38 o 12 325.29  3.40258 1870.45     55.4688  1885.5      55.4659  242.688    117.786     34.6651     117.786     
1 1 1 15 11 39 o 1  44.6233 3.51847 38.033      7.67188  33.6035     7.76149  10.9428    233.993     47.1115     233.993     
1 1 1 15 11 40 o 14 344.42  3.60159 2114.15     60.7852  2097.88     63.5026  256.706    296.573     37.3594     296.573     
1 1 1 15 11 41 o 10 181.36  2.59139 575.442     21.5006  591.41      25.4859  106.071    297.502     32.1563     117.502     
1 1 1 15 11 42 o 8  187.141 2.64356 605.352     23.7059  637.341     25.8748  104.837    64.1905     43.0233     244.191     
1 1 1 15 11 43 o 13 150.816 2.49753 416.103     17.173   391.255     20.317   119.134    208.903     43.9885     208.903     
1 1 1 15 11 44 o 1  291.273 3.1197  1477.87     44.6029  1534.37     46.4769  244        225.406     91.1297     225.406     
1 1 1 15 11 45 o 2  146.67  2.54856 384.1       18.3603  379.485     19.0773  101.296    16.7478     10.2883     16.7479     
1 1 1 15 11 46 o 5  316.56  3.31246 1741.17     50.3043  1819.25     54.778   246.884    238.045     61.7014     238.045     
1 1 1 15 11 47 o 9  190.02  2.57115 626.358     23.7491  655.414     25.221   137.82     197.538     20.4573     197.538     
1 1 1 15 11 48 o 2  122.492 2.44783 260.896     14.2004  272.146     15.8074  68.6987    104.083     23.3455     284.083     
1 1 1 15 11 49 o 11 149.139 2.54615 385.856     18.9183  403.997     19.1383  107.106    272.248     17.267      272.248     
1 1 1 15 11 50 o 4  215.891 2.71252 802.168     29.6989  853.983     28.9455  160.075    5.49813     30.2121     5.49813     
1 1 1 15 11 51 o 14 151.237 2.64134 389.29      19.2624  423.694     20.7843  89.4963    47.5834     21.6282     227.583     
1 1 1 15 11 52 o 13 314.093 3.15053 1713.82     50.2436  1796.9      48.8749  250.231    251.749     77.3921     251.749     
1 1 1 15 11 53 o 19 110.376 2.49845 218.427     13.6795  214.968     13.921   77.4099    73.351      13.437      73.351      
1 1 1 15 11 54 o 6  126.364 2.53883 265.521     15.632   303.273     16.4822  81.6835    48.1528     1.48924     228.153     
1 1 1 15 11 55 o 14 48.2266 3.47086 39.8935     7.98759  43.9825     8.55898  18.2993    254.381     6.13734     74.3815     
1 1 1 15 11 56 o 3  80.6709 2.64907 109.708     10.5125  122.61      10.8384  57.5942    21.941      18.9794     21.941      
1 1 1 15 11 57 o 15 167.276 2.54253 497.31      21.2404  498.727     21.3872  135.28     204.894     52.1113     204.894     
1 1 1 15 11 58 o 14 86.133  2.59623 127.175     10.8445  137.633     11.5206  58.6802    358.839     10.4197     358.839     
1 1 1 15 11 59 o 17 22.5056 5.24262 10.5329     6.66704  6.75719     7.2378   7.21021    0.484801    28.6371     0.484801    
1 1 1 15 11 60 o 9  101.646 2.38864 177.071     12.0412  191.478     12.2533  73.3519    193.078     15.8322     193.078     
1 1 1 15 11 61 o 15 121.087 2.60091 273.917     16.5195  249.927     15.0175  79.893     305.874     2.45078     305.874     
1 1 1 15 11 62 o 3  91.8663 2.89027 153.718     13.919   148.718     12.6125  54.4505    149.752     9.0601      329.752     
1 1 1 15 11 63 o 3  76.8443 3.18792 114.758     12.5285  98.1167     11.9001  49.5846    192.644     2.11781     192.644     
1 1 1 15 11 64 o 12 104.114 2.73409 212.013     14.6381  177.25      13.818   59.001     355.764     15.7795     175.764     
1 1 1 15 11 65 o 12 69.9005 3.25414 84.7769     11.3663  91.8001     11.2868  46.5727    56.7582     6.0467      56.7582     
1 1 1 15 11 66 o 11 32.7404 5.36886 23.2969     8.75439  17.918      8.56988  13.4404    98.7241     4.54815     98.7241     
1 1 1 15 11 67 o 18 88.2303 2.99584 141.042     13.273   139.397     13.1424  61.7113    283.717     12.2733     283.717     
1 1 1 15 11 68 o 15 36.3493 5.18727 28.6371     9.30103  22.0267     8.95142  8.79208    175.878     24.8882     355.878     
1 1 1 15 11 69 o 16 19.7237 5.56057 7.64523     8.44761  -0.881711   8.71891  1.265      279.238     5.07856     99.2385     
1 1 1 15 11 70 o 12 78.3236 3.30051 109.194     12.5822  113.551     13.2108  52.0995    9.5922      6.51981     9.5922      
1 1 1 15 11 71 o 18 21.4282 5.73566 6.31521     8.91743  7.27025     8.01578  0.592591   307.076     23.3127     307.076     
1 1 1 15 11 72 o 14 30.4861 5.63753 19.7899     9.34944  16.9852     8.0761   4.55928    304.223     26.171      124.223     
1 1 1 15 11 73 o 19 59.4974 3.96631 70.1102     12.3793  61.6873     11.0053  33.5572    246.605     5.7196      66.6049     
1 1 1 15 11 74 f 0  18.8819 5.57243 1.18392     10.0726  3.71918     7.62983  15.8865    349.872     0           0           
1 1 1 15 11 75 o 10 18.6092 5.67083 6.90831     10.0909  -13.5167    11.1501  1.61958    6.4713      2.74804     186.471     
1 1 1 15 11 76 o 17 22.1938 6.40029 3.42305     10.9423  8.23962     11.6149  4.35877    297.245     1.72624     117.245     
1 1 1 15 11 77 o 3  50.2097 5.96211 42.772      14.472   59.3398     14.1557  33.5813    128.18      9.49284     128.18      
1 1 1 15 11 78 o 2  23.8629 6.5408  14.0455     11.2071  2.06428     12.1992  3.75451    194.41      15.014      14.4095     
1 1 1 15 11 79 o 17 20.436  5.79926 14.2374     10.9834  -17.654     11.021   3.82286    21.6799     4.62263     201.68      
1 1 1 15 11 80 o 9  21.6909 6.13889 10.2466     9.43642  -0.991435   12.0986  2.76685    328.481     15.8746     148.481     
1 1 1 15 11 81 o 19 21.4189 6.47601 2.08384     12.5936  4.52001     12.1317  5.47878    118.273     2.31815     298.273     
1 1 1 15 11 82 o 16 30.9386 7.38478 17.9479     14.0808  23.9571     13.3673  7.18842    225.212     19.6064     45.2123     
1 1 1 15 11 83 o 7  20.1301 6.32074 0.434565    12.9685  0.46922     12.5155  1.99869    97.5723     11.831      277.572     
1 1 1 15 11 84 o 7  30.0166 7.56439 16.2948     14.2388  25.4828     14.7803  10.7932    115.276     3.31413     115.276     
1 1 1 15 11 85 o 16 24.1378 7.05781 21.5005     16.0352  -6.45804    13.8458  4.50192    108.826     5.14986     288.826     
1 1 1 15 11 86 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 12 0  o 19 40.7329 3.50613 30.6898     6.87452  30.6898     6.87452  65.7584    2.23244e-05 160.612     2.23244e-05 
1 1 1 15 12 1  o 4  145.367 2.4411  370.444     17.7815  378.667     17.7834  63.7863    273.485     63.0056     93.4848     
1 1 1 15 12 2  o 19 431.361 4.12939 3301.2      89.2672  3299.27     89.2652  259.003    248.931     106.144     68.9313     
1 1 1 15 12 3  o 13 159     2.52031 447.46      20.5025  448.751     19.6517  87.4644    138.315     35.1622     318.315     
1 1 1 15 12 4  o 3  45.2839 3.14234 35.0185     6.86061  38.4306     7.21846  64.9634    30.7117     165.561     30.7117     
1 1 1 15 12 5  o 3  312.163 3.4413  1752.37     53.8365  1703.44     53.8255  333.008    151.08      237.108     151.08      
1 1 1 15 12 6  f 0  289.171 3.22381 1496.85     47.7337  1468.31     45.6964  192.716    256.111     0           0           
1 1 1 15 12 7  o 5  375.121 3.79983 2505.58     69.8603  2485.49     72.9579  277.744    148.34      16.9946     148.34      
1 1 1 15 12 8  o 12 455.937 4.28887 3670.51     97.9912  3704.78     97.9991  256.75     191.367     146.422     11.3667     
1 1 1 15 12 9  o 8  376.266 3.98735 2527.29     76.9687  2494.98     73.3823  322.522    7.68767     107.42      7.68767     
1 1 1 15 12 10 o 18 238.131 3.28626 1013.15     39.2209  997.804     39.2121  71.5621    291.425     194.868     111.425     
1 1 1 15 12 11 o 4  228.656 3.29078 927.218     38.7921  926.903     36.5935  112.172    312.022     96.9666     132.022     
1 1 1 15 12 12 o 15 234.592 3.34678 971.885     38.1828  979.85      40.4844  170.823    202.05      16.282      202.05      
1 1 1 15 12 13 o 10 319.399 3.97728 1803.82     61.7667  1815.44     65.5136  209.067    95.3566     36.9804     275.357     
1 1 1 15 12 14 o 4  185.382 2.98675 602.993     27.7405  615.679     27.7529  124.389    194.014     0.310669    14.0144     
1 1 1 15 12 15 f 0  204.336 3.09647 753.98      31.7007  726.819     31.7077  117.137    332.911     0           0           
1 1 1 15 12 16 o 16 218.982 3.1638  859.744     34.7233  840.938     34.7134  145.712    58.8226     10.7479     238.823     
1 1 1 15 12 17 o 2  287.33  3.53761 1481.14     52.2815  1447.54     49.587   187.493    308.045     30.9649     128.045     
1 1 1 15 12 18 f 0  307.809 3.49024 1664.85     52.542   1696.14     55.1256  134.302    264.64      0           0           
1 1 1 15 12 19 o 2  228.213 3.00951 903.296     35.1824  943.944     33.5894  162.249    302.316     9.94327     302.315     
1 1 1 15 12 20 o 14 245.017 3.01627 1063.75     37.0343  1065.32     37.038   223.978    272.106     115.031     272.106     
1 1 1 15 12 21 o 1  148.959 2.51439 394.694     18.3471  392.048     19.1803  70.9921    311.734     55.4694     131.734     
1 1 1 15 12 22 o 5  40.9594 3.41887 27.3314     6.64816  33.153      7.09954  68.3974    221.138     172.197     221.138     
1 1 1 15 12 23 o 12 410.561 3.9867  3012.53     78.4998  2969.82     85.3561  316.482    279.783     47.7347     279.783     
1 1 1 15 12 24 o 9  457.497 4.51949 3736.42     98.7621  3695.53     108.204  400.89     346.933     149.605     346.933     
1 1 1 15 12 25 o 16 446.721 4.33478 3555.05     94.8905  3530.18     99.1331  312.389    37.3598     13.0729     217.36      
1 1 1 15 12 26 o 7  317.292 3.47475 1774.23     55.2452  1797.88     55.2558  161.39     293.413     128.122     113.413     
1 1 1 15 12 27 o 1  356.03  3.83654 2251.8      66.8159  2247.28     70.0468  237.855    314.28      30.1137     134.28      
1 1 1 15 12 28 o 7  76.8799 2.75134 103.352     10.599   106.825     10.529   22.4889    52.5967     40.455      232.597     
1 1 1 15 12 29 o 18 291.058 3.42702 1504.19     49.9892  1501.93     49.9847  189.459    307.888     31.295      127.888     
1 1 1 15 12 30 o 9  165.993 2.58821 495.709     21.5373  481.537     21.5202  119.029    65.9958     14.1462     65.9959     
1 1 1 15 12 31 o 4  345.12  3.75871 2108.04     66.5381  2120.21     63.4318  304.278    359.804     124.058     359.804     
1 1 1 15 12 32 o 7  59.4133 2.99677 65.5128     9.1187   60.4077     8.61195  37.5502    7.36955     145.805     7.36955     
1 1 1 15 12 33 f 0  40.4496 3.80022 31.3767     7.14772  27.7874     7.7872   15.2184    255.968     0           0           
1 1 1 15 12 34 o 4  112.993 2.47036 230.758     13.3902  222.523     14.5065  62.3744    210.794     17.8603     30.7937     
1 1 1 15 12 35 o 5  106.198 2.39615 200.53      11.9803  199.854     13.4463  69.8759    198.111     18.6377     198.111     
1 1 1 15 12 36 o 4  152.654 2.55179 408.667     17.8611  418.197     21.0659  100.328    264.362     1.88405     84.3616     
1 1 1 15 12 37 o 13 126.065 2.46846 285.577     14.952   278.56      16.1665  97.5397    300.547     66.1331     300.547     
1 1 1 15 12 38 o 2  240.983 2.83563 997.422     33.5668  1063.57     34.9269  202.088    9.62352     75.1684     9.62352     
1 1 1 15 12 39 o 15 133.529 2.42469 313.846     15.2272  318.814     17.1627  62.9457    273.009     50.6275     93.009      
1 1 1 15 12 40 o 5  221.542 2.84288 853.123     30.8601  888.662     32.2686  175.709    302.97      50.493      302.97      
1 1 1 15 12 41 o 8  123.635 2.49196 264.686     15.4516  278.092     15.3877  49.3385    131.813     64.0155     311.813     
1 1 1 15 12 42 o 8  161.264 2.74709 454.686     22.7451  468.522     21.6017  133.299    184.906     55.7805     184.906     
1 1 1 15 12 43 o 1  266.484 3.13752 1239.84     42.8221  1281.87     40.9161  175.589    131.98      14.4592     311.98      
1 1 1 15 12 44 o 2  102.995 2.49437 200.305     12.4119  176.928     13.1995  67.5051    86.4504     7.1149      86.4504     
1 1 1 15 12 45 o 8  196.674 2.53809 699.151     24.4892  673.819     25.5068  115.971    54.2573     35.2996     234.257     
1 1 1 15 12 46 o 17 88.6116 2.54386 143.492     11.2773  135.742     11.2625  63.8657    356.059     23.7516     356.059     
1 1 1 15 12 47 o 17 134.184 2.35401 315.2       15.8281  324.116     15.8157  99.9106    89.5123     23.5859     89.5123     
1 1 1 15 12 48 o 2  91.1992 2.55982 147.055     11.8859  148.777     11.4594  60.7545    67.8595     8.63407     67.8594     
1 1 1 15 12 49 o 11 87.2191 2.63745 132.271     11.3704  138.496     11.6324  39.5622    144.238     31.9176     324.238     
1 1 1 15 12 50 o 9  85.5472 2.68785 119.801     11.1138  141.223     11.8655  49.7701    155.924     7.24048     335.924     
1 1 1 15 12 51 o 13 81.841  2.80367 121.623     11.5867  117.12      11.343   59.8273    23.1152     23.6905     23.1152     
1 1 1 15 12 52 o 3  125.04  2.39203 278.208     15.4424  277.793     14.4937  95.9932    26.3865     29.4409     26.3865     
1 1 1 15 12 53 o 1  160.137 2.55938 450.691     21.0611  461.292     19.9886  129.478    253.773     47.5703     253.773     
1 1 1 15 12 54 o 3  107.786 2.45044 206.123     12.6264  207.496     13.7894  44.7966    157.628     51.3625     337.628     
1 1 1 15 12 55 o 13 111.951 2.40679 209.396     13.1525  237.297     13.8155  72.2647    69.0926     0.204228    249.092     
1 1 1 15 12 56 o 13 88.943  2.51493 151.127     10.8338  131.28      11.4445  46.5587    239.009     19.8959     59.0093     
1 1 1 15 12 57 o 6  40.7001 3.90732 26.7713     7.36333  33.8871     8.15123  11.0796    179.214     18.7642     359.214     
1 1 1 15 12 58 f 0  75.4327 2.74163 98.1743     9.88254  105.349     10.7784  55.5035    45.3207     0           0           
1 1 1 15 12 59 f 0  72.7708 2.82614 89.0912     10.1147  100.701     10.405   46.6256    354.205     0           0           
1 1 1 15 12 60 o 4  65.123  2.90216 69.2577     9.03119  83.2532     9.80997  38.2357    64.6849     5.54592     244.685     
1 1 1 15 12 61 o 14 60.2961 3.22466 66.8003     9.70635  64.3003     9.6354   38.0525    34.5164     1.41699     34.5164     
1 1 1 15 12 62 o 19 159.141 2.60139 458.515     20.7929  446.651     20.6989  108.956    314.091     10.0959     314.091     
1 1 1 15 12 63 o 14 28.6693 5.87165 10.0739     9.03722  20.9114     9.38935  0.621402   98.2019     30.2553     278.202     
1 1 1 15 12 64 o 10 72.595  3.16235 100.498     12.2252  89.8388     10.6794  42.7608    216.936     6.26316     36.9356     
1 1 1 15 12 65 o 14 16.2737 5.01464 2.89595     8.21549  -7.43212    7.76621  7.80047    239.785     27.8267     239.785     
1 1 1 15 12 66 o 15 58.8247 3.72313 65.9199     11.1862  60.4552     10.5361  34.9398    136.315     2.718       316.315     
1 1 1 15 12 67 o 13 69.6217 3.39584 86.318      12.0461  89.6428     11.4817  48.7367    134.222     10.9525     134.222     
1 1 1 15 12 68 o 11 71.9783 3.41034 93.4056     12.518   94.8721     11.9291  45.9442    240.554     1.86104     240.554     
1 1 1 15 12 69 o 7  82.1256 3.35109 122.623     14.3041  122.466     13.135   66.6663    331.147     30.866      331.147     
1 1 1 15 12 70 o 9  29.2187 6.38101 18.9662     10.3416  14.3602     10.3453  14.1181    126.692     5.14076     126.692     
1 1 1 15 12 71 o 11 96.221  3.31223 166.912     15.9948  170.728     15.8487  56.0303    349.475     9.11304     169.475     
1 1 1 15 12 72 o 8  49.4147 4.88198 40.7212     11.8128  53.0745     11.4282  17.5493    156.784     25.4623     336.784     
1 1 1 15 12 73 o 18 55.7854 4.69358 60.565      12.5049  58.076      13.1834  31.37      173.128     5.23648     353.128     
1 1 1 15 12 74 o 15 63.5399 3.87913 80.5226     12.0644  70.3252     12.3217  38.8308    143.91      0.0341676   143.911     
1 1 1 15 12 75 o 8  25.3726 6.61646 9.17271     10.0356  14.4182     12.1758  8.73457    172.427     5.58888     352.427     
1 1 1 15 12 76 o 8  53.113  5.11714 51.8253     13.5344  58.4062     12.8753  36.7548    333.316     11.4822     333.316     
1 1 1 15 12 77 o 4  20.7689 6.16331 3.8892      10.9531  3.68321     10.7101  0.438356   136.318     20.0308     136.318     
1 1 1 15 12 78 o 16 22.528  6.28769 -1.42484    11.2549  13.2414     11.0276  2.97836    265.192     0.16721     85.1916     
1 1 1 15 12 79 o 9  27.2191 6.87368 20.1894     12.4161  7.91922     12.1018  12.8025    200.791     0.757495    200.791     
1 1 1 15 12 80 o 15 46.2979 7.06744 54.9965     16.4508  38.0291     15.5036  23.7117    94.1814     6.31261     274.181     
1 1 1 15 12 81 o 2  19.9803 6.36078 1.3059      13.6825  -5.29516    13.2064  0.215961   320.115     18.7134     140.115     
1 1 1 15 12 82 f 0  26.7669 7.37028 6.99093     14.302   20.3636     14.903   15.5222    298.718     0           0           
1 1 1 15 12 83 o 3  50.2456 7.12402 61.6016     16.9395  52.8871     17.6513  28.4112    191.126     0.105522    191.126     
1 1 1 15 12 84 o 9  18.6584 6.07944 -1.38603    13.239   -6.62289    13.1679  0.177762   14.4349     5.51889     194.435     
1 1 1 15 12 85 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 13 0  o 11 606.735 6.00601 6534.98     182.538  6534.98     182.538  484.173    2.14148e-06 78.8761     2.14148e-06 
1 1 1 15 13 1  o 7  546.562 5.65087 5313.68     150.654  5297.1      158.786  386.882    79.9966     21.2788     259.997     
1 1 1 15 13 2  f 0  95.4025 2.88391 162.792     13.3361  160.525     14.1572  76.6947    280.097     0           0           
1 1 1 15 13 3  o 17 100.942 2.73115 180.343     13.8056  181.452     13.7748  25.3917    272.584     65.0185     92.584      
1 1 1 15 13 4  o 4  186.126 2.99273 626.252     27.8966  602.299     27.9246  160.241    337.469     82.6356     337.469     
1 1 1 15 13 5  o 15 302.337 3.85251 1641.62     60.0862  1601.28     56.6407  229.488    354.169     28.674      354.169     
1 1 1 15 13 6  o 3  99.7266 2.9677  176.939     14.7778  176.348     14.8192  32.7105    339.075     38.7386     159.075     
1 1 1 15 13 7  o 9  68.6988 3.31039 85.1408     10.9473  83.025      11.686   18.9048    103.132     102.017     103.132     
1 1 1 15 13 8  o 3  119.005 2.86166 249.346     17.5261  253.423     16.5335  19.0756    1.5667      116.464     181.567     
1 1 1 15 13 9  o 6  184.455 3.17136 607.296     31.0861  599.752     27.4238  59.9921    82.7409     136.98      262.741     
1 1 1 15 13 10 o 9  198.247 3.06246 706.354     32.0722  687.483     28.7277  150.845    73.9338     33.7435     73.9338     
1 1 1 15 13 11 o 5  54.5631 3.21378 57.9684     8.90489  48.5612     8.48827  73.0044    6.05329     203.137     6.05329     
1 1 1 15 13 12 o 1  376.152 3.99401 2491.03     73.4952  2529.69     77.065   317.969    122.323     97.8869     122.323     
1 1 1 15 13 13 o 12 40.942  3.50736 32.7482     7.39263  27.6902     6.70904  24.1217    197.389     61.7269     197.389     
1 1 1 15 13 14 o 16 434.169 4.14859 3324.74     90.2596  3365.23     90.2682  304.087    119.298     17.3225     299.298     
1 1 1 15 13 15 o 16 283.71  3.10524 1404.74     44.1386  1450.21     44.1531  220.111    356.692     40.1189     356.692     
1 1 1 15 13 16 o 16 228.24  2.78995 903.179     31.9034  944.346     31.908   200.13     298.56      88.8909     298.56      
1 1 1 15 13 17 o 19 292.45  3.30411 1531.87     48.4298  1502.03     48.4164  241.43     160.274     70.2355     160.274     
1 1 1 15 13 18 o 3  240.145 2.99622 1014.39     36.0499  1030.98     36.0655  173.266    156.169     10.3084     156.169     
1 1 1 15 13 19 o 19 273.104 3.11862 1324.24     43.5905  1321.28     41.7568  188.823    237.765     8.94932     57.7655     
1 1 1 15 13 20 o 4  638.935 6.08268 7300.7      190.043  7218.99     199.319  482.051    261.952     41.8356     261.952     
1 1 1 15 13 21 o 7  155.454 2.64767 428.377     20.1325  428.581     21.1091  110.483    100.888     13.8467     100.888     
1 1 1 15 13 22 o 18 236.69  3.11232 988.892     36.9121  998.344     36.9209  197.598    81.8422     64.5562     81.8422     
1 1 1 15 13 23 o 5  366.344 3.98764 2394.15     73.2141  2369.9      73.2029  300.269    107.275     77.5991     107.275     
1 1 1 15 13 24 o 15 458.626 4.71907 3710.12     108.452  3762.16     108.467  342.031    164.068     26.5912     164.068     
1 1 1 15 13 25 o 8  216.449 2.9242  812.141     32.4228  849.895     30.9526  114.353    119.429     76.0929     299.429     
1 1 1 15 13 26 o 5  34.4897 4.10567 20.6625     6.66093  22.7519     7.02974  12.819     299.764     36.1018     299.764     
1 1 1 15 13 27 o 19 236.73  3.12908 987.819     35.2477  1000.45     38.9266  190.561    235.835     50.7073     235.835     
1 1 1 15 13 28 o 14 197.432 2.69231 692.565     26.039   689.982     27.2218  136.967    284.408     0.709793    284.408     
1 1 1 15 13 29 o 17 531.022 4.87448 4976.09     124.218  5047.56     135.062  406.763    123.537     56.8018     123.537     
1 1 1 15 13 30 o 17 244.36  2.89972 1042.43     34.7247  1076.04     36.2954  186.208    269.735     31.7958     269.735     
1 1 1 15 13 31 o 17 26.4658 4.66924 10.968      6.03297  14.967      6.36715  15.3604    142.891     36.2331     142.891     
1 1 1 15 13 32 o 6  157.932 2.91495 447.955     21.6772  437.348     24.3268  92.869     70.7274     28.1529     250.727     
1 1 1 15 13 33 o 9  113.252 2.50195 239.554     13.837   216.112     14.4598  57.4792    189.196     30.4629     9.19587     
1 1 1 15 13 34 o 10 100.339 2.47056 177.854     12.0639  179.675     12.738   62.2793    231.137     11.0485     231.136     
1 1 1 15 13 35 o 7  216.667 2.80403 860.599     29.7318  805.411     31.0762  146.664    24.9023     5.20748     204.902     
1 1 1 15 13 36 o 4  81.3695 2.67426 117.013     10.663   118.382     11.0853  25.1783    353.841     44.8029     173.841     
1 1 1 15 13 37 o 12 224.274 2.92538 888.247     34.9795  896.65      30.6118  179.508    166.405     51.972      166.405     
1 1 1 15 13 38 o 19 183.857 2.56796 602.974     23.2193  596.249     24.0888  111.375    131.415     27.8203     311.415     
1 1 1 15 13 39 o 4  366.542 3.52463 2355.45     64.7437  2416.3      64.7356  325.199    103.067     141.24      103.067     
1 1 1 15 13 40 o 19 62.0424 2.865   72.7816     8.52556  64.5405     9.11818  10.2735    293.056     42.559      113.056     
1 1 1 15 13 41 o 6  251.19  2.77026 1129.73     34.2454  1109.75     35.4757  175.27     326.509     4.68892     326.509     
1 1 1 15 13 42 o 14 294.116 3.11017 1491.77     46.6872  1580.94     44.8978  179.365    47.3529     48.1018     227.353     
1 1 1 15 13 43 o 8  68.8506 2.8711  79.5726     9.84264  89.4741     9.85596  23.8309    338.937     33.3318     158.937     
1 1 1 15 13 44 o 3  313.75  3.30947 1732.2      53.1057  1766.26     50.9178  280.669    184.465     129.847     184.465     
1 1 1 15 13 45 o 17 84.6416 2.72966 130.617     11.6476  124.368     11.4472  24.9838    289.039     59.4144     109.039     
1 1 1 15 13 46 o 4  167.763 2.55474 487.116     21.4999  512.476     21.4452  109.324    258.078     7.99137     78.0783     
1 1 1 15 13 47 o 12 170.297 2.5024  526.967     21.4204  503.134     21.2865  116.453    270.47      3.30565     270.47      
1 1 1 15 13 48 o 5  98.2121 2.58498 171.764     12.3712  171.393     13.0207  60.9197    125.893     4.36871     305.893     
1 1 1 15 13 49 o 14 34.3309 4.42169 26.3489     7.4667   17.448      7.12548  1.18456    121.051     22.2268     121.051     
1 1 1 15 13 50 o 3  26.7744 4.96298 16.947      6.99388  9.71126     6.72606  6.41912    138.263     24.1392     138.263     
1 1 1 15 13 51 o 17 109.418 2.44923 214.965     13.8338  211.054     12.9858  94.1433    310.633     49.7091     310.633     
1 1 1 15 13 52 o 17 20.4705 5.09229 -1.56475    6.67128  12.2966     7.73038  15.943     165.584     42.4015     165.584     
1 1 1 15 13 53 o 4  115.547 2.73399 247.147     16.5631  228.958     15.059   74.8135    247.507     1.31511     67.5077     
1 1 1 15 13 54 o 11 60.7972 3.3873  55.4996     10.0583  78.3238     10.1821  35.4074    135.622     3.91632     135.622     
1 1 1 15 13 55 o 6  31.2108 5.11768 21.1434     8.09183  15.5514     7.66023  0.636888   129.034     16.1296     309.034     
1 1 1 15 13 56 o 4  66.625  2.91175 73.3448     9.56808  85.8885     9.74593  38.9711    9.10649     4.17422     189.106     
1 1 1 15 13 57 o 6  84.8894 2.64026 126.814     11.0788  130.651     11.3309  55.9939    310.987     2.66675     310.987     
1 1 1 15 13 58 o 18 26.8161 5.25799 17.4621     6.96668  8.7191      8.32193  4.93749    292.205     11.2194     112.205     
1 1 1 15 13 59 o 3  21.7176 5.22898 12.315      7.17739  1.841       7.51349  5.41413    329.206     30.7215     329.206     
1 1 1 15 13 60 f 0  16.4832 4.77828 6.96028     7.48074  -10.1004    6.91499  1.95123    101.359     0           0           
1 1 1 15 13 61 o 3  15.9353 4.89916 -2.24086    7.56883  0.232403    7.08539  1.08853    211.885     4.18181     211.885     
1 1 1 15 13 62 o 19 49.9281 3.81225 46.4712     9.59976  44.6798     9.17608  23.4454    167.754     14.6163     347.754     
1 1 1 15 13 63 o 4  29.9626 5.84949 23.0718     9.9089   11.6743     8.65683  6.8399     302.988     1.68615     302.988     
1 1 1 15 13 64 o 2  77.6825 3.14401 122.081     12.7465  96.5656     11.6091  51.8778    2.80247     5.12603     2.80248     
1 1 1 15 13 65 o 16 32.5571 5.5999  23.0635     9.56885  18.0543     8.56212  6.33606    245.599     24.8493     65.599      
1 1 1 15 13 66 o 17 33.2615 5.99696 18.0676     10.9042  24.9122     9.40463  16.8523    38.9971     5.97468     38.9971     
1 1 1 15 13 67 o 17 68.1697 3.88291 79.4791     13.626   91.0169     12.5073  41.2901    8.43835     3.02927     188.438     
1 1 1 15 13 68 o 9  72.6104 3.76436 98.6058     14.1368  94.6168     13.0634  62.3249    23.5418     34.7786     23.5419     
1 1 1 15 13 69 f 0  68.5299 3.98671 97.1717     14.1411  76.8671     12.9647  44.1785    153.671     0           0           
1 1 1 15 13 70 f 0  68.4792 3.77323 87.838      13.5106  85.2151     12.1601  32.941     289.658     0           0           
1 1 1 15 13 71 o 3  52.2402 4.57935 58.7502     12.3701  45.2268     11.0642  32.3441    119.779     0.942572    119.779     
1 1 1 15 13 72 o 10 23.8656 6.04464 3.06634     10.2294  15.1306     9.35964  4.36188    334.571     16.3744     154.571     
1 1 1 15 13 73 o 3  58.9147 4.17469 60.8245     12.4881  70.1208     11.6718  31.8985    281.467     8.47397     101.467     
1 1 1 15 13 74 o 12 39.3336 5.90608 20.1368     11.7055  43.8938     11.1988  21.3094    242.568     2.43074     62.5679     
1 1 1 15 13 75 o 8  42.6626 6.37132 52.1393     13.4504  24.8273     13.2862  21.3338    22.5696     6.78435     202.57      
1 1 1 15 13 76 o 1  26.6741 6.99706 14.985      12.5775  11.8355     12.3569  9.58318    23.6529     4.35762     203.653     
1 1 1 15 13 77 o 18 27.1313 7.03814 11.7975     12.6888  16.3295     12.5123  4.87807    7.20754     19.502      187.208     
1 1 1 15 13 78 o 14 27.1665 7.13534 12.754      13.0157  15.4167     12.9259  11.3906    67.1595     4.4051      247.16      
1 1 1 15 13 79 f 0  35.9633 7.44187 32.0663     13.9497  25.3774     14.8463  13.9916    254.215     0           0           
1 1 1 15 13 80 o 12 48.2171 6.79059 58.7293     16.2283  42.0026     15.4415  25.7866    211.581     4.68679     31.5806     
1 1 1 15 13 81 o 7  21.2997 6.50394 8.16419     12.968   -2.46679    12.8931  4.02354    115.436     8.80986     295.436     
1 1 1 15 13 82 o 1  37.2513 7.37033 26.569      14.4087  39.195      14.6408  21.5228    72.5109     5.81991     72.5109     
1 1 1 15 13 83 o 11 37.4877 7.47124 37.6144     14.7232  30.2863     14.7163  18.4609    320.885     1.64084     140.885     
1 1 1 15 13 84 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 14 0  o 19 820.988 7.86713 11981.2     323.544  11981.2     323.544  546.133    180         113.037     8.65135e-06 
1 1 1 15 14 1  o 1  228.655 3.22296 915.627     36.931   938.833     36.9273  161.515    228.516     3.0153      228.516     
1 1 1 15 14 2  o 17 304.478 3.75128 1647.36     57.2338  1641.85     57.2451  283.678    302.123     137.277     302.123     
1 1 1 15 14 3  o 14 338.222 3.90535 2034.38     67.9083  2024.75     64.4433  218.97     250.279     49.3791     70.2792     
1 1 1 15 14 4  o 4  245.881 3.1735  1069.27     39.0915  1075.02     39.1168  155.146    93.0946     37.7789     273.095     
1 1 1 15 14 5  o 10 279.998 3.6864  1386.6      50.1697  1394.93     53.2476  245.238    303.74      96.2269     303.74      
1 1 1 15 14 6  o 9  142.094 2.98933 353.014     21.2461  363.715     21.2772  86.1287    18.1954     8.48338     198.195     
1 1 1 15 14 7  o 2  209.755 2.96346 775         31.1411  785.35      31.1602  139.803    339.866     11.9048     159.866     
1 1 1 15 14 8  o 9  208.867 2.82828 779.276     29.6002  767.792     29.607   87.6269    168.139     119.448     348.139     
1 1 1 15 14 9  o 9  115.271 2.49438 237.606     14.4006  233.962     14.3835  62.7702    359.995     17.6207     359.995     
1 1 1 15 14 10 o 8  269.747 3.41735 1286.91     47.3857  1294.36     44.9678  228.852    299.48      77.6269     299.48      
1 1 1 15 14 11 o 15 94.2138 2.55664 160.959     12.0432  154.272     12.0498  29.4195    229.838     0.418601    229.838     
1 1 1 15 14 12 o 10 323.999 3.7316  1885.82     63.5811  1839.19     57.5147  232.994    303.494     1.20133     303.495     
1 1 1 15 14 13 o 11 219.091 3.09663 842.984     33.1039  859.607     34.887   122.791    264.962     63.7507     84.9617     
1 1 1 15 14 14 o 18 311.669 3.61803 1740.29     59.291   1706.4      53.6386  232.491    27.3851     18.8752     27.3851     
1 1 1 15 14 15 o 3  100.454 2.807   182.457     14.1292  176.001     14.0745  15.8315    327.216     97.8141     147.216     
1 1 1 15 14 16 o 4  113.612 2.77275 233.914     15.7491  224.44      15.7718  67.3918    320.757     4.20925     140.757     
1 1 1 15 14 17 o 19 236.253 3.26828 997.233     38.7085  982.88      38.6805  168.415    267.801     2.60718     267.801     
1 1 1 15 14 18 o 8  281.678 3.94667 1418.34     53.8071  1397.97     57.524   262.465    70.0063     126.309     70.0063     
1 1 1 15 14 19 o 5  248.152 3.56962 1078.54     44.3718  1106.75     44.4063  146.648    109.111     60.616      289.111     
1 1 1 15 14 20 o 2  268.845 3.71155 1265.69     49.9961  1299.66     50.0087  180.582    18.7839     22.5727     198.784     
1 1 1 15 14 21 o 4  112.546 2.7728  228.077     15.5957  221.742     15.6315  27.3704    313.168     97.4075     133.168     
1 1 1 15 14 22 o 11 364.69  4.12722 2351.26     77.3666  2371.28     73.423   266.329    50.9955     9.60497     50.9955     
1 1 1 15 14 23 o 18 177.177 2.80378 549.086     24.8896  564.426     24.8967  134.599    104.11      25.4137     104.11      
1 1 1 15 14 24 o 16 212.842 3.01893 825.434     31.3166  781.998     33.0002  145.947    61.1902     6.75342     241.19      
1 1 1 15 14 25 o 12 127.911 2.69138 287.42      17.208   293.424     17.257   78.9523    13.8332     11.0547     193.833     
1 1 1 15 14 26 o 7  108.956 2.7121  207.256     14.3422  214.382     15.2275  59.0758    309.867     20.8474     129.867     
1 1 1 15 14 27 o 2  290.626 3.42463 1473.17     49.8621  1524.88     49.8831  249.73     282.326     89.7944     282.326     
1 1 1 15 14 28 o 17 48.7055 3.49162 46.9651     8.32935  38.3261     8.39273  4.9375     358.786     36.9146     358.786     
1 1 1 15 14 29 o 18 135.244 2.5715  333.738     17.3145  315.631     17.4954  72.9674    304.531     35.4508     124.531     
1 1 1 15 14 30 o 19 358.452 3.71811 2284.64     66.7771  2277.71     66.8035  238.213    110.506     32.0228     290.506     
1 1 1 15 14 31 o 17 103.882 2.81207 192.013     14.1988  191.411     15.0132  16.9418    309.212     103.404     129.212     
1 1 1 15 14 32 o 16 195.399 2.71412 678.851     25.9815  675.669     27.1572  154.15     314.242     41.0193     314.242     
1 1 1 15 14 33 o 19 345.091 3.5707  2115.94     61.7465  2112.6      61.7566  273.479    7.12262     61.3441     7.12262     
1 1 1 15 14 34 o 5  228.585 2.8443  924.827     32.589   929.178     32.5756  165.134    150.327     13.3936     150.327     
1 1 1 15 14 35 o 6  313.804 3.30136 1748.54     51.9186  1747.35     51.9162  205.026    241.008     30.2549     61.0083     
1 1 1 15 14 36 o 2  149.565 2.56936 401.668     19.2459  391.975     19.268   79.3505    101.241     43.6666     281.241     
1 1 1 15 14 37 o 10 382.228 3.84451 2577.04     72.0235  2614.27     75.2448  301.484    268.353     67.3727     268.353     
1 1 1 15 14 38 o 9  234.728 2.83982 967.121     33.3983  988.459     33.4095  196.48     158.751     70.1646     158.751     
1 1 1 15 14 39 o 12 231.044 2.88394 930.84      32.6553  964.25      34.1304  180.356    353.547     42.4363     353.547     
1 1 1 15 14 40 o 9  242.982 2.89497 1026.09     34.5932  1070.34     35.9139  194.921    329.255     54.7304     329.255     
1 1 1 15 14 41 o 4  279.098 2.99326 1371.1      41.0705  1395.41     42.6581  199.924    210.849     12.8216     210.849     
1 1 1 15 14 42 o 9  95.8435 2.61196 160.43      12.5448  166.184     12.4954  29.2911    221.731     68.3242     41.7313     
1 1 1 15 14 43 o 3  136.454 2.51737 331.198     16.6155  330.283     17.7629  89.7935    196.505     3.70014     16.5053     
1 1 1 15 14 44 o 15 123.754 2.42648 272.345     14.7968  271.811     15.2671  104.037    169.318     47.1727     169.318     
1 1 1 15 14 45 o 6  103.886 2.45747 186.199     12.784   197.567     12.7587  43.9435    7.41856     49.8461     187.419     
1 1 1 15 14 46 o 9  168.238 2.49501 500.381     20.9875  505.015     21.0839  104.723    334.748     18.8925     154.748     
1 1 1 15 14 47 o 18 164.226 2.58604 476.561     21.6768  481.866     20.8772  148.717    191.243     78.3287     191.243     
1 1 1 15 14 48 o 7  60.285  3.32724 74.8753     9.95096  56.0344     9.83564  33.8313    149.779     7.96398     149.779     
1 1 1 15 14 49 o 12 130.191 2.46547 304.839     16.0465  298.118     16.0938  75.0873    105.514     23.9018     285.514     
1 1 1 15 14 50 o 10 41.7065 4.11178 27.6826     8.29253  35.9852     8.29777  9.19128    155.432     20.0195     335.432     
1 1 1 15 14 51 o 5  108.721 2.50202 203.79      13.2808  217.282     13.9499  72.1401    110.359     2.10335     110.359     
1 1 1 15 14 52 o 12 127.41  2.47155 277.924     15.4061  300.41      16.1281  108.936    84.867      51.9405     84.867      
1 1 1 15 14 53 o 18 17.9118 5.03279 0.66642     7.04981  4.94723     6.68004  4.30392    133.501     10.9474     133.501     
1 1 1 15 14 54 o 6  44.2206 3.79165 33.7961     8.1887   37.3293     8.2574   18.1519    197.689     2.17385     197.689     
1 1 1 15 14 55 o 7  137.655 2.78604 321.39      18.7125  355.614     19.6867  98.1711    112.177     13.6528     112.177     
1 1 1 15 14 56 f 0  109.529 2.70394 212.78      14.6637  215.805     14.9743  73.5451    80.467      0           0           
1 1 1 15 14 57 o 11 38.4693 4.67333 27.5638     8.66302  27.4887     8.70675  16.8384    51.1363     10.1518     231.136     
1 1 1 15 14 58 o 17 73.7871 3.02993 90.9377     10.3182  104.931     12.0072  36.0387    146.984     23.621      326.984     
1 1 1 15 14 59 o 6  27.9486 5.5886  13.525      7.89676  16.0854     8.47051  1.10976    83.1908     33.2655     83.1908     
1 1 1 15 14 60 o 9  85.2844 2.93161 131.893     12.4956  129.504     12.4877  53.8606    165.138     2.75314     345.138     
1 1 1 15 14 61 o 19 83.3352 3.03939 122.343     12.6551  127.782     12.6406  61.2835    248.232     15.5772     248.232     
1 1 1 15 14 62 o 5  30.328  6.0558  21.3935     9.98252  14.1038     9.42826  2.08834    290.794     30.656      110.794     
1 1 1 15 14 63 o 11 67.4847 3.81582 87.2122     12.3801  79.0941     13.1317  38.8745    180.189     7.97049     0.189219    
1 1 1 15 14 64 o 17 29.2009 6.45627 17.7383     10.6143  14.7794     10.4054  2.68099    198.616     27.6559     18.6165     
1 1 1 15 14 65 o 18 60.8025 4.03231 74.0234     12.3994  62.1647     11.8514  29.9895    50.6118     16.6922     230.612     
1 1 1 15 14 66 o 5  34.6333 5.64246 19.208      9.34193  27.7725     9.94081  16.4916    168.191     6.43894     348.191     
1 1 1 15 14 67 o 14 66.4043 4.11454 53.342      13.0038  115.048     11.7521  54.4242    247.964     26.3987     247.964     
1 1 1 15 14 68 o 13 32.7544 6.0328  28.5903     10.3749  14.2117     10.3087  15.9702    58.5038     5.15216     238.504     
1 1 1 15 14 69 o 2  61.4384 4.11842 76.2048     12.5476  64.7324     12.4404  33.0515    292.643     10.9007     112.643     
1 1 1 15 14 70 o 15 23.1588 6.23167 9.9309      10.2098  7.09423     9.84501  5.81726    205.102     11.6905     25.102      
1 1 1 15 14 71 o 14 19.0272 5.83272 -5.29181    9.88166  5.07184     11.0698  2.92154    147.875     4.50772     327.875     
1 1 1 15 14 72 o 18 71.4707 4.2355  111.258     15.4556  82.3109     14.4518  40.7173    39.0718     7.58736     219.072     
1 1 1 15 14 73 o 14 20.063  6.00522 -1.46934    11.1494  5.72236     10.1249  3.17632    134.298     4.5664      314.298     
1 1 1 15 14 74 o 14 23.2958 6.64509 4.00445     12.4685  10.3603     11.7609  4.68959    52.5615     11.8678     232.561     
1 1 1 15 14 75 o 7  51.4147 6.07645 56.4037     15.3359  51.2504     14.8677  21.9273    157.662     18.0121     337.662     
1 1 1 15 14 76 f 0  27.7257 6.79793 9.77135     12.4198  20.0176     11.4687  8.12811    157.393     0           0           
1 1 1 15 14 77 o 17 18.3051 5.79086 2.95713     11.4961  -9.06833    10.8021  2.44022    217.582     2.67677     37.5824     
1 1 1 15 14 78 o 10 23.4777 6.67932 10.4165     12.0364  5.83357     12.1921  8.45042    307.951     2.6621      127.951     
1 1 1 15 14 79 o 19 38.4326 6.84872 17.1818     14.2188  48.8128     14.3411  25.8903    154.545     10.5962     154.545     
1 1 1 15 14 80 o 6  35.0409 7.66526 24.4646     15.6923  33.3839     14.5084  20.8434    263.22      7.93354     263.22      
1 1 1 15 14 81 o 17 26.1236 6.70145 26.8284     13.417   -4.84898    13.3552  4.95273    162.636     0.932143    162.636     
1 1 1 15 14 82 o 11 29.0672 7.86624 11.301      13.7742  29.9371     18.4934  10.2081    308.049     0.175934    128.05      
1 1 1 15 14 83 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 15 15 0  o 13 910.647 12.2246 14763.2     557.432  14763.2     557.432  642.53     2.4991e-06  53.8993     180         
1 1 1 15 15 1  o 4  138.482 2.70279 340.684     18.7248  340.684     18.7248  119.767    210         43.2887     210         
1 1 1 15 15 2  o 4  204.076 2.81144 739.03      28.7283  739.03      28.7283  174.477    60          48.9639     60          
1 1 1 15 15 3  o 4  118.766 2.51928 250.672     14.9638  250.672     14.9638  66.945     90          37.6902     270         
1 1 1 15 15 4  o 19 365.952 3.85123 2376.14     70.5938  2376.14     70.5938  257.042    300         23.7511     120         
1 1 1 15 15 5  o 15 208.759 2.96009 773.43      30.9397  773.43      30.9397  172.882    150         39.0407     150         
1 1 1 15 15 6  o 13 295.209 3.72269 1546.65     55.0345  1546.65     55.0345  215.767    180         2.09195     360         
1 1 1 15 15 7  o 17 178.993 2.8191  568.734     25.2593  568.734     25.2593  180.091    210         98.7372     210         
1 1 1 15 15 8  o 11 58.3    3.19244 61.3289     9.19511  61.3289     9.19511  11.211     240         82.3139     240         
1 1 1 15 15 9  o 12 389.264 4.70147 2690.17     91.6541  2690.17     91.6541  335.565    90          100.061     90          
1 1 1 15 15 10 o 11 156.395 3.03706 434.561     23.7627  434.561     23.7627  119.777    300         10.4579     300         
1 1 1 15 15 11 o 6  328.717 4.14185 1918.09     68.1814  1918.09     68.1814  265.485    150         49.2573     150         
1 1 1 15 15 12 o 2  510.396 5.80598 4627.63     148.419  4627.63     148.419  468.55     180         189.626     180         
1 1 1 15 15 13 o 11 54.9519 3.4426  54.7862     9.30148  54.7862     9.30148  1.51593    210         11.5555     29.9999     
1 1 1 15 15 14 o 4  636.822 7.47602 7213.91     238.44   7213.91     238.44   529.303    240         127.321     240         
1 1 1 15 15 15 o 19 212.889 3.2984  804.672     35.1518  804.672     35.1518  98.3337    90          114.412     270         
1 1 1 15 15 16 o 14 86.7083 2.87236 134.149     12.4187  134.149     12.4187  50.3896    300         16.8777     300         
1 1 1 15 15 17 f 0  314.647 3.49203 1756.71     55.0326  1756.71     55.0326  270.685    150         0           0           
1 1 1 15 15 18 f 0  156.137 2.71969 432.926     21.2516  432.926     21.2516  98.2467    180         0           0           
1 1 1 15 15 19 o 4  40.2257 4.05866 30.3955     7.70031  30.3955     7.70031  30.6385    30          98.0855     30          
1 1 1 15 15 20 o 10 365.102 3.66315 2365.24     66.9934  2365.24     66.9934  193.426    240         144.069     60          
1 1 1 15 15 21 o 3  42.8313 3.53779 33.8371     7.32316  33.8371     7.32316  4.66684    89.9999     21.0132     89.9999     
1 1 1 15 15 22 o 5  166.566 2.53994 492.47      21.1795  492.47      21.1795  132.659    120         23.6898     120         
1 1 1 15 15 23 o 17 210.901 2.71289 789.263     28.6515  789.263     28.6515  134.486    330         36.6233     150         
1 1 1 15 15 24 o 10 20.3915 6.0932  10.4484     6.28924  10.4484     6.28924  37.9555    360         83.0776     360         
1 1 1 15 15 25 o 8  124.881 2.4503  277.074     15.308   277.074     15.308   92.0902    30          4.63968     30.0001     
1 1 1 15 15 26 o 1  245.997 2.89235 1073.74     35.6345  1073.74     35.6345  231.825    60          108.645     60          
1 1 1 15 15 27 o 11 232.676 2.81207 960.622     32.7681  960.622     32.7681  211.743    90          88.1985     90          
1 1 1 15 15 28 o 7  171.87  2.5602  524.335     22.0292  524.335     22.0292  140.769    120         34.2662     120         
1 1 1 15 15 29 o 15 264.114 3.045   1237.83     40.279   1237.83     40.279   221.174    150         62.9328     150         
1 1 1 15 15 30 o 18 234.547 3.0118  976.38      35.3748  976.38      35.3748  193.903    6.1e-08     51.4142     6.1e-08     
1 1 1 15 15 31 o 3  224.164 2.75307 891.679     30.9063  891.679     30.9063  189.452    30          57.9449     30          
1 1 1 15 15 32 o 18 175.528 2.47696 546.824     21.7688  546.824     21.7688  144.866    240         38.8559     240         
1 1 1 15 15 33 o 2  109.788 2.36992 214.262     13.0116  214.262     13.0116  90.6432    270         29.5304     270         
1 1 1 15 15 34 o 5  465.358 4.18341 3844.95     97.5258  3844.95     97.5258  388.109    300         113.5       300         
1 1 1 15 15 35 o 9  432.616 4.13778 3323.32     89.671   3323.32     89.671   345.55     150         76.1824     150         
1 1 1 15 15 36 o 18 95.3046 2.57633 161.746     12.2639  161.746     12.2639  65.5413    1.53271e-07 1.14804     180         
1 1 1 15 15 37 o 11 307.092 3.15428 1673.8      48.5203  1673.8      48.5203  197.823    30          39.1188     210         
1 1 1 15 15 38 o 9  131.639 2.35899 307.825     15.5396  307.825     15.5396  111.15     240         36.4054     240         
1 1 1 15 15 39 o 2  178.917 2.47809 568.272     22.2     568.272     22.2     109.448    90          33.3427     270         
1 1 1 15 15 40 o 12 131.007 2.46253 304.989     16.1415  304.989     16.1415  125.106    300         66.0252     300         
1 1 1 15 15 41 o 15 57.0334 3.08812 58.721      8.70433  58.721      8.70433  13.0364    330         3.87516     330         
1 1 1 15 15 42 o 19 154.902 2.64044 426.37      20.4703  426.37      20.4703  74.6343    360         67.653      180         
1 1 1 15 15 43 o 7  131.672 2.38317 308.104     15.7024  308.104     15.7024  117.34     30          50.7341     30          
1 1 1 15 15 44 o 18 57.461  3.13814 59.65       8.90934  59.65       8.90934  32.0516    60          5.41758     240         
1 1 1 15 15 45 o 9  59.2525 2.99734 63.2717     8.79358  63.2717     8.79358  21.4036    270         10.7289     270         
1 1 1 15 15 46 o 13 130.956 2.47039 304.934     16.1865  304.934     16.1865  98.4337    120         15.2556     120         
1 1 1 15 15 47 o 3  200.876 2.41525 716.637     24.2978  716.637     24.2978  144.002    330         10.1403     330         
1 1 1 15 15 48 o 8  31.1861 5.36612 20.1078     7.26626  20.1078     7.26626  6.39969    360         43.0721     360         
1 1 1 15 15 49 o 18 92.6926 2.47917 153.176     11.4788  153.176     11.4788  83.2242    210         39.3267     210         
1 1 1 15 15 50 o 5  145.829 2.40639 378.159     17.5645  378.159     17.5645  119.591    240         39.078      240         
1 1 1 15 15 51 o 4  119.808 2.42675 255.505     14.5434  255.505     14.5434  76.3443    270         11.2516     90          
1 1 1 15 15 52 o 4  20.0697 6.63348 10.5912     7.4474   10.5912     7.4474   2.31594    300         7.01682     300         
1 1 1 15 15 53 o 12 14.1622 5.83244 4.37689     6.83604  4.37689     6.83604  10.7607    150         26.2664     150         
1 1 1 15 15 54 o 19 75.7908 2.65867 102.859     10.0412  102.859     10.0412  53.4772    360         4.1468      360         
1 1 1 15 15 55 o 13 18.6106 6.28252 9.17042     6.71146  9.17042     6.71146  10.5685    30          39.7998     30          
1 1 1 15 15 56 o 7  80.4856 2.6674  115.986     10.7048  115.986     10.7048  49.9013    240         8.71379     60          
1 1 1 15 15 57 o 11 14.5005 6.09626 4.24787     7.74014  4.24787     7.74014  19.3773    90          52.9451     90          
1 1 1 15 15 58 o 8  220.71  2.97828 869.17      32.9148  869.17      32.9148  140.42     300         14.8681     120         
1 1 1 15 15 59 f 0  41.833  6.05215 35.2694     11.2176  35.2694     11.2176  16.8066    330         0           0           
1 1 1 15 15 60 o 11 41.2187 5.17287 33.3067     9.68191  33.3067     9.68191  19.3349    2.81182e-06 16.0179     180         
1 1 1 15 15 61 o 6  60.0019 3.70759 65.9244     10.9442  65.9244     10.9442  45.4371    30          11.2834     30          
1 1 1 15 15 62 o 8  58.9491 3.5814  63.567      10.3932  63.567      10.3932  19.7456    60          38.448      240         
1 1 1 15 15 63 o 2  8.2956  4.21459 -13.9813    8.45512  -13.9813    8.45512  4.96147    90          11.3977     90          
1 1 1 15 15 64 o 11 32.3755 6.73612 23.3952     9.49738  23.3952     9.49738  12.5398    120         7.34064     120         
1 1 1 15 15 65 o 14 14.7865 6.34325 4.06487     8.72251  4.06487     8.72251  0.793264   330         5.60842     330         
1 1 1 15 15 66 o 12 59.2643 3.86318 64.7989     11.2373  64.7989     11.2373  39.4861    360         1.71726     360         
1 1 1 15 15 67 o 5  57.5341 3.84984 61.232      10.858   61.232      10.858   48.3114    210         21.9007     210         
1 1 1 15 15 68 o 17 48.7942 5.39478 46.588      12.2301  46.588      12.2301  47.2022    240         31.7535     240         
1 1 1 15 15 69 o 7  69.8527 4.03299 90.1602     13.8943  90.1602     13.8943  44.2661    90          1.51187     270         
1 1 1 15 15 70 o 15 17.8313 7.29231 8.1436      10.5692  8.1436      10.5692  1.7739     300         3.07277     120         
1 1 1 15 15 71 o 8  26.8728 7.95087 19.3803     10.729   19.3803     10.729   15.0966    150         1.44088     150         
1 1 1 15 15 72 o 17 27.4502 7.80349 19.8355     10.444   19.8355     10.444   1.59725    180         31.5342     8.70027e-06 
1 1 1 15 15 73 o 5  10.4248 5.14111 -8.23331    9.74077  -8.23331    9.74077  12.3329    210         32.2014     210         
1 1 1 15 15 74 o 13 66.0623 4.5065  82.147      14.5798  82.147      14.5798  39.2979    240         4.89604     60          
1 1 1 15 15 75 o 9  46.6969 6.21169 44.623      13.034   44.623      13.034   30.4613    270         2.15501     270         
1 1 1 15 15 76 o 14 23.1938 8.44055 15.9614     12.5272  15.9614     12.5272  7.19064    120         12.9571     300         
1 1 1 15 15 77 o 4  19.9963 8.04023 11.3774     12.535   11.3774     12.535   1.31752    150         0.198884    330         
1 1 1 15 15 78 o 7  13.2834 6.332   -3.28723    12.1689  -3.28723    12.1689  1.80768    8.76012e-06 10.8395     8.76012e-06 
1 1 1 15 15 79 o 2  64.3401 6.48855 84.4004     19.6917  84.4004     19.6917  48.5707    30          17.5276     30          
1 1 1 15 15 80 o 14 26.5978 9.78369 23.6761     16.9538  23.6761     16.9538  10.9661    60          0.698507    240         
1 1 1 15 15 81 f 0  41.3036 9.86287 45.7028     18.2544  45.7028     18.2544  16.5186    270         0           0           
1 1 1 15 15 82 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 0  0  o 4  411.245 4.81191 2999.24     99.1085  2999.24     99.1085  264.721    1.14308e-06 66.2371     180         
1 1 1 16 0  1  o 19 634.553 5.08653 7138.46     161.705  7138.46     161.705  387.261    240         145.103     60          
1 1 1 16 0  2  o 7  71.2886 2.20768 90.5646     7.85259  90.5646     7.85259  1.13695    299.998     3.1819      299.998     
1 1 1 16 0  3  o 4  500.774 4.56876 4446.16     114.614  4446.16     114.614  363.651    180         1.71674     180         
1 1 1 16 0  4  o 3  127.894 2.3974  290.437     15.3413  290.437     15.3413  19.3291    60          87.1289     240         
1 1 1 16 0  5  o 7  1041.61 8.64598 19242.2     451.174  19242.2     451.174  894.889    120         281.233     120         
1 1 1 16 0  6  o 4  805.144 6.76013 11494.8     272.679  11494.8     272.679  650.559    360         135.393     360         
1 1 1 16 0  7  o 3  1177.64 9.69    24600.2     571.697  24600.2     571.697  967.611    60          230.788     60          
1 1 1 16 0  8  o 7  231.669 2.80134 951.827     32.5018  951.827     32.5018  177.613    120         28.9113     120         
1 1 1 16 0  9  o 5  985.882 8.23546 17237.8     406.758  17237.8     406.758  760.453    8.06839e-07 95.2751     8.06839e-07 
1 1 1 16 0  10 o 18 334.19  3.19873 1980.05     53.5492  1980.05     53.5492  278.38     240         73.9114     240         
1 1 1 16 0  11 o 7  650.521 5.52994 7503.01     180.219  7503.01     180.219  558.756    120         177.868     120         
1 1 1 16 0  12 o 6  349.906 3.49538 2170.81     61.2648  2170.81     61.2648  388.202    4.81541e-06 277.345     4.81541e-06 
1 1 1 16 0  13 o 3  158.595 2.36548 446.264     18.7816  446.264     18.7816  55.2302    60          338.111     60          
1 1 1 16 0  14 o 13 144.46  2.07719 370.225     15.0237  370.225     15.0237  54.0941    120         41.8028     300         
1 1 1 16 0  15 o 16 306.796 2.96815 1668.76     45.6157  1668.76     45.6157  295.731    180         152.741     180         
1 1 1 16 0  16 o 7  837.958 7.33212 12452.7     307.795  12452.7     307.795  528.454    60          148.971     240         
1 1 1 16 0  17 o 7  871.155 7.28494 13458.4     317.94   13458.4     317.94   613.021    120         26.4679     300         
1 1 1 16 0  18 o 16 574.328 4.9789  5848.31     143.254  5848.31     143.254  598.296    360         371.647     360         
1 1 1 16 0  19 o 11 421.454 3.83895 3149.14     81.0513  3149.14     81.0513  202.844    60          199.055     240         
1 1 1 16 0  20 o 19 115.968 2.20243 238.809     12.7789  238.809     12.7789  186.269    120         535.554     120         
1 1 1 16 0  21 o 16 1337.46 11.0202 31746.9     738.416  31746.9     738.416  1117.04    2.82934e-06 319.192     2.82934e-06 
1 1 1 16 0  22 o 3  1368.68 11.2215 33249.3     769.448  33249.3     769.448  959.715    60          37.8184     240         
1 1 1 16 0  23 o 16 593.146 4.85431 6237.76     144.251  6237.76     144.251  495.325    300         143.489     300         
1 1 1 16 0  24 o 11 1080.26 8.5861  20702.2     464.686  20702.2     464.686  750.413    180         40.0487     8.50437e-06 
1 1 1 16 0  25 o 11 251.795 2.65105 1124.18     33.4356  1124.18     33.4356  220.638    240         97.5118     240         
1 1 1 16 0  26 o 6  61.1313 2.32948 66.793      7.08879  66.793      7.08879  67.995     300         170.502     300         
1 1 1 16 0  27 o 4  448.619 3.80326 3568.22     85.478   3568.22     85.478   250.162    360         136.886     180         
1 1 1 16 0  28 o 7  1261.75 10.3181 28266.9     652.233  28266.9     652.233  938.439    60          87.4425     60          
1 1 1 16 0  29 o 16 575.685 4.93164 5877.08     142.231  5877.08     142.231  508.15     120         201.135     120         
1 1 1 16 0  30 o 9  144.305 2.34239 369.583     16.9194  369.583     16.9194  82.634     3.7288e-08  9.11826     180         
1 1 1 16 0  31 o 19 611.886 5.52323 6641.13     169.303  6641.13     169.303  493.504    240         123.453     240         
1 1 1 16 0  32 o 18 145.805 2.39653 377.326     17.4898  377.326     17.4898  71.3545    120         34.7784     120         
1 1 1 16 0  33 o 5  237.326 2.8068  998.972     33.3613  998.972     33.3613  168.36     360         3.02795     360         
1 1 1 16 0  34 o 8  265.6   3.01807 1251.16     40.148   1251.16     40.148   150.881    60          71.0649     240         
1 1 1 16 0  35 f 0  555.367 4.99139 5471.43     138.869  5471.43     138.869  261.333    120         0           0           
1 1 1 16 0  36 o 17 532.604 4.79681 5032.11     127.985  5032.11     127.985  466.909    360         189.082     360         
1 1 1 16 0  37 o 16 551.015 4.97876 5386.7      137.431  5386.7      137.431  474.115    60          179.302     60          
1 1 1 16 0  38 o 10 153.545 2.32103 418.377     17.8414  418.377     17.8414  74.7047    300         63.3769     120         
1 1 1 16 0  39 o 18 236.491 2.92276 992.175     34.6154  992.175     34.6154  210.575    360         92.7322     360         
1 1 1 16 0  40 o 11 66.7632 2.54967 79.685      8.4734   79.685      8.4734   25.6024    60          121.109     60          
1 1 1 16 0  41 o 16 163.203 2.46829 472.694     20.1667  472.694     20.1667  121.109    300         17.6968     300         
1 1 1 16 0  42 o 17 247.145 2.83819 1083.48     35.1315  1083.48     35.1315  193.01     360         44.8796     360         
1 1 1 16 0  43 o 2  51.2559 2.68358 47.3251     6.80434  47.3251     6.80434  7.05872    60          42.3468     60          
1 1 1 16 0  44 o 8  37.9276 3.10298 26.5062     5.69263  26.5062     5.69263  58.9013    120         156.504     120         
1 1 1 16 0  45 o 15 203.915 2.52039 737.668     25.7382  737.668     25.7382  203.721    180         128.197     180         
1 1 1 16 0  46 o 10 508.548 4.38626 4589.29     111.748  4589.29     111.748  380.258    60          65.3503     60          
1 1 1 16 0  47 o 12 9.32657 4.24657 -0.010079   4.57199  -0.010079   4.57199  69.2023    300         140.533     300         
1 1 1 16 0  48 o 3  39.1141 3.29766 28.2599     6.2217   28.2599     6.2217   9.27335    360         28.8224     360         
1 1 1 16 0  49 o 6  143.849 2.26282 367.298     16.2942  367.298     16.2942  132.013    240         98.485      240         
1 1 1 16 0  50 o 4  540.2   4.71255 5180.59     127.533  5180.59     127.533  450.611    300         170.585     300         
1 1 1 16 0  51 f 0  135.466 2.5592  325.992     17.3458  325.992     17.3458  37.5962    180         0           0           
1 1 1 16 0  52 o 3  310.417 3.91028 1710.83     60.7859  1710.83     60.7859  230.565    240         43.6409     240         
1 1 1 16 0  53 o 5  70.4124 2.65137 88.6373     9.29481  88.6373     9.29481  8.6389     300         70.2316     120         
1 1 1 16 0  54 o 1  329.844 3.74345 1931.44     61.8428  1931.44     61.8428  254.682    360         68.3405     360         
1 1 1 16 0  55 o 16 133.479 2.71461 316.677     18.1246  316.677     18.1246  100.799    60          23.9495     60          
1 1 1 16 0  56 o 14 9.54838 4.52737 -2.37367    6.06887  -2.37367    6.06887  9.25303    300         18.9744     300         
1 1 1 16 0  57 o 7  342.915 3.78005 2088.45     64.9242  2088.45     64.9242  217.399    360         19.5026     180         
1 1 1 16 0  58 o 12 13.5048 5.6042  3.75812     6.39161  3.75812     6.39161  6.90653    240         14.7724     240         
1 1 1 16 0  59 o 6  120.723 2.77663 259.339     16.7581  259.339     16.7581  69.3136    120         20.2844     300         
1 1 1 16 0  60 o 19 401.996 4.52605 2875.19     91.1283  2875.19     91.1283  295.408    180         63.3845     180         
1 1 1 16 0  61 o 16 11.7535 5.20889 1.31582     6.35465  1.31582     6.35465  22.302     240         47.3255     240         
1 1 1 16 0  62 o 2  430.911 4.46773 3306.14     96.4327  3306.14     96.4327  331.847    120         102.125     120         
1 1 1 16 0  63 o 14 62.1946 2.9713  69.6145     9.16248  69.6145     9.16248  39.8177    360         6.60622     360         
1 1 1 16 0  64 o 14 97.5954 2.65991 169.842     12.9654  169.842     12.9654  74.3742    60          22.5835     60          
1 1 1 16 0  65 o 2  60.7264 2.92409 66.4135     8.80248  66.4135     8.80248  11.9204    120         54.1162     300         
1 1 1 16 0  66 o 13 162.238 2.57836 468.119     20.9393  468.119     20.9393  94.0391    180         20.3821     360         
1 1 1 16 0  67 o 5  30.859  5.31297 19.7218     7.11858  19.7218     7.11858  2.57466    240         37.1173     240         
1 1 1 16 0  68 o 2  29.23   6.97994 19.7856     9.14237  19.7856     9.14237  6.01208    300         11.8597     120         
1 1 1 16 0  69 o 11 40.6554 4.79531 31.8854     8.95367  31.8854     8.95367  6.87474    180         37.6996     8.65145e-06 
1 1 1 16 0  70 o 18 11.7316 5.35084 0.0634877   7.29986  0.0634877   7.29986  21.6644    60          51.5887     60          
1 1 1 16 0  71 o 15 38.6772 5.67667 30.0699     9.70647  30.0699     9.70647  6.76659    300         4.04849     300         
1 1 1 16 0  72 o 10 17.1646 6.74034 7.43847     8.54901  7.43847     8.54901  12.4839    8.65137e-06 40.9181     8.65137e-06 
1 1 1 16 0  73 o 10 80.872  3.54542 118.199     14.241   118.199     14.241   53.4263    60          5.69704     60          
1 1 1 16 0  74 o 17 71.4916 3.69564 92.8867     13.0744  92.8867     13.0744  46.664     300         4.26833     300         
1 1 1 16 0  75 o 10 44.2236 5.32991 38.1593     10.7827  38.1593     10.7827  30.8664    8.69025e-06 7.80238     8.69025e-06 
1 1 1 16 0  76 o 7  9.61515 4.7112  -6.31519    7.83598  -6.31519    7.83598  3.73523    59.9999     9.01261     59.9999     
1 1 1 16 0  77 o 15 91.4448 3.56505 151.179     16.2232  151.179     16.2232  75.7097    120         38.9204     120         
1 1 1 16 0  78 o 6  31.8862 6.97082 23.1737     9.7493   23.1737     9.7493   18.6495    1.94444e-06 0.120213    1.94445e-06 
1 1 1 16 0  79 o 7  10.3687 5.01671 -4.85458    8.24465  -4.85458    8.24465  4.06578    240         11.343      240         
1 1 1 16 0  80 o 2  41.1603 5.84686 34.4163     10.6939  34.4163     10.6939  32.2739    120         15.2902     120         
1 1 1 16 0  81 o 13 41.5549 5.92119 35.2209     10.9282  35.2209     10.9282  21.9275    360         6.35007     180         
1 1 1 16 0  82 o 6  31.0619 7.41827 23.1578     10.3258  23.1578     10.3258  19.0784    240         7.32977     240         
1 1 1 16 0  83 o 4  107.314 3.45536 208.965     18.4948  208.965     18.4948  71.7216    300         14.8777     300         
1 1 1 16 0  84 o 4  25.262  8.51658 18.2808     12.329   18.2808     12.329   7.61464    9.4346e-06  1.76237     180         
1 1 1 16 0  85 o 19 21.487  8.13351 13.2739     11.9881  13.2739     11.9881  0.0841701  59.9994     0.0414308   239.999     
1 1 1 16 0  86 o 15 12.5929 6.01014 -3.86286    11.0274  -3.86286    11.0274  2.63822    120         10.772      120         
1 1 1 16 0  87 o 19 56.7842 7.94293 68.2659     20.0927  68.2659     20.0927  22.531     180         21.7005     8.6156e-06  
1 1 1 16 0  88 o 16 22.2209 9.18077 14.1573     17.0274  14.1573     17.0274  6.8422     240         5.12492     60          
1 1 1 16 0  89 o 7  28.4102 10.1463 25.835      17.9022  25.835      17.9022  4.78545    120         1.96909     120         
1 1 1 16 0  90 o 3  15.3364 7.32118 -3.29748    16.3809  -3.29748    16.3809  0.56589    180         2.89793     180         
1 1 1 16 0  91 x 15 ?       ?       ?           ?        ?           ?        3.76285    60          0           0           
1 1 1 16 0  92 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 1  0  o 6  126.929 2.14874 285.958     13.6504  285.958     13.6504  16.0597    180         21.3929     360         
1 1 1 16 1  1  o 9  976.863 7.84474 17013.2     384.038  16835.5     384.029  656.243    96.6117     96.3537     276.612     
1 1 1 16 1  2  o 8  189.067 2.51477 643.027     23.3404  623.879     24.2864  87.7273    4.33893     39.8425     4.33893     
1 1 1 16 1  3  o 14 499.597 4.28654 4426.9      111.088  4420.44     103.423  362.743    77.4554     18.0075     77.4554     
1 1 1 16 1  4  o 9  501.553 4.39685 4424.69     112.518  4492.36     108.437  371.556    76.7215     33.1778     76.7215     
1 1 1 16 1  5  o 13 591.897 5.13565 6184.59     158.053  6235.51     146.343  356.657    326.902     132.749     146.902     
1 1 1 16 1  6  o 5  942.271 7.81014 15593.1     382.548  15901.7     354.207  667.701    192.484     21.4355     12.4837     
1 1 1 16 1  7  o 13 1120.74 9.31718 22020.2     542.745  22554.7     502.534  844.786    291.898     73.8459     291.898     
1 1 1 16 1  8  o 12 602.743 5.43177 6421.97     170.747  6458.28     157.071  332.926    212.029     196.147     32.0291     
1 1 1 16 1  9  o 8  546.389 5.09728 5257.72     136.513  5326.15     142.602  533.971    120.638     301.227     120.638     
1 1 1 16 1  10 o 7  275.29  3.092   1315.61     45.9736  1370.63     38.8871  179.825    279.522     8.6143      99.5221     
1 1 1 16 1  11 o 4  558.183 5.05267 5496.33     141.324  5549.33     141.349  384.137    281.086     24.9439     101.086     
1 1 1 16 1  12 o 4  474.059 4.3898  4002.57     108.56   3963.78     99.877   342.401    198.502     17.4522     198.502     
1 1 1 16 1  13 o 3  365.309 3.47215 2394.88     63.5635  2335.27     63.5591  251.858    298.981     0.601608    118.981     
1 1 1 16 1  14 o 1  1162.54 9.53589 24078.3     555.535  23890.5     555.573  772.311    168.414     125.629     348.414     
1 1 1 16 1  15 o 2  975.079 8.10747 16802.9     396.148  16929.1     396.195  762.694    171.963     129.516     171.963     
1 1 1 16 1  16 o 18 707.634 6.12734 8800.94     212.918  8956.23     221.639  426.257    271.063     156.046     91.0634     
1 1 1 16 1  17 o 18 865.522 7.04391 13275.2     311.109  13296.2     299.835  723.7      172.696     214.37      172.696     
1 1 1 16 1  18 o 1  579.375 4.95654 5926.47     146.529  5974.4      141.224  307.08     333.327     206.249     153.327     
1 1 1 16 1  19 o 17 366.455 3.51881 2393.54     67.0687  2366.39     62.1057  161.603    190.677     184.121     10.6771     
1 1 1 16 1  20 o 19 459.957 4.24118 3768.14     99.6982  3731.67     95.8019  280.066    95.1291     81.2158     275.129     
1 1 1 16 1  21 o 17 752.908 6.36247 10062.5     240.051  10043.3     240.078  479.852    180.404     107.452     0.403956    
1 1 1 16 1  22 o 17 335.542 3.2627  1982.13     54.8436  2008.59     54.8819  271.691    344.039     102.605     344.039     
1 1 1 16 1  23 o 14 365.849 3.50693 2396.22     64.2885  2348.29     64.3     279.186    54.5539     64.1156     54.5539     
1 1 1 16 1  24 o 7  913.521 7.77146 14912.4     348.548  14707.1     362.758  618.192    337.79      59.1378     157.79      
1 1 1 16 1  25 o 6  207.334 2.56973 737.991     25.6647  785.978     27.7413  54.9691    239.203     160.409     59.2034     
1 1 1 16 1  26 o 12 808.911 6.81793 11699       265.475  11521.4     286.709  553.392    56.311      36.4256     236.311     
1 1 1 16 1  27 o 3  702.032 5.84265 8745.67     201.706  8738.7      209.329  571.568    40.2692     155.88      40.2692     
1 1 1 16 1  28 o 12 599.729 5.19235 6342.02     149.959  6415.88     161.986  519.278    228.197     199.787     228.197     
1 1 1 16 1  29 o 17 334.868 3.23121 2000.53     53.2108  1974.79     55.2059  239.158    41.228      20.8662     41.228      
1 1 1 16 1  30 o 19 330.32  3.22247 1947.71     53.3508  1920.49     53.335   211.385    209.864     30.0643     29.8636     
1 1 1 16 1  31 o 11 286.843 3.01241 1421.31     43.2921  1496        43.2926  181.094    114.691     27.1908     294.691     
1 1 1 16 1  32 o 7  153.984 2.2781  423.113     17.9366  417.336     17.2195  89.7787    49.7971     47.1225     49.7971     
1 1 1 16 1  33 o 17 419.936 3.85034 3138.41     81.0356  3115.6      81.0227  320.32     314.867     60.3952     314.867     
1 1 1 16 1  34 o 12 752.569 6.44403 10046.4     247.841  10071.9     238.113  534.676    247.932     17.3428     247.932     
1 1 1 16 1  35 o 9  239.467 2.68184 1017.26     32.1984  1015.72     32.1693  114.889    137.598     93.5444     317.598     
1 1 1 16 1  36 o 8  627.175 5.56603 6957.92     174.938  7010.42     174.945  418.153    161.11      35.6442     341.11      
1 1 1 16 1  37 o 17 212.141 2.64151 783.573     27.5219  812.132     28.6454  133.211    211.178     12.3518     31.1777     
1 1 1 16 1  38 o 14 142.257 2.40793 360.168     17.1638  357.284     17.1688  56.8867    28.3599     62.8532     208.36      
1 1 1 16 1  39 o 9  339.507 3.49975 2035.7      55.5478  2052.98     63.3198  250.017    263.196     38.9085     263.196     
1 1 1 16 1  40 o 2  132.236 2.356   315.989     15.58    304.21      15.6273  75.2285    196.04      5.05654     16.0396     
1 1 1 16 1  41 o 15 321.224 3.59752 1821.42     59.262   1839.36     56.5153  274.465    77.6926     115.609     77.6926     
1 1 1 16 1  42 o 4  297.971 3.1213  1577.62     45.6619  1571.58     47.5335  201.508    90.3236     0.928268    270.324     
1 1 1 16 1  43 o 9  253.694 2.88258 1129        35.9001  1153.69     37.394   164.517    86.2103     12.9516     266.21      
1 1 1 16 1  44 o 17 282.038 3.01011 1394.6      41.6837  1427.01     43.4049  146.104    203.494     89.7804     23.4943     
1 1 1 16 1  45 o 17 421.06  3.92683 3112.96     81.1857  3180.61     84.5297  321.638    264.589     71.2949     264.589     
1 1 1 16 1  46 o 16 548.141 4.91302 5296.97     131.994  5380.87     137.898  399.638    199.86      53.4547     199.86      
1 1 1 16 1  47 o 7  45.3182 3.07087 34.6268     6.3302   38.9637     7.44972  22.3324    96.9064     78.0009     96.9064     
1 1 1 16 1  48 o 8  69.6259 2.6264  88.0143     9.32309  84.4314     8.93987  12.9703    83.5745     9.31553     263.574     
1 1 1 16 1  49 o 11 275.549 3.08643 1355.86     42.6268  1338.2      42.6125  196.692    229.226     27.1861     229.226     
1 1 1 16 1  50 o 2  117.894 2.40469 242.671     14.1939  250.698     14.1881  53.9517    62.6572     36.8212     242.657     
1 1 1 16 1  51 o 6  144.802 2.55159 374.251     18.0842  369.714     18.9163  91.5952    28.591      1.97187     28.5911     
1 1 1 16 1  52 o 17 91.727  2.4762  142.19      11.6687  156.859     10.9893  28.4196    31.8981     50.6651     211.898     
1 1 1 16 1  53 o 15 171.807 2.615   542.467     22.0054  505.038     22.9589  83.7422    338.709     54.9685     158.709     
1 1 1 16 1  54 o 16 297.462 3.247   1596.95     49.5678  1544.76     47.2392  224.056    173.068     56.2135     173.068     
1 1 1 16 1  55 o 3  155.942 2.82224 431.803     22.5524  431.604     21.5265  72.56      112.587     55.886      292.587     
1 1 1 16 1  56 o 3  268.902 3.3511  1263.06     44.4207  1305.9      45.9001  160.356    82.9687     32.9162     262.969     
1 1 1 16 1  57 o 8  319.707 3.70087 1803.93     57.7214  1830.51     60.847   203.625    189.514     13.4793     9.51396     
1 1 1 16 1  58 o 6  115.004 2.80865 225.793     16.5462  244.681     15.7143  64.3617    169.806     15.1247     349.806     
1 1 1 16 1  59 o 14 284.168 3.34574 1430.47     48.7591  1441.31     46.497   225.031    69.4435     79.8838     69.4435     
1 1 1 16 1  60 f 0  100.743 2.77965 184.665     13.5947  176.571     14.3834  80.1394    276.266     0           0           
1 1 1 16 1  61 o 4  110.43  2.66281 222.623     13.9338  211.33      15.4105  69.3334    214.266     1.98647     214.266     
1 1 1 16 1  62 o 15 90.5479 2.73509 147.982     12.0105  144.098     12.7319  35.8356    339.901     40.0412     159.901     
1 1 1 16 1  63 o 5  119.741 2.65045 254.306     15.8858  256.148     15.8842  74.8206    212.748     0.0953328   212.751     
1 1 1 16 1  64 o 17 37.259  4.33547 31.9114     7.65255  19.7628     7.7042   6.73784    264.468     49.699      264.468     
1 1 1 16 1  65 o 9  71.6997 2.62317 85.1286     8.98834  98.5981     9.80258  40.0428    0.885415    27.3819     0.885415    
1 1 1 16 1  66 o 16 34.8223 4.88904 26.291      8.95316  19.1582     7.54453  4.33876    166.012     12.7354     346.012     
1 1 1 16 1  67 o 18 47.9078 3.03662 40.2358     7.35673  42.3471     7.05287  24.128     346.838     11.4965     346.838     
1 1 1 16 1  68 o 19 96.5706 2.7769  169.45      13.9894  163.839     12.8233  61.2164    308.417     2.44746     308.417     
1 1 1 16 1  69 o 12 56.9364 3.43313 52.7974     10.2398  64.5269     8.86463  30.2065    325.848     6.90579     145.848     
1 1 1 16 1  70 f 0  179.544 3.00136 582.19      27.9436  571.6       26.0485  94.2962    122.945     0           0           
1 1 1 16 1  71 f 0  49.5839 4.07184 47.1274     10.5272  42.9389     9.33515  26.0809    280.399     0           0           
1 1 1 16 1  72 o 4  45.8284 3.45217 54.2434     9.32372  25.0038     6.26367  17.9095    344.192     17.2323     164.192     
1 1 1 16 1  73 o 1  62.4079 3.85152 66.0574     11.5706  76.0544     12.2721  34.5504    195.175     5.276       15.175      
1 1 1 16 1  74 o 6  63.5565 3.75775 71.3637     11.5104  75.7948     12.2107  37.9522    334.33      0.428652    334.33      
1 1 1 16 1  75 o 7  25.1263 5.92918 13.8075     8.58824  8.46787     9.22854  5.45932    74.6477     6.09685     254.648     
1 1 1 16 1  76 o 7  43.931  4.87793 38.3447     10.3332  34.3652     10.4087  24.0789    1.01704     1.23296     181.017     
1 1 1 16 1  77 o 18 30.1226 5.9332  14.4064     9.26125  20.9833     9.49652  5.31303    249.503     2.82203     249.503     
1 1 1 16 1  78 o 4  62.3904 3.90954 72.4846     12.0393  70.9356     12.1522  43.8717    86.8982     14.4836     86.8982     
1 1 1 16 1  79 o 1  14.4041 4.72341 -5.10997    8.05117  -7.18418    8.24555  2.44053    51.6685     12.7648     51.6686     
1 1 1 16 1  80 o 13 39.9568 5.57011 30.2822     10.7315  32.5614     10.7813  25.2855    265.472     7.63041     265.472     
1 1 1 16 1  81 o 15 26.929  6.36595 15.5009     10.0257  12.59       10.2367  10.7928    188.456     0.0691087   8.45554     
1 1 1 16 1  82 o 4  20.3372 5.71272 -4.3708     9.14036  11.1664     9.7021   2.26756    53.3723     2.72569     233.372     
1 1 1 16 1  83 o 7  51.3686 5.62074 49.9836     14.5682  54.3052     13.3075  20.605     131.332     17.5495     311.332     
1 1 1 16 1  84 o 17 37.5421 7.5076  25.8338     15.8048  34.8738     14.182   15.6313    228.38      8.45964     48.3805     
1 1 1 16 1  85 o 10 21.9867 6.57685 1.59558     11.2052  6.42995     13.7185  3.39301    103.687     11.733      283.687     
1 1 1 16 1  86 o 2  18.4483 5.83718 2.43878     11.0779  -10.339     11.871   1.93227    122.497     3.31172     302.497     
1 1 1 16 1  87 o 9  51.3298 7.87712 61.9849     19.4964  54.7203     19.8808  25.7035    336.957     6.00276     156.957     
1 1 1 16 1  88 o 16 23.1492 7.03326 15.6165     16.0788  -19.0565    16.7154  4.99108    175.338     9.65283     355.338     
1 1 1 16 1  89 o 16 27.7736 7.98197 9.26876     17.6292  19.5127     17.5955  7.76503    190.334     0.998954    190.334     
1 1 1 16 1  90 o 1  31.8105 8.44294 28.3803     18.2289  20.6847     18.5054  12.3015    156.277     0.617853    156.277     
1 1 1 16 1  91 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 2  0  o 7  469.608 4.19977 3909.84     98.8019  3909.84     98.8019  230.213    180         221.015     6.4602e-06  
1 1 1 16 2  1  o 12 1195.28 9.71262 25406.5     570.905  25302.1     592.433  917.448    195.837     107.301     195.837     
1 1 1 16 2  2  o 1  280.003 2.89896 1376.36     41.4171  1402.35     39.9093  206.269    253.713     40.9244     253.713     
1 1 1 16 2  3  o 10 270.117 2.79416 1294.7      37.8227  1291.16     37.8245  196.852    199.775     37.9369     199.775     
1 1 1 16 2  4  o 17 720.608 6.09334 9205.76     220.048  9207.04     220.046  523.723    285.548     12.9246     285.548     
1 1 1 16 2  5  o 18 423.246 3.71377 3178.04     78.7696  3171.4      78.7733  210.557    283.543     178.584     103.543     
1 1 1 16 2  6  f 0  448.923 3.83125 3566.39     86.1899  3576.92     86.1962  254.046    48.4932     0           0           
1 1 1 16 2  7  o 10 810.917 6.58394 11679.3     267.559  11640.5     267.562  645.266    68.1801     126.08      68.1801     
1 1 1 16 2  8  o 6  110.602 2.21345 222.652     12.9868  211.289     11.5135  21.1411    145.093     150.271     145.093     
1 1 1 16 2  9  f 0  471.692 4.42934 3915.2      104.694  3971.92     104.708  460.574    210.098     0           0           
1 1 1 16 2  10 o 10 557.592 5.08559 5453.25     142.091  5569.49     142.113  452.788    47.6312     115.8       47.6312     
1 1 1 16 2  11 o 12 576.991 5.32476 5847.27     157.236  5956.27     150.555  341.365    272.03      139.624     92.0298     
1 1 1 16 2  12 o 1  496.56  4.92148 4321.04     130.795  4420.6      113.307  416.992    45.8774     137.632     45.8774     
1 1 1 16 2  13 o 8  1267.75 11.3647 28501.9     688.423  28586.5     754.208  932.432    328.067     40.5891     328.067     
1 1 1 16 2  14 o 18 101.009 2.29738 187.638     11.3335  174.443     11.8577  25.8189    105.579     127.444     105.579     
1 1 1 16 2  15 o 15 401.634 3.82695 2837.73     75.4713  2880.18     78.5717  403.638    171.634     341.275     171.634     
1 1 1 16 2  16 o 6  740.033 6.27736 9759.13     223.613  9662.88     241.553  513.476    96.9296     27.6334     276.93      
1 1 1 16 2  17 o 4  152.646 2.2732  426.163     17.3702  399.822     17.3944  14.4841    74.0702     144.022     254.07      
1 1 1 16 2  18 o 16 615.02  5.40613 6679.26     169.891  6732.9      163.261  394.814    222.766     81.0239     42.7658     
1 1 1 16 2  19 o 2  265.009 2.91763 1255.33     37.9464  1233.87     39.5183  186.795    277.786     43.3193     277.786     
1 1 1 16 2  20 o 10 701.557 6.10886 8738.6      210.41   8717.59     219.043  439.691    290.357     115.81      110.357     
1 1 1 16 2  21 o 3  633.671 5.53876 7109.58     179.339  7130.09     172.358  634.331    309.271     384.985     309.271     
1 1 1 16 2  22 o 10 401.378 3.78176 2830.05     77.535   2881.09     74.5426  302.216    159.508     53.1164     159.508     
1 1 1 16 2  23 o 5  782.271 6.72027 10736.6     268.55   10976.1     258.114  656.736    57.3313     206.739     57.3312     
1 1 1 16 2  24 o 8  463.055 4.35033 3759.36     100.922  3843.32     100.973  288.559    197.808     70.2805     17.8082     
1 1 1 16 2  25 o 13 460.379 4.35769 3757.21     100.518  3757.98     100.559  354.929    147.979     69.3658     147.979     
1 1 1 16 2  26 o 18 735.656 6.48446 9667.7      239.031  9537.96     239.083  531.774    235.267     24.0095     235.267     
1 1 1 16 2  27 o 14 583.34  5.16445 6068.71     147.887  6001.76     153.966  439.698    232.679     59.8199     232.679     
1 1 1 16 2  28 o 19 332.448 3.38018 1962.27     55.1574  1955.98     57.4453  201.244    92.8811     55.4634     272.881     
1 1 1 16 2  29 o 17 422.277 3.96876 3148.53     82.2754  3174.7      85.6773  330.231    247.367     75.1043     247.367     
1 1 1 16 2  30 o 2  580.476 5.32478 6079.57     141.207  5877.34     167.034  374.199    81.0813     66.036      261.081     
1 1 1 16 2  31 o 16 480.323 4.29057 4073.32     99.2366  4109.79     107.2    362.675    281.394     56.2593     281.394     
1 1 1 16 2  32 o 13 95.7114 2.33851 165.064     10.7151  160.058     11.6481  20.5786    223.64      38.76       43.6402     
1 1 1 16 2  33 o 15 333.751 3.35193 1987.81     54.9203  1962.09     57.1671  335.565    96.6327     225.007     96.6327     
1 1 1 16 2  34 o 19 416.012 3.95327 3056.05     82.4095  3082.92     82.4258  295.799    54.775      16.0295     54.7751     
1 1 1 16 2  35 o 13 100.823 2.3143  179.302     11.4402  181.43      11.9131  31.0931    166.047     27.3889     346.047     
1 1 1 16 2  36 o 14 189.046 2.60414 634.104     24.6814  632.963     24.6612  100.955    88.6951     45.351      268.695     
1 1 1 16 2  37 o 5  343.278 3.42872 2084.71     57.7974  2094.94     60.1535  232.451    193.896     4.3835      13.8956     
1 1 1 16 2  38 o 17 185.879 2.60265 613.011     24.7644  612.033     23.7134  107.414    45.972      26.693      225.972     
1 1 1 16 2  39 o 19 373.978 3.74915 2485.67     68.7106  2476.46     71.7799  185.032    341.024     144.036     161.024     
1 1 1 16 2  40 o 3  247.325 2.9381  1108.7      33.9232  1060.88     38.6385  135.836    116.746     62.5412     296.746     
1 1 1 16 2  41 o 15 320.645 3.28367 1780.38     51.6811  1867.19     53.8553  239.312    263.25      42.3658     263.25      
1 1 1 16 2  42 o 15 75.41   2.4658  104.304     8.65426  97.8176     9.84593  18.1336    274.453     41.5226     94.4525     
1 1 1 16 2  43 o 5  137.963 2.30493 341.488     14.9458  333.616     16.8315  76.7382    12.6233     22.8103     192.623     
1 1 1 16 2  44 o 13 14.4579 4.12536 0.861404    4.3939   2.28363     4.83823  27.5516    331.154     57.2823     331.154     
1 1 1 16 2  45 o 12 189.664 2.67621 620.226     24.2955  655.828     26.5761  159.394    69.2544     74.9806     69.2544     
1 1 1 16 2  46 o 14 479.475 4.81282 4023.08     109.77   4147.36     121.382  348.155    340.618     44.5201     340.618     
1 1 1 16 2  47 o 6  97.0022 2.56888 164.897     12.1543  169.302     12.776   15.994     27.8911     86.791      207.891     
1 1 1 16 2  48 o 11 140.743 2.63107 349.412     17.5644  353.674     19.479   55.0705    24.0344     70.8555     204.034     
1 1 1 16 2  49 f 0  287.697 3.26435 1454.26     45.8731  1483.23     48.2457  193.959    39.3204     0           0           
1 1 1 16 2  50 o 2  282.211 3.24366 1412.05     42.4433  1414.49     49.0699  218.671    331.096     63.2226     331.096     
1 1 1 16 2  51 o 12 102.652 2.54853 193.636     12.0269  180.71      13.9963  58.8067    297.703     2.36114     297.703     
1 1 1 16 2  52 o 6  109.446 2.50547 218.53      12.9715  206.892     14.3914  66.5304    283.829     5.72175     283.829     
1 1 1 16 2  53 o 17 287.213 3.56526 1489.33     51.3033  1440.61     51.3184  208.121    2.52171     36.7553     2.52171     
1 1 1 16 2  54 o 3  432.702 4.37237 3332.06     99.4292  3327.57     89.9623  346.062    291.603     116.902     291.603     
1 1 1 16 2  55 o 1  317.484 3.3336  1828.66     56.4975  1752.26     49.4782  168.308    213.608     83.9612     33.608      
1 1 1 16 2  56 o 18 164.299 2.47053 504.854     21.7491  453.806     18.9435  112.868    148.368     14.0393     148.368     
1 1 1 16 2  57 o 10 123.118 2.52636 278.377     16.078   260.304     15.0684  57.9809    330.797     40.748      150.797     
1 1 1 16 2  58 o 14 169.881 2.89827 510.387     23.9801  514.962     25.3549  106.376    284.724     6.45758     104.724     
1 1 1 16 2  59 o 13 345.526 3.81438 2234.73     70.7043  2019.97     61.4071  230.083    280.666     7.3366      280.666     
1 1 1 16 2  60 o 18 105.808 2.832   200.78      15.2907  197.752     14.686   65.4582    212.911     0.264987    212.912     
1 1 1 16 2  61 f 0  225.726 3.15249 911.882     35.7442  901.645     35.578   132.038    245.582     0           0           
1 1 1 16 2  62 o 11 132.927 2.76285 324.079     18.9545  305.144     17.8192  113.854    53.1754     63.4006     53.1754     
1 1 1 16 2  63 o 2  253.383 3.04416 1162.07     39.5869  1125.25     37.723   178.126    51.4769     29.7283     51.477      
1 1 1 16 2  64 o 11 125.018 2.59343 277.791     16.1427  278.902     16.3184  88.0857    13.2807     20.5913     13.2807     
1 1 1 16 2  65 o 14 125.455 2.25374 272.817     13.8572  287.331     14.4609  107.122    1.38033     60.6154     1.38033     
1 1 1 16 2  66 o 6  110.259 2.64158 237.992     14.9836  196.581     14.1343  62.9987    306.48      11.8902     126.48      
1 1 1 16 2  67 o 4  123.997 2.83085 280.634     17.1005  268.529     17.9963  70.7567    189.075     15.0016     9.07494     
1 1 1 16 2  68 o 5  39.5688 4.29148 33.5592     7.82858  24.4588     8.38643  19.1992    26.9422     7.70596     26.9422     
1 1 1 16 2  69 o 17 83.2335 2.93884 125.443     12.5132  122.92      11.9238  51.8083    38.6795     1.23725     38.6796     
1 1 1 16 2  70 o 6  97.0819 2.89254 168.681     14.0277  169.192     14.0547  70.6139    247.426     21.609      247.426     
1 1 1 16 2  71 o 16 52.2747 3.56145 61.1474     9.51332  39.3425     8.69811  34.3576    145.244     9.41814     145.244     
1 1 1 16 2  72 o 3  21.9283 5.03472 14.3489     7.67917  2.46221     5.8389   0.704012   144.639     13.169      324.639     
1 1 1 16 2  73 o 9  24.7086 5.36557 9.83569     8.18541  12.4975     6.58404  4.37929    12.3431     9.06829     192.343     
1 1 1 16 2  74 o 11 31.6661 4.94868 23.9537     8.6101   14.7601     6.77545  6.01328    186.95      22.1611     6.95039     
1 1 1 16 2  75 o 14 32.5252 5.76511 13.2128     10.2746  27.5433     9.23335  11.0239    151.26      12.2002     331.26      
1 1 1 16 2  76 o 4  21.0036 5.78299 5.07154     8.50032  6.32136     9.01775  2.03849    223.186     12.0326     43.1862     
1 1 1 16 2  77 o 10 73.3052 3.86911 98.5444     14.1195  98.6651     14.1028  46.3662    207.024     4.74052     207.023     
1 1 1 16 2  78 o 16 28.1183 6.19302 15.3367     9.31833  15.4198     10.0114  12.5574    120.741     0.265705    120.741     
1 1 1 16 2  79 o 19 58.4846 4.27282 63.0229     11.9136  64.9044     12.7658  32.5318    77.6137     3.93987     257.614     
1 1 1 16 2  80 o 13 59.8336 4.21932 74.6662     12.3048  59.8635     12.4831  42.3586    150.661     15.3146     150.661     
1 1 1 16 2  81 o 6  18.3318 5.60361 2.36986     8.81461  -2.07557    10.2556  1.10729    7.61604     3.24379     187.616     
1 1 1 16 2  82 o 7  19.1772 5.70956 -0.530252   9.08351  5.01543     9.75524  1.15497    354.565     3.00814     174.565     
1 1 1 16 2  83 o 1  75.3484 4.21509 102.72      15.8208  110.928     15.726   50.7344    298.249     13.9374     298.249     
1 1 1 16 2  84 o 13 47.2517 6.21095 55.2382     13.3224  36.1212     14.6197  21.5726    4.48861     9.95163     184.489     
1 1 1 16 2  85 o 4  29.0503 6.79555 5.81808     12.1504  26.5715     12.8374  3.4366     226.985     24.19       46.9849     
1 1 1 16 2  86 o 19 28.3084 7.60852 14.4263     17.051   15.5402     13.0214  10.9852    342.475     5.08561     162.475     
1 1 1 16 2  87 o 4  23.7627 7.05518 2.90013     16.3101  8.82121     12.604   7.17431    78.4794     4.42846     258.479     
1 1 1 16 2  88 o 6  24.0594 7.41486 7.42115     16.6833  1.99972     17.0362  5.98992    79.0479     6.89521     259.048     
1 1 1 16 2  89 o 5  45.2707 8.5199  35.7457     19.9364  67.0904     20.9371  21.0113    5.19754     6.23791     185.198     
1 1 1 16 2  90 o 15 22.2573 7.04055 -14.2086    16.6798  11.7296     17.1137  2.04809    220.719     5.73132     40.7194     
1 1 1 16 2  91 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 3  0  f 0  790.348 6.6131  11076.5     261.847  11076.5     261.847  638.484    3.22558e-06 0           0           
1 1 1 16 3  1  o 16 326.281 3.187   1906.22     53.0785  1867.06     51.1427  201.445    75.2438     47.6653     255.244     
1 1 1 16 3  2  o 1  350.649 3.27344 2175.73     57.5196  2182.13     57.5254  139.334    310.723     214.214     130.723     
1 1 1 16 3  3  o 5  454.871 4.00485 3701.32     92.9803  3632.92     89.5988  245.72     52.6232     154.599     232.623     
1 1 1 16 3  4  f 0  376.962 3.53714 2482.24     66.807   2554.61     66.824   264.151    40.8298     0           0           
1 1 1 16 3  5  o 16 724.693 6.31093 9288.41     215.039  9335.14     242.591  336.724    7.84502     370.013     187.845     
1 1 1 16 3  6  o 8  934.091 7.48121 15466.8     350.201  15483.1     350.208  740.001    203.576     134.534     203.576     
1 1 1 16 3  7  o 15 441.984 3.88731 3433.04     86.095   3491.41     86.1057  269.446    334.197     85.4202     154.197     
1 1 1 16 3  8  o 13 433.314 3.91303 3333.17     86.5321  3322.22     83.3883  182.322    293.452     249.703     113.452     
1 1 1 16 3  9  o 6  1019.82 8.46537 18330.9     432.631  18573.2     432.64   711.21     333.772     47.2824     153.772     
1 1 1 16 3  10 o 1  710.657 5.93267 8977.12     207.321  8931.24     215.157  504.502    114.264     8.29325     294.265     
1 1 1 16 3  11 o 5  737.086 6.64291 9490.76     260.597  9778.95     228.591  468.749    101.967     118.823     281.967     
1 1 1 16 3  12 o 5  546.95  5.03967 5150.3      143.557  5458.09     132.056  486.069    342.201     203.243     342.201     
1 1 1 16 3  13 o 8  922.871 8.17071 15168.3     386.024  15053.1     369.629  695.543    99.166      67.2633     99.166      
1 1 1 16 3  14 o 15 362.53  3.71681 2327.44     66.0462  2331.18     68.9774  280.896    10.2401     69.2856     10.2401     
1 1 1 16 3  15 o 1  473.282 4.40519 3959.7      104.474  3981.15     104.491  260.783    167.416     145.296     347.416     
1 1 1 16 3  16 o 2  140.951 2.41876 368.177     17.0462  336.504     17.0818  10.6161    71.6993     8.6077      251.699     
1 1 1 16 3  17 o 18 309.004 3.23753 1717.64     49.0888  1666.92     51.1211  158.746    334.388     101.293     154.388     
1 1 1 16 3  18 o 15 472.524 4.3473  3956.39     100.852  3959.3      104.997  377.084    50.5143     97.1709     50.5143     
1 1 1 16 3  19 o 9  148.908 2.35711 383.243     17.5392  402.734     17.6343  18.2488    180.597     2.67825     0.596601    
1 1 1 16 3  20 f 0  465.826 4.25574 3862.81     97.3141  3830.28     101.323  336.337    159.169     0           0           
1 1 1 16 3  21 o 13 702.572 5.94312 8727.82     201.038  8780.79     217.196  590.765    136.811     187.034     136.811     
1 1 1 16 3  22 o 10 563.196 4.9449  5668.17     142.338  5580.04     136.774  331.169    6.09533     133.798     186.095     
1 1 1 16 3  23 o 6  290.686 2.89497 1524.46     42.1509  1470.85     42.1831  153.22     269.925     90.0361     89.9252     
1 1 1 16 3  24 o 11 211.243 2.58494 802.121     27.3226  779.597     27.4017  64.6937    318.616     152.175     138.616     
1 1 1 16 3  25 o 7  452.693 4.13052 3672.1      93.6861  3594.57     93.7181  226.652    311.169     183.301     131.169     
1 1 1 16 3  26 o 9  95.0264 2.32359 163.961     10.7744  156.521     11.2997  13.0346    158.845     120.358     158.845     
1 1 1 16 3  27 o 4  538.784 4.81724 5086.29     132.562  5210.78     127.449  433.385    35.9466     110.805     35.9466     
1 1 1 16 3  28 o 17 381.246 3.7009  2591.21     72.086   2562.6      69.3181  317.011    90.2183     108.103     90.2183     
1 1 1 16 3  29 o 15 162.003 2.46418 460.395     19.9477  469.927     20.0634  71.8845    105.53      61.7734     285.53      
1 1 1 16 3  30 o 18 372.763 3.63399 2466.76     66.4895  2460.56     69.2497  286.081    313.869     56.7043     313.869     
1 1 1 16 3  31 o 12 383.146 3.76243 2586.06     72.2162  2620.2      72.2668  276.489    162.214     21.5986     162.214     
1 1 1 16 3  32 o 11 542.844 4.87587 5219.36     129.942  5238.16     135.301  379.765    358.914     0.0112935   358.916     
1 1 1 16 3  33 o 4  116.565 2.30244 236.098     13.1064  245.983     13.7681  39.8222    126.083     54.2084     306.083     
1 1 1 16 3  34 o 19 500.826 4.7684  4492.01     122.251  4410.84     117.092  413.841    198.141     132.187     198.141     
1 1 1 16 3  35 o 5  385.057 3.75783 2643.45     72.486   2616.26     72.5405  251.865    74.45       27.9696     254.45      
1 1 1 16 3  36 o 17 168.408 2.48168 489.229     20.9204  516.462     20.958   75.213     346.301     67.9338     166.301     
1 1 1 16 3  37 o 16 41.7212 3.26433 30.5049     6.98427  31.9955     6.40168  40.9619    318.986     103.949     318.986     
1 1 1 16 3  38 o 8  139.451 2.42058 337.835     16.5471  351.698     17.2868  68.0497    354.018     38.3845     174.018     
1 1 1 16 3  39 o 1  358.909 3.87724 2310.34     68.0055  2260.83     71.386   270.62     168.035     49.6098     168.035     
1 1 1 16 3  40 o 12 411.64  3.92178 2970.59     80.8677  3043.11     80.9287  280.298    334.195     5.92129     154.195     
1 1 1 16 3  41 o 15 302.511 3.37291 1589.34     48.7891  1657.67     53.4528  205.583    87.9125     1.70612     267.912     
1 1 1 16 3  42 o 15 162.608 2.64727 483.205     19.9293  454.983     22.9791  82.3217    39.9383     49.923      219.938     
1 1 1 16 3  43 o 2  177.098 2.56648 556.657     22.3068  555.578     23.2383  100.37     290.321     33.4109     110.321     
1 1 1 16 3  44 o 7  242.321 2.85278 1040.42     33.8925  1042.39     35.3797  183.345    35.4228     42.8207     35.4228     
1 1 1 16 3  45 o 10 493.459 4.76305 4233.81     114.981  4420.22     120.606  360.304    170.9       47.3599     170.9       
1 1 1 16 3  46 o 17 28.5898 4.29968 12.4959     5.80126  17.8082     6.16904  10.5139    286.564     25.2675     286.564     
1 1 1 16 3  47 o 1  343.62  3.43496 2056.11     56.6441  2135.03     61.6303  203.112    144.097     58.1901     324.097     
1 1 1 16 3  48 o 18 80.6631 2.54309 119.638     9.30131  111.664     11.0576  29.5746    50.0565     18.9011     230.057     
1 1 1 16 3  49 o 4  379.71  3.69736 2490.71     65.684   2629.56     74.9354  309.331    210.983     108.942     210.983     
1 1 1 16 3  50 o 19 22.5512 4.63493 4.37626     5.53199  13.7406     6.19888  27.1685    284.44      60.764      284.44      
1 1 1 16 3  51 o 18 130.958 2.33516 304.237     14.9947  304.227     15.6356  90.2171    23.3217     20.5836     23.3217     
1 1 1 16 3  52 o 2  57.328  2.93684 58.6304     8.51824  58.6149     8.2396   6.58624    126.982     70.6161     126.982     
1 1 1 16 3  53 o 4  286.22  3.12162 1436.81     46.3597  1471.72     43.0867  183.881    112.347     11.9603     292.347     
1 1 1 16 3  54 o 19 88.5434 2.69005 151.567     12.2585  127.706     11.543   30.0244    98.6067     47.3389     278.607     
1 1 1 16 3  55 o 17 85.6468 2.68494 134.387     12.1166  126.562     10.8698  37.7155    95.2086     27.6206     275.209     
1 1 1 16 3  56 o 5  70.8718 3.04578 103.379     11.3854  76.7005     10.1162  11.3158    50.3002     110.179     50.3002     
1 1 1 16 3  57 o 2  217.182 3.04776 875.972     34.1212  801.031     32.2297  145.782    76.5999     7.74958     76.5999     
1 1 1 16 3  58 o 1  138.018 2.64253 338.265     18.7471  338.838     17.7598  92.341     215.234     9.13824     215.234     
1 1 1 16 3  59 o 4  92.0719 2.77784 154.993     13.8215  146.885     11.715   52.827     49.6604     6.26317     229.66      
1 1 1 16 3  60 o 17 182.617 2.705   623.364     28.0227  562.901     21.3233  120.105    19.7382     4.47671     19.7381     
1 1 1 16 3  61 o 1  136.725 2.8273  353.877     19.3016  312.338     19.341   85.0706    160.702     3.78982     340.702     
1 1 1 16 3  62 o 8  81.7789 2.94475 124.926     11.5444  113.93      12.4325  29.9784    64.3955     40.3527     244.396     
1 1 1 16 3  63 o 16 223.221 2.87388 913.939     32.1622  861.192     32.1151  157.6      333.374     28.0577     333.374     
1 1 1 16 3  64 o 5  29.8914 5.03862 12.9274     7.76791  20.5564     7.29426  3.49791    288.117     23.0363     288.117     
1 1 1 16 3  65 o 11 51.9436 3.66153 40.7168     8.80018  57.5029     9.94403  22.4229    110.094     11.6624     290.094     
1 1 1 16 3  66 o 19 42.6551 4.28531 38.7398     8.1641   28.3374     9.22064  18.1162    224.62      8.22167     44.6202     
1 1 1 16 3  67 o 6  83.4305 3.01483 135.159     11.5378  114.599     13.3011  50.9975    216.697     1.37819     36.6967     
1 1 1 16 3  68 o 9  14.5177 4.52771 -3.82709    6.24341  -0.0121871  6.70739  15.9864    283.516     42.2        283.516     
1 1 1 16 3  69 o 6  61.9699 3.41456 75.4879     9.69345  63.4613     11.0897  32.7252    301.938     9.28349     121.938     
1 1 1 16 3  70 o 11 93.04   2.90963 154.585     12.8929  156.047     14.1478  73.0701    41.3604     32.1011     41.3604     
1 1 1 16 3  71 o 9  25.3424 5.03156 7.54625     7.31232  16.0936     6.60054  1.05786    182.589     21.7414     2.58934     
1 1 1 16 3  72 o 2  36.7718 4.34753 29.6117     8.06864  21.1735     7.35084  0.82206    201.601     40.9846     21.6014     
1 1 1 16 3  73 o 6  23.5907 5.28077 14.753      8.04885  5.75522     6.33351  3.12295    56.0757     3.85099     236.076     
1 1 1 16 3  74 o 16 71.2462 3.09162 99.4269     11.685   84.2154     10.3002  39.6179    354.465     6.931       174.465     
1 1 1 16 3  75 o 7  64.5575 3.30309 82.7594     11.361   68.8048     9.88413  38.1423    241.228     1.04689     61.2277     
1 1 1 16 3  76 o 8  55.8915 3.63602 58.6516     10.8853  55.7897     9.2124   26.086     72.7029     14.5548     252.703     
1 1 1 16 3  77 o 15 86.0275 3.16371 148.446     13.909   120.86      13.2257  59.8672    24.5929     15.7571     24.5929     
1 1 1 16 3  78 o 8  22.2722 5.9271  2.28211     9.27064  11.8297     9.40324  5.64754    74.1083     2.56004     254.108     
1 1 1 16 3  79 o 8  75.1379 3.72783 109.503     13.7705  98.9309     14.0737  42.0473    352.522     5.91782     172.522     
1 1 1 16 3  80 o 17 40.808  5.7808  28.4514     11.5696  38.1898     11.2155  22.4841    286.151     0.29119     106.151     
1 1 1 16 3  81 o 9  37.4702 5.84179 38.8002     10.654   18.5632     11.1305  22.1529    130.97      5.41678     130.97      
1 1 1 16 3  82 o 1  45.3792 5.74825 49.0049     12.5964  33.7784     12.4207  27.2788    188.442     4.77136     188.442     
1 1 1 16 3  83 o 11 29.4593 7.16239 17.2899     14.1698  17.7914     11.5403  11.2693    119.288     2.24633     119.288     
1 1 1 16 3  84 f 0  21.3879 6.3112  3.99663     10.6275  4.6039      11.8845  1.65045    294.85      0           0           
1 1 1 16 3  85 o 10 28.6964 7.01976 20.9182     12.1334  11.2532     13.1806  5.52159    21.2721     19.3193     201.272     
1 1 1 16 3  86 o 14 44.8503 7.59612 49.9496     18.6422  39.0642     15.0912  22.432     194.462     4.77306     14.462      
1 1 1 16 3  87 o 1  25.9319 7.15859 -3.33701    17.0128  19.5529     13.2419  5.6588     180.488     1.70032     180.488     
1 1 1 16 3  88 o 18 37.9365 9.19219 37.3124     18.6618  37.2541     24.0562  19.4677    208.12      1.65527     208.12      
1 1 1 16 3  89 o 18 31.3847 8.43486 30.3213     18.333   16.0027     19.3923  12.0051    148.201     2.29762     328.201     
1 1 1 16 3  90 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 4  0  o 2  73.1763 2.29686 95.4403     8.38508  95.4403     8.38508  104.441    180         277.643     180         
1 1 1 16 4  1  o 17 741.462 6.15757 9735.65     232.994  9759.87     224.52   568.165    251.5       70.957      251.5       
1 1 1 16 4  2  o 8  683.082 5.62245 8267.01     192.467  8277.44     192.47   554.634    95.6105     130.967     95.6105     
1 1 1 16 4  3  f 0  436.691 3.92294 3398.16     87.4293  3361.48     84.2589  186.422    166.345     0           0           
1 1 1 16 4  4  o 16 342.057 3.23824 2073.17     55.5071  2073.8      55.5121  130.8      233.157     217.598     53.1572     
1 1 1 16 4  5  o 12 327.733 3.18722 1890.2      53.2942  1916.76     51.367   209.706    184.889     30.4632     4.88944     
1 1 1 16 4  6  o 13 549.693 4.72292 5329.07     127.678  5383.13     132.507  412.352    326.324     43.4341     326.324     
1 1 1 16 4  7  o 19 1022.61 8.15837 18539.3     418.086  18566.1     418.102  790.591    189.454     106.137     189.454     
1 1 1 16 4  8  o 19 866.06  7.2614  13287.9     327.03   13319.5     302.789  504.772    137.625     238.427     317.625     
1 1 1 16 4  9  o 3  770.804 6.36851 10478.2     241.42   10593.4     250.547  557.785    97.7453     9.43508     97.7454     
1 1 1 16 4  10 o 18 254.641 2.66955 1186.56     33.4008  1112.12     34.6532  167.167    349.924     8.24982     349.924     
1 1 1 16 4  11 o 19 565.024 4.85426 5651.37     134.878  5667.34     139.985  430.347    14.7255     59.8705     14.7255     
1 1 1 16 4  12 o 10 918.21  7.7935  14908       365.691  15008.1     351.355  727.876    155.566     137.763     155.566     
1 1 1 16 4  13 o 19 1152.22 9.66331 23510.3     568.975  23633       546.706  1008.29    234.275     360.16      234.275     
1 1 1 16 4  14 o 7  724.441 6.24675 9271.63     222.214  9342.51     231.3    534.078    270.802     34.426      270.802     
1 1 1 16 4  15 o 14 401.102 3.77078 2811.75     75.7899  2891.5      75.7912  205.682    164.295     149.658     344.295     
1 1 1 16 4  16 o 1  435.459 3.89649 3348.39     86.5785  3373.7      83.4436  374.741    315.846     148.857     315.846     
1 1 1 16 4  17 o 8  591.148 5.04078 6174.88     152.056  6216.56     146.538  405.867    246.02      26.9069     66.0204     
1 1 1 16 4  18 o 16 484.632 4.37712 4174.17     110.325  4152.94     102.151  338.069    289.578     5.53002     109.578     
1 1 1 16 4  19 o 9  544.718 4.97544 5303.5      135.806  5218.58     135.827  356.417    8.07251     58.1676     188.073     
1 1 1 16 4  20 o 5  707.574 6.23765 8902.62     221.168  8859.6      221.199  427.242    341.012     153.985     161.012     
1 1 1 16 4  21 o 13 283.28  3.05302 1445.13     42.4332  1399.55     44.1955  246.931    252.758     128.206     252.758     
1 1 1 16 4  22 o 2  337.875 3.42724 2058.21     56.8195  1989.09     59.1663  270.841    247.387     79.9956     247.387     
1 1 1 16 4  23 o 14 714.815 6.11051 9049.93     214.45   9081.23     223.261  526.191    30.3988     36.6343     30.3988     
1 1 1 16 4  24 o 6  225.349 2.72633 929.028     30.1178  871.474     31.3831  144.942    174.453     7.1573      354.453     
1 1 1 16 4  25 o 2  531.078 4.79486 5048.49     124.989  4955.8      130.128  407.594    67.5783     66.9591     67.5783     
1 1 1 16 4  26 o 18 142.061 2.31147 372.66      15.7219  342.969     17.0841  44.9693    112.033     84.8434     292.033     
1 1 1 16 4  27 o 9  446.412 3.93884 3507.82     89.698   3559.35     86.4816  358.291    269.433     92.6242     269.433     
1 1 1 16 4  28 o 13 528.418 4.65391 4923.85     123.211  4981.89     123.269  370.534    300.012     2.52169     120.012     
1 1 1 16 4  29 o 19 191.395 2.54439 661.866     24.85    636.814     23.9618  137.43     353.149     29.9095     353.149     
1 1 1 16 4  30 o 1  224.088 2.66276 911.441     29.8538  869.002     29.9369  67.1908    253.182     172.374     73.1819     
1 1 1 16 4  31 o 9  378.759 3.54512 2549.6      67.2593  2538.09     67.3214  325.153    173.488     127.276     173.488     
1 1 1 16 4  32 o 14 274.938 2.88439 1327.44     38.9654  1352.79     40.5155  166.876    317.244     42.5054     137.244     
1 1 1 16 4  33 o 11 231.408 2.61803 935.357     29.7525  963.295     30.97    64.0467    293.785     188.289     113.785     
1 1 1 16 4  34 o 1  387.614 3.65214 2664.54     68.1312  2665.07     73.6469  256.865    43.7331     23.078      223.733     
1 1 1 16 4  35 o 2  285.703 2.98043 1465.57     40.9447  1429.16     44.2887  243.112    192.888     102.323     192.888     
1 1 1 16 4  36 o 18 184.647 2.45516 596.577     21.7859  612.275     23.6349  98.7961    118.043     45.6816     298.043     
1 1 1 16 4  37 o 2  35.2983 3.58353 22.3834     6.21634  22.7213     6.09669  13.2045    149.217     32.3198     149.217     
1 1 1 16 4  38 o 10 370.246 3.97264 2490.56     68.1112  2374.92     78.6483  278.562    258.851     47.6362     258.851     
1 1 1 16 4  39 o 4  447.637 4.66842 3588.76     109.888  3527.26     99.3842  310.212    326.986     1.51732     326.987     
1 1 1 16 4  40 o 12 414.781 4.4899  3028.71     90.8595  3080.76     95.7704  259.928    188.913     52.5736     8.91315     
1 1 1 16 4  41 o 17 216.252 2.97825 820.942     32.273   837.881     32.2769  114.214    243.345     63.9987     63.3446     
1 1 1 16 4  42 o 6  165.971 2.78528 480.969     22.5151  496.09      23.8157  61.3618    137.042     98.4745     317.042     
1 1 1 16 4  43 o 3  82.0964 2.50901 125.469     9.92148  114.126     10.6115  8.18781    163.939     116.439     163.939     
1 1 1 16 4  44 o 19 89.7151 2.51094 137.936     11.1298  148.042     11.4012  9.24201    284.23      90.7202     104.23      
1 1 1 16 4  45 o 1  316.691 3.42744 1732.56     50.7367  1827.53     57.9772  212.169    5.88913     4.7105      185.889     
1 1 1 16 4  46 o 6  218.417 2.65404 829.793     28.4301  862.498     29.6737  99.659     268.694     93.2459     88.6938     
1 1 1 16 4  47 o 7  173.83  2.5609  531.232     22.2603  540.549     22.357   81.6035    313.665     65.5679     133.665     
1 1 1 16 4  48 o 13 397.154 3.93332 2711.79     79.8126  2891.68     76.5576  301.098    202.147     65.9734     202.147     
1 1 1 16 4  49 o 3  205.216 2.73811 724.281     28.0907  770.108     28.2116  125.02     335.568     20.7567     155.568     
1 1 1 16 4  50 o 3  139.374 2.53183 332.668     17.9777  356.853     17.3266  92.9697    228.477     11.3993     228.477     
1 1 1 16 4  51 o 13 125.828 2.52288 273.71      15.4493  288.507     16.3386  81.0196    328.984     7.17374     328.984     
1 1 1 16 4  52 o 6  54.3441 2.96582 51.4487     7.95708  54.0167     8.07088  5.77472    254.355     65.8221     254.355     
1 1 1 16 4  53 o 19 305.031 3.36206 1583.05     50.5929  1723.56     52.1801  199.832    324.223     6.42693     144.223     
1 1 1 16 4  54 o 11 226.01  3.4313  903.315     41.1705  911.815     36.3852  146.751    82.8985     4.73678     262.899     
1 1 1 16 4  55 o 18 81.2646 2.74354 124.715     11.313   110.511     10.9562  23.1176    259.688     53.461      79.6884     
1 1 1 16 4  56 o 16 154.614 2.62549 446.034     22.4386  403.645     18.1784  119.153    225.419     40.2637     225.419     
1 1 1 16 4  57 o 7  110.668 2.77751 222.985     16.7224  212.735     13.9701  73.8531    179.762     10.2002     179.762     
1 1 1 16 4  58 o 17 58.4926 3.24445 64.901      10.0623  57.6609     8.81425  25.6991    241.252     3.10702     61.2525     
1 1 1 16 4  59 o 7  86.3698 2.64955 142.426     11.5633  123.528     11.2917  56.6621    202.792     11.1357     202.792     
1 1 1 16 4  60 o 17 42.4297 3.87327 44.812      8.91334  22.4256     6.95795  7.10171    173.503     60.0143     173.503     
1 1 1 16 4  61 o 7  56.772  2.96414 60.6253     8.63773  54.817      8.1119   15.8347    132.964     7.74083     132.964     
1 1 1 16 4  62 o 15 72.3277 3.15245 101.781     11.2569  85.7521     11.4035  29.4809    175.596     27.6115     355.596     
1 1 1 16 4  63 o 9  86.7321 2.48271 137.086     10.9235  131.048     10.6148  45.3159    138.665     15.1423     318.665     
1 1 1 16 4  64 o 3  83.8468 2.44269 118.941     10.1211  131.854     10.3527  47.7201    209.642     6.81411     29.6424     
1 1 1 16 4  65 f 0  87.7719 3.12222 136.288     12.9365  139.539     14.4163  42.7852    331.792     0           0           
1 1 1 16 4  66 o 18 22.3783 5.69525 7.12111     7.71302  8.51629     8.58843  0.0898177  9.01633     8.94462     9.01634     
1 1 1 16 4  67 o 6  57.4293 3.67848 62.0405     9.41101  57.3821     11.3258  44.6722    357.39      27.4408     357.39      
1 1 1 16 4  68 o 10 30.9919 5.39992 17.7302     7.44026  18.723      9.23993  4.59092    251.235     23.0447     71.2347     
1 1 1 16 4  69 o 11 38.7952 4.66272 24.3639     8.05106  32.0571     9.45181  15.1705    52.4418     12.4802     232.442     
1 1 1 16 4  70 o 6  41.9974 4.26703 31.923      8.50105  33.3167     8.94587  25.473     326.286     7.71494     326.286     
1 1 1 16 4  71 o 2  155.162 2.75012 432.703     20.8828  429.961     21.8521  90.7398    357.288     13.3026     177.288     
1 1 1 16 4  72 o 7  62.7582 3.41101 82.5789     10.2418  61.0255     10.7472  30.5922    265.128     14.7374     85.1281     
1 1 1 16 4  73 o 17 57.4061 3.37917 57.7017     9.90784  62.0121     9.31174  30.8161    172.292     6.80322     352.292     
1 1 1 16 4  74 o 13 47.3927 3.86762 39.9243     9.32838  42.7083     8.64855  30.742     232.396     7.7628      232.396     
1 1 1 16 4  75 o 10 108.824 2.75938 215.719     15.2637  210.455     14.785   77.1685    0.607858    20.7718     0.607858    
1 1 1 16 4  76 o 6  34.2179 5.05657 26.5638     8.86111  18.852      7.961    20.2304    124.042     5.69789     124.042     
1 1 1 16 4  77 o 11 44.0363 4.69382 35.8302     9.26561  37.7749     10.7759  20.5035    252.099     10.231      72.0988     
1 1 1 16 4  78 o 13 28.4678 5.70922 19.7331     9.28469  12.5628     7.88674  11.8161    245.31      5.23573     65.3096     
1 1 1 16 4  79 o 14 97.7378 3.67491 190.709     16.7949  161.986     18.7322  54.7634    166.679     8.63064     346.679     
1 1 1 16 4  80 o 9  18.3889 5.73461 -6.67458    8.52276  4.83571     12.0657  1.43813    16.0602     6.90737     196.06      
1 1 1 16 4  81 o 8  37.8562 6.65939 36.9586     11.8584  22.5499     14.0164  14.7524    269.308     12.2135     89.3076     
1 1 1 16 4  82 o 16 26.2943 6.87544 14.0467     10.9434  10.8468     13.3318  5.63601    126.928     13.4917     306.928     
1 1 1 16 4  83 o 4  22.5406 6.53938 7.16564     10.6904  4.37887     13.1029  3.32227    128.269     1.33403     308.269     
1 1 1 16 4  84 o 15 20.7314 6.29007 5.07961     10.7599  -2.36895    13.1786  0.708673   252.944     17.9225     72.9443     
1 1 1 16 4  85 o 12 29.8396 8.0108  24.3998     16.8828  9.12109     17.2263  8.53239    179.064     13.9817     359.064     
1 1 1 16 4  86 o 16 63.0285 6.98483 98.2303     21.2586  71.1734     20.9541  35.6408    33.1592     0.945386    213.159     
1 1 1 16 4  87 o 14 35.4759 8.06184 29.5309     18.1     29.6661     14.6666  14.5097    210.728     7.87593     30.728      
1 1 1 16 4  88 o 1  25.8373 7.76883 13.2215     17.8549  7.16615     17.4113  5.89587    15.742      1.23153     195.742     
1 1 1 16 4  89 o 4  27.5006 8.06765 10.9935     17.9253  18.9016     18.7149  6.69682    332.862     1.97502     152.862     
1 1 1 16 4  90 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 5  0  f 0  257.253 2.86407 1173.54     36.9031  1173.54     36.9031  42.0481    180         0           0           
1 1 1 16 5  1  o 18 601.612 5.12239 6376.1      157.245  6456.72     151.535  562.586    50.8819     272.381     50.8819     
1 1 1 16 5  2  o 11 1327.51 10.4791 31183.4     697.128  31409.8     697.151  1044.25    236.462     165.116     236.462     
1 1 1 16 5  3  o 8  700.914 5.84244 8705.76     201.385  8715.88     208.989  578.403    304.01      152.718     304.01      
1 1 1 16 5  4  o 2  583.787 4.90302 6055.82     143.439  6027.26     143.446  453.722    319.542     75.8645     319.542     
1 1 1 16 5  5  o 2  287.81  2.90599 1464.58     41.9103  1471.3      41.918   134.452    345.839     123.583     165.839     
1 1 1 16 5  6  o 11 244.985 2.77986 1070.16     34.1224  1057.01     34.1347  160.664    115.08      13.3823     115.08      
1 1 1 16 5  7  o 17 341.264 3.2936  2063.2      55.2726  2064.72     57.3641  167.701    230.205     138.449     50.2047     
1 1 1 16 5  8  o 5  261.104 2.78589 1219.85     37.1248  1196.49     35.78    85.4482    227.334     182.721     47.3337     
1 1 1 16 5  9  o 14 139.192 2.30979 343.714     15.4881  342.92      16.711   1.85183    218.59      143.686     38.5899     
1 1 1 16 5  10 o 13 290.934 2.93445 1473.23     42.7682  1527.01     42.7899  142.24     55.4159     110.504     235.416     
1 1 1 16 5  11 o 13 410.693 3.64137 3000.9      74.9366  2977.98     74.9524  172.272    89.9047     234.851     269.905     
1 1 1 16 5  12 o 8  570.807 5.07374 5822.9      145.131  5730.35     145.136  495.887    50.3281     185.096     50.3281     
1 1 1 16 5  13 o 12 604.669 5.35428 6466.29     171.668  6499.41     152.191  496.51     19.6816     134.374     19.6816     
1 1 1 16 5  14 o 10 265.712 3.0137  1241.25     38.438   1261.27     41.7776  189.468    151.156     34.0352     151.156     
1 1 1 16 5  15 o 4  150.309 2.28503 412.691     16.891   388.214     17.4977  45.1002    308.552     69.4946     128.552     
1 1 1 16 5  16 o 4  745.108 6.03502 9836.52     225.334  9857.46     225.367  573.15     88.9202     80.9558     88.9202     
1 1 1 16 5  17 o 15 272.061 2.85138 1299.81     39.5718  1323.75     38.1518  159.764    178.436     48.1248     358.436     
1 1 1 16 5  18 o 15 920.572 7.47857 15050.6     351.329  15032.8     338.588  724.609    142.988     130.154     142.988     
1 1 1 16 5  19 o 17 578.974 5.01775 5953.31     145.58   5935.24     145.598  540.14     123.431     262.621     123.431     
1 1 1 16 5  20 o 19 444.882 4.08243 3479.3      94.4025  3538.48     87.4351  357.527    179.651     90.6832     179.651     
1 1 1 16 5  21 o 12 675.641 5.64767 8075.65     194.708  8120        187.657  442.01     127.787     79.4667     307.787     
1 1 1 16 5  22 o 16 552.695 4.73748 5392.78     133.6    5441.64     128.767  426.603    109.874     70.2948     109.874     
1 1 1 16 5  23 o 13 533.019 4.79052 5038.01     130.484  5039.47     125.391  364.364    219.658     26.338      39.6583     
1 1 1 16 5  24 o 13 294.757 3.06471 1542.8      45.2523  1537.25     45.2883  260.965    224.563     125.115     224.563     
1 1 1 16 5  25 o 19 228.172 2.76486 939.765     30.9385  905.951     32.2465  206.796    250.223     136.844     250.223     
1 1 1 16 5  26 o 18 103.538 2.30131 181.978     11.6247  198.557     12.229   5.97012    309.637     105.342     129.637     
1 1 1 16 5  27 o 8  247.935 2.86773 1125.53     35.5855  1054.36     35.6473  178.17     87.4779     20.9383     87.4779     
1 1 1 16 5  28 o 17 592.481 5.14105 6177.48     149.546  6281.3      155.728  490.532    113.018     145.27      113.018     
1 1 1 16 5  29 o 7  112.162 2.35681 231.116     12.8522  215.368     13.5655  29.8345    288.416     7.89646     288.416     
1 1 1 16 5  30 o 10 371.156 3.61809 2438.77     68.601   2447.08     65.9625  298.755    359.152     82.7028     359.152     
1 1 1 16 5  31 o 13 170.691 2.38147 516.109     20.3136  516.757     20.4287  104.402    216.993     10.0197     36.9926     
1 1 1 16 5  32 o 19 555.131 4.89039 5383.28     133.278  5557.74     138.829  342.35     165.08      94.5727     345.08      
1 1 1 16 5  33 o 1  86.8745 2.34314 136.083     10.0878  131.883     10.2715  14.7514    128.739     40.0053     308.739     
1 1 1 16 5  34 o 3  236.168 2.82564 992.38      33.4284  985.405     33.456   177.945    178.672     40.4558     178.672     
1 1 1 16 5  35 o 5  180.968 2.59866 589.525     22.979   571.739     24.1204  70.5388    250.787     100.862     70.787      
1 1 1 16 5  36 o 3  79.9008 2.53825 113.248     10.3348  113.57      9.93577  14.0985    255.863     10.2141     75.863      
1 1 1 16 5  37 o 9  338.143 3.52703 2015.63     58.4251  2041        61.0961  253.328    182.451     40.8856     182.451     
1 1 1 16 5  38 o 17 161.597 2.777   455.9       20.556   470.55      24.2977  90.242     175.973     33.6313     355.973     
1 1 1 16 5  39 o 6  312.675 3.44375 1730.36     53.9422  1738.45     53.981   262.299    129.483     96.6477     129.483     
1 1 1 16 5  40 o 7  111.893 2.47195 234.447     13.3816  210.278     14.2168  30.2754    54.8999     82.8338     234.9       
1 1 1 16 5  41 o 6  148.716 2.48614 391.209     18.0067  393.073     19.0384  84.5067    308.776     24.839      128.776     
1 1 1 16 5  42 o 3  260.83  3.02156 1161.97     38.5327  1252.38     40.4659  230.1      54.28       110.245     54.28       
1 1 1 16 5  43 o 3  276.755 3.14772 1348.79     44.5407  1368.83     42.7391  155.78     29.5006     64.824      209.501     
1 1 1 16 5  44 o 11 274.54  3.08352 1316.51     41.4282  1357.91     43.4199  189.546    40.6858     7.90359     40.6858     
1 1 1 16 5  45 o 3  239.049 2.9649  1010.01     33.1023  1017.42     37.796   181.656    262.442     44.1327     262.442     
1 1 1 16 5  46 o 17 263.23  2.95631 1208.08     38.1973  1250.54     39.802   139.338    133.315     76.4616     313.315     
1 1 1 16 5  47 o 4  165.462 2.4684  491.382     19.531   479.687     21.3407  126.744    36.5063     42.3707     36.5064     
1 1 1 16 5  48 o 14 202.886 2.79987 750.875     26.4638  709.809     30.2236  177.974    33.7655     93.5191     33.7655     
1 1 1 16 5  49 o 11 248.79  3.20227 1068.87     35.7742  1128.59     43.8624  183.275    136.861     35.6737     136.861     
1 1 1 16 5  50 o 6  258.532 3.27629 1173.74     43.5231  1199.3      41.3164  188.027    51.384      32.0829     51.384      
1 1 1 16 5  51 o 6  95.6234 2.53174 163.696     11.8695  161.184     12.3432  60.4164    122.386     16.1849     122.386     
1 1 1 16 5  52 o 15 93.3374 2.50504 157.795     11.6026  151.808     11.782   23.3781    132.809     69.8017     312.809     
1 1 1 16 5  53 o 18 65.0542 2.79937 77.7632     9.0883   73.0708     9.07142  26.883     345.163     11.1035     165.163     
1 1 1 16 5  54 o 7  206.867 2.7716  741.846     28.6414  777.872     28.8166  145.824    226.751     19.2802     226.751     
1 1 1 16 5  55 o 1  111.773 2.45041 208.271     13.9236  236.092     13.4165  62.2608    166.369     16.9439     346.369     
1 1 1 16 5  56 o 9  79.6947 2.74824 110.418     11.4641  115.772     10.3607  33.2057    156.287     30.0811     336.287     
1 1 1 16 5  57 o 17 65.7338 2.82418 85.3123     9.71851  69.2387     8.79699  29.7351    13.9911     13.8081     193.991     
1 1 1 16 5  58 o 13 24.4271 5.07729 10.4503     7.08032  11.2063     6.20639  15.7217    201.997     44.7763     201.997     
1 1 1 16 5  59 f 0  48.2892 3.47422 44.6878     8.34424  39.3425     8.21484  23.7269    257.012     0           0           
1 1 1 16 5  60 o 12 55.7281 3.38523 61.2758     10.4338  50.5067     8.30986  2.96886    143.929     59.8896     323.929     
1 1 1 16 5  61 o 14 140.532 2.54719 373.407     18.9295  330.278     16.9351  67.1006    184.793     46.3741     4.79344     
1 1 1 16 5  62 o 1  83.3004 2.38738 121.442     10.4129  125.797     9.43284  55.2452    156.443     11.7709     156.443     
1 1 1 16 5  63 o 15 150.545 2.4235  426.291     19.2277  380.87      17.3542  108.202    227.213     24.5724     227.213     
1 1 1 16 5  64 o 5  58.3907 2.97314 79.9406     9.78753  44.8675     7.46117  33.353     37.6915     0.0964791   217.693     
1 1 1 16 5  65 o 9  46.507  5.01438 27.9348     11.3774  53.9762     9.92716  25.9038    330.976     0.409082    330.976     
1 1 1 16 5  66 o 4  69.488  2.70609 94.6391     10.4131  78.586      8.3784   45.1281    111.953     5.37179     111.953     
1 1 1 16 5  67 o 2  127.637 2.89541 285.651     18.8539  297.587     18.109   95.153     120.398     28.9636     120.398     
1 1 1 16 5  68 o 16 110.1   2.97603 225.213     16.1341  209.708     16.6087  77.2916    45.7        16.3856     45.7        
1 1 1 16 5  69 o 15 72.5615 3.26709 98.1158     11.0808  91.8864     12.4519  42.8231    122.256     3.43314     302.256     
1 1 1 16 5  70 o 15 27.7976 5.37513 21.2489     7.70654  6.74725     9.07754  6.49736    194.034     1.22032     14.0342     
1 1 1 16 5  71 o 18 47.2395 4.34543 43.3823     9.27358  39.2173     10.6343  21.3895    152.165     12.6114     332.165     
1 1 1 16 5  72 o 14 71.5727 3.54755 87.3362     11.2206  98.8262     14.0395  38.5354    32.0866     10.3669     212.087     
1 1 1 16 5  73 o 2  46.5983 4.7438  38.9173     9.24614  42.3948     12.1477  18.6384    124.44      17.5956     304.44      
1 1 1 16 5  74 o 5  136.261 2.94845 343.726     18.9828  325.343     21.1038  96.7778    109.104     24.6844     109.104     
1 1 1 16 5  75 o 6  30.2447 5.79024 12.6751     8.9793   23.1837     9.42191  6.88287    182.989     19.7778     2.98879     
1 1 1 16 5  76 o 1  13.6946 4.40091 -1.90584    6.99272  -4.99109    6.1782   1.696      359.637     8.33339     359.637     
1 1 1 16 5  77 o 4  54.9888 3.72051 57.9328     10.5751  53.8854     9.68245  25.5537    34.2893     14.6124     214.289     
1 1 1 16 5  78 o 10 31.7151 5.34254 25.9031     8.70409  14.2635     8.33824  10.7574    355.02      13.4269     175.02      
1 1 1 16 5  79 o 5  29.0684 6.21515 19.3078     8.8449   14.0902     11.3124  13.8413    99.077      1.80018     99.077      
1 1 1 16 5  80 o 13 28.7946 5.75859 25.873      9.01094  3.94777     11.3372  9.54475    43.7505     10.4144     223.751     
1 1 1 16 5  81 o 13 55.3546 4.75317 57.6008     11.9865  60.1275     13.7932  39.401     76.0894     16.266      76.0894     
1 1 1 16 5  82 o 12 44.5962 6.04146 48.4793     12.8696  32.7358     13.0302  17.3159    313.502     15.9615     133.502     
1 1 1 16 5  83 o 13 44.4634 6.18263 49.7635     13.175   31.5554     13.3097  14.1758    26.381      22.5295     206.381     
1 1 1 16 5  84 o 6  17.6164 5.7767  -3.90512    13.4188  -9.4098     10.6032  0.787199   117.565     11.197      297.565     
1 1 1 16 5  85 o 12 62.0389 6.34534 85.8949     21.4671  72.8493     16.7718  47.8871    304.756     25.8217     304.756     
1 1 1 16 5  86 o 16 20.7362 6.61961 1.74019     16.1567  -4.53292    12.8355  0.896102   274.131     16.7477     94.131      
1 1 1 16 5  87 o 6  41.1851 8.71553 45.3506     23.7187  40.2851     15.8037  22.8905    45.6248     3.59214     45.6248     
1 1 1 16 5  88 o 16 32.8541 8.14266 26.6178     18.1629  26.4955     15.1586  13.7929    312.561     1.57131     132.561     
1 1 1 16 5  89 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 6  0  o 9  81.2626 2.4581  117.652     9.96862  117.652     9.96862  21.1346    3.60006e-05 66.1002     3.60006e-05 
1 1 1 16 6  1  o 11 258.018 2.79905 1165.31     36.8372  1194.32     35.5158  97.2256    271.913     154.26      91.913      
1 1 1 16 6  2  o 19 710.612 5.8126  8928.33     206.993  8980.22     207      489.648    345.375     42.8917     165.375     
1 1 1 16 6  3  o 10 130.196 2.22289 290.06      14.487   310.872     14.508   35.3977    114.261     219.85      114.261     
1 1 1 16 6  4  o 5  342.255 3.2387  2068.97     55.5508  2083.03     55.548   214.083    143.869     44.5532     323.869     
1 1 1 16 6  5  o 9  575.254 4.83302 5887.43     139.323  5845.67     139.332  456.352    353.876     93.344      353.876     
1 1 1 16 6  6  o 12 264.817 2.82407 1235.07     38.1609  1250.51     36.7734  161.018    159.297     28.6765     339.297     
1 1 1 16 6  7  o 8  446.631 4.06572 3542.18     90.999   3529.51     91.0031  348.119    123.315     69.1338     123.315     
1 1 1 16 6  8  o 9  978.257 8.09732 16902.2     381.424  17066.8     412.058  746.906    175.906     81.1336     175.906     
1 1 1 16 6  9  o 7  506.471 4.33707 4519        110.07   4575.35     110.088  484.178    183.304     259.026     183.304     
1 1 1 16 6  10 o 1  527.402 4.57534 4963.15     118.644  4899.11     123.137  326.991    282.922     98.2796     102.922     
1 1 1 16 6  11 o 12 282.169 2.9355  1410.28     40.7226  1411.8      42.2834  167.41     326.655     48.2411     146.655     
1 1 1 16 6  12 o 3  301.979 3.15329 1599.27     46.7628  1633.2      48.6743  253.152    321.417     106.342     321.417     
1 1 1 16 6  13 o 17 334.449 3.45545 2012.52     57.8938  1952.85     57.9268  215.946    46.9656     31.7069     226.966     
1 1 1 16 6  14 o 14 290.65  3.11822 1500.65     44.4906  1493.79     46.3244  107.219    260.123     189.666     80.1226     
1 1 1 16 6  15 o 10 479.636 4.63563 4074.71     98.5683  4083.05     122.963  416.861    173.44      157.935     173.44      
1 1 1 16 6  16 o 9  450.67  4.08307 3604.99     88.5869  3596.26     95.699   311.043    313.882     15.8312     133.882     
1 1 1 16 6  17 o 13 270.388 2.93783 1307.39     38.2065  1284.17     41.3189  224.329    261.213     90.4245     261.213     
1 1 1 16 6  18 o 14 249.898 2.76861 1092.42     34.6452  1121.26     34.6961  117.722    293.9       107.609     113.9       
1 1 1 16 6  19 o 17 822.661 6.76148 12040.4     273.509  11984.9     283.88   647.486    352.68      116.176     352.68      
1 1 1 16 6  20 o 15 476.139 4.24084 3971.93     101.16   4068.02     101.214  421.469    52.7317     171.756     52.7317     
1 1 1 16 6  21 o 5  653.439 5.46976 7616.02     175.727  7534.5      182.401  485.707    22.3502     39.2814     22.3502     
1 1 1 16 6  22 o 5  195.422 2.52002 670.074     25.1267  683.66      24.2131  139.65     246.292     30.3792     246.292     
1 1 1 16 6  23 o 13 459.234 4.26268 3774.52     96.0966  3705.62     100.025  285.816    313.106     78.7322     133.106     
1 1 1 16 6  24 o 14 222.488 2.64514 876.138     29.46    878.622     29.5256  100.902    215.672     102.301     35.6722     
1 1 1 16 6  25 o 3  486.332 4.29431 4182.36     104.64   4207.56     104.683  381.462    254.805     76.0578     254.805     
1 1 1 16 6  26 o 8  507.897 4.67219 4561.35     118.895  4591.56     118.945  377.784    134.405     37.4375     134.405     
1 1 1 16 6  27 o 10 281.199 3.00704 1419.83     40.6638  1383.91     43.9742  196.649    126.931     5.64674     126.931     
1 1 1 16 6  28 o 8  126.738 2.36466 295.025     13.9648  274.791     15.9069  31.5704    353.996     96.2444     173.996     
1 1 1 16 6  29 f 0  271.091 2.94758 1314.14     39.1979  1291.74     40.8572  128.241    342.917     0           0           
1 1 1 16 6  30 o 16 356.314 3.52783 2277.07     61.6794  2226.28     64.248   226.428    246.465     43.9567     66.4648     
1 1 1 16 6  31 o 11 513.959 4.77595 4663.86     120.303  4713.87     125.689  424.548    6.29987     128.733     6.29987     
1 1 1 16 6  32 o 14 292.525 3.30424 1530.58     46.1516  1504.54     50.5838  182.79     46.0466     37.4405     226.047     
1 1 1 16 6  33 o 9  171.081 2.75924 522.77      24.7476  515.102     22.5288  87.4914    85.9449     50.3133     265.945     
1 1 1 16 6  34 o 18 290.797 3.44008 1454.38     52.4183  1546.1      47.5428  141.951    20.3049     118.528     200.305     
1 1 1 16 6  35 o 10 186.215 2.87579 633.72      26.0131  596.301     27.5719  93.628     143.265     63.4187     323.265     
1 1 1 16 6  36 o 10 133.911 2.46343 308.159     16.3455  328.259     16.6864  9.68865    303.564     159.424     123.564     
1 1 1 16 6  37 o 10 300.501 3.53001 1639.27     50.3     1565.23     55.7326  229.104    60.8011     44.2204     60.8011     
1 1 1 16 6  38 o 14 320.018 3.30419 1819.49     52.9264  1813.92     53.0547  259.955    33.6592     79.6896     33.6592     
1 1 1 16 6  39 o 18 227.576 2.67127 916.939     29.1684  919.818     31.7128  169.94     16.9519     32.034      16.9519     
1 1 1 16 6  40 o 19 369.144 3.58289 2388.89     64.8883  2447.47     67.6713  254.87     6.9374      0.861532    6.93747     
1 1 1 16 6  41 o 8  144.767 2.42359 368.904     17.4597  374.306     17.7064  112.034    100.502     43.7721     100.502     
1 1 1 16 6  42 o 4  256.167 3.17565 1143.4      39.738   1185.21     41.7986  154.177    295.555     39.9173     115.555     
1 1 1 16 6  43 o 14 302.759 3.29614 1616.83     48.8367  1636.13     51.1699  176.318    189.577     60.5982     9.57736     
1 1 1 16 6  44 o 9  220.267 2.80163 867.257     30.1344  853.933     31.6844  156.763    200.725     19.1204     200.725     
1 1 1 16 6  45 o 15 212.748 2.77911 805.425     28.8375  800.272     30.3966  178.858    2.76098     77.7813     2.76098     
1 1 1 16 6  46 o 18 577.057 5.42302 5845.3      149.525  6007.31     163.967  455.515    239.792     122.368     239.792     
1 1 1 16 6  47 o 10 83.0491 2.88292 130.574     10.609   114.988     12.9959  2.37553    272.499     106.409     272.499     
1 1 1 16 6  48 o 8  191.673 2.92639 651.724     25.7522  651.994     30.2838  131.537    31.4278     10.7246     31.4278     
1 1 1 16 6  49 f 0  52.3666 3.30097 50.7099     8.14644  47.4514     8.93854  85.9214    183.812     0           0           
1 1 1 16 6  50 o 13 135.64  2.55951 311.521     17.7278  341.88      16.977   97.6907    90.3797     24.667      90.3797     
1 1 1 16 6  51 o 3  79.9251 2.57758 108.192     10.3223  119.103     10.2494  16.1444    237.323     65.0782     57.3232     
1 1 1 16 6  52 o 6  111.862 2.42114 220.051     13.5671  224.409     13.5448  93.0829    212.373     56.7933     212.373     
1 1 1 16 6  53 f 0  176.937 2.376   551.527     20.67    559.528     21.4636  120.688    119.768     0           0           
1 1 1 16 6  54 o 6  320.831 3.17281 1844.2      49.0011  1814.43     52.9142  242.972    355.026     58.4041     355.026     
1 1 1 16 6  55 o 13 141.204 2.71188 376.477     18.7544  332.764     19.4938  104.561    2.49125     27.8775     2.49125     
1 1 1 16 6  56 o 9  190.799 2.58446 657.121     24.6019  636.187     24.8132  114.319    321.23      21.995      141.23      
1 1 1 16 6  57 o 6  73.4039 2.77523 96.6241     10.2367  95.4671     10.107   47.7334    268.123     16.7016     268.123     
1 1 1 16 6  58 o 18 68.5141 2.85776 81.7986     9.87335  85.7819     9.65257  43.4232    303.773     18.908      303.773     
1 1 1 16 6  59 o 13 31.208  4.62154 17.1066     7.11109  19.0833     6.87951  0.56623    97.5333     8.37028     97.5334     
1 1 1 16 6  60 o 18 247.006 3.18691 1063.85     41.2389  1111.58     37.4685  146.446    275.757     30.1873     95.7567     
1 1 1 16 6  61 o 19 86.9154 2.64499 139.752     11.8068  129.767     11.1836  26.9759    51.1998     54.9269     231.2       
1 1 1 16 6  62 o 8  43.9991 4.06042 37.9848     8.976    32.6587     8.49203  14.4748    340.119     9.27208     160.119     
1 1 1 16 6  63 o 15 24.1144 5.12184 3.56568     8.06506  15.5505     6.69761  3.78864    61.8354     19.6365     61.8354     
1 1 1 16 6  64 o 11 65.9075 3.14912 80.2769     10.8121  75.7001     9.86721  36.7192    144.755     7.32018     324.755     
1 1 1 16 6  65 o 6  142.86  2.61572 383.499     19.6437  345.508     17.7907  106.296    271.324     29.9517     271.324     
1 1 1 16 6  66 o 18 117.521 2.62363 267.767     16.222   226.64      14.6534  84.9901    312.533     21.0502     312.533     
1 1 1 16 6  67 o 2  48.2754 4.19272 45.4668     10.0749  40.1146     9.76859  31.4463    164.043     9.1212      164.043     
1 1 1 16 6  68 o 6  69.4958 3.33114 95.7965     11.914   79.0151     11.1308  46.9297    248.94      9.12449     248.94      
1 1 1 16 6  69 o 2  22.0766 5.68688 9.43339     8.48084  5.7317      7.92303  3.21534    72.6258     26.3765     72.6257     
1 1 1 16 6  70 o 4  62.9827 3.52288 74.0376     11.7868  70.0221     10.2492  30.8441    119.257     15.2441     299.257     
1 1 1 16 6  71 o 12 98.4069 3.05103 170.208     14.4274  178.654     15.5907  70.3681    283.913     18.7178     283.913     
1 1 1 16 6  72 o 7  107.972 3.00366 200.189     15.6208  220.003     16.8282  67.6506    240.811     0.981486    240.811     
1 1 1 16 6  73 o 2  51.7379 4.33739 54.1144     9.72903  45.2964     11.8472  36.7955    333.87      13.8006     333.87      
1 1 1 16 6  74 o 10 96.2103 3.14672 159.122     14.1828  176.274     16.0855  64.8196    280.447     11.0519     280.447     
1 1 1 16 6  75 o 17 53.1229 4.06798 50          9.89996  54.7819     11.4086  27.4373    202.176     8.70819     22.1758     
1 1 1 16 6  76 o 19 30.0207 5.48805 16.7938     8.39686  18.7487     8.25529  13.6035    161.369     7.15582     161.369     
1 1 1 16 6  77 o 8  72.3995 3.35152 96.0525     11.8867  96.0468     12.2956  43.35      195.191     0.828669    15.191      
1 1 1 16 6  78 o 14 33.2308 5.72176 19.6145     8.85911  24.9093     10.0496  19.6681    16.5838     7.94141     16.5838     
1 1 1 16 6  79 o 17 50.8006 5.05389 42.0396     10.5669  58.7271     14.5349  21.6632    308.93      16.3506     128.93      
1 1 1 16 6  80 o 19 33.7748 6.50116 28.1062     10.2902  18.6841     13.0677  9.68249    212.652     17.6219     32.6521     
1 1 1 16 6  81 o 12 33.6311 6.81882 31.5763     12.2033  15.5173     13.2263  11.9937    117.987     11.6439     297.987     
1 1 1 16 6  82 o 1  59.7847 4.81643 58.0196     12.5     80.5646     15.9149  33.9961    188.481     1.67084     8.48122     
1 1 1 16 6  83 o 9  26.8546 6.72367 16.1891     10.0223  10.5093     13.3462  4.09339    221.207     20.3292     41.2073     
1 1 1 16 6  84 o 12 48.5212 6.51485 55.6794     14.5794  42.6189     15.7591  29.2268    59.9048     3.80453     59.9049     
1 1 1 16 6  85 o 1  27.1476 7.15439 -5.26952    16.9445  24.3369     13.7198  9.00978    223.812     8.70078     43.8119     
1 1 1 16 6  86 o 1  44.5705 7.44112 25.5944     19.2732  66.0949     16.306   31.1868    192.345     18.6735     192.345     
1 1 1 16 6  87 o 16 44.2762 7.98402 57.4831     19.3348  37.7433     16.4726  26.5475    247.468     7.45932     247.468     
1 1 1 16 6  88 o 7  40.2408 8.20799 49.7109     19.1273  32.2825     16.056   20.3402    130.287     0.818524    130.287     
1 1 1 16 6  89 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 7  0  o 2  53.9211 2.64545 52.2599     7.06815  52.2599     7.06815  3.0465     0.000556802 7.27595     0.000556802 
1 1 1 16 7  1  f 0  840.83  6.91973 12480       286.141  12606.6     296.968  499.233    198.352     0           0           
1 1 1 16 7  2  o 8  161.961 2.34497 458.785     19.0053  470.938     19.0591  17.9416    157.216     167.882     337.216     
1 1 1 16 7  3  o 18 713.175 5.95187 9138.56     208.684  8903.53     216.555  550.409    176.614     73.2476     176.614     
1 1 1 16 7  4  o 10 294.241 2.95285 1528.64     42.7202  1540.11     44.3536  205.78     31.4632     11.7659     31.4631     
1 1 1 16 7  5  o 2  476.852 4.23103 4066.47     99.1975  3995.57     102.947  357.689    165.962     37.7573     165.962     
1 1 1 16 7  6  o 15 250.899 2.76737 1119.04     34.1315  1112.18     35.4436  195.589    247.593     71.3443     247.593     
1 1 1 16 7  7  o 14 535.45  4.82269 5134.79     131.993  5032.26     126.818  414.484    312.243     64.4748     312.243     
1 1 1 16 7  8  o 2  366.721 3.63693 2383.97     62.6915  2383.55     70.743   211.856    251.198     93.1312     71.1983     
1 1 1 16 7  9  o 3  640.212 5.49316 7260.56     176.227  7277.34     176.254  456.299    137.481     7.77688     317.481     
1 1 1 16 7  10 o 11 319.602 3.21312 1812.48     51.453   1808.36     51.4733  128.405    354.336     192.789     174.336     
1 1 1 16 7  11 o 18 792.65  6.65737 11135.7     264.426  11161.3     264.475  685.701    64.7262     230.128     64.7262     
1 1 1 16 7  12 o 1  70.7383 2.44172 85.2794     8.4278   92.5732     8.83256  119.738    166.479     315.817     166.479     
1 1 1 16 7  13 o 12 137.873 2.45767 343.555     16.9152  330.481     17.025   55.774     247.493     1.42052     67.4932     
1 1 1 16 7  14 o 3  249.326 2.78435 1108.93     34.7726  1094.55     34.8056  134.481    89.2625     72.8982     269.263     
1 1 1 16 7  15 o 2  383.314 3.81742 2613.6      70.1871  2595.95     76.3237  265        277.671     11.3286     97.6707     
1 1 1 16 7  16 o 6  669.853 5.71892 7933.69     184.461  7987.58     199.259  436.175    146.074     89.9801     326.074     
1 1 1 16 7  17 o 5  380.605 3.47463 2556.55     65.019   2579.35     67.5154  273.352    27.4921     10.0308     27.4921     
1 1 1 16 7  18 o 2  385.851 3.63337 2648.53     70.232   2630.34     70.2813  265.884    228.257     13.2009     48.2574     
1 1 1 16 7  19 o 8  635.955 5.3575  7191.91     167.522  7158.95     173.894  382.948    184.553     145.487     4.55315     
1 1 1 16 7  20 f 0  283.19  2.87581 1430.83     40.009   1412.19     41.5899  172.285    276.139     0           0           
1 1 1 16 7  21 o 3  50.2466 2.74921 46.93       6.68904  43.1472     7.01907  16.2916    50.4961     45.0152     50.4961     
1 1 1 16 7  22 o 11 105.249 2.40658 209.685     12.3562  183.817     12.9122  25.0689    321.069     2.85096     141.069     
1 1 1 16 7  23 o 6  292.939 2.98594 1513.89     42.9857  1528.57     44.6748  222.701    350.279     39.5214     350.279     
1 1 1 16 7  24 o 1  109.208 2.24831 206.155     12.2625  217.027     12.3159  36.7245    333.558     47.6697     153.558     
1 1 1 16 7  25 o 12 228.402 2.67521 909.043     30.5813  940.565     30.6552  121.656    116.76      70.327      296.76      
1 1 1 16 7  26 o 11 441.544 3.99954 3449.32     88.4786  3466.93     88.5215  282.3      356.378     59.56       176.378     
1 1 1 16 7  27 o 4  191.647 2.64458 636.928     25.928   665.398     24.825   78.9822    132.676     101.597     312.676     
1 1 1 16 7  28 o 9  162.598 2.58092 467.843     20.5799  469.502     21.4733  123.273    190.322     74.0657     190.322     
1 1 1 16 7  29 o 5  370.13  3.79267 2430.38     70.3369  2429.84     70.3614  318.436    194.092     122.442     194.092     
1 1 1 16 7  30 o 19 193.743 2.79573 685.344     26.4534  645.957     27.763   87.1847    348.056     86.8415     168.056     
1 1 1 16 7  31 o 17 214.511 2.88933 837.327     30.2505  794.721     31.7947  172.353    247.976     60.8697     247.976     
1 1 1 16 7  32 o 5  359.505 3.76418 2305.48     64.6272  2280.31     70.8275  215.544    215.288     71.1356     35.288      
1 1 1 16 7  33 o 17 179.632 2.63632 592.7       22.5912  551.849     24.7265  126.072    284.715     15.0116     284.715     
1 1 1 16 7  34 o 14 368.143 3.57923 2380.01     64.6626  2428.78     67.3992  268.248    143.004     23.4531     143.004     
1 1 1 16 7  35 o 1  56.6698 3.07166 68.1924     7.84469  47.356      8.96966  0.099089   225.042     38.8783     225.043     
1 1 1 16 7  36 o 16 106.001 2.52283 212.044     13.212   187.236     13.4942  23.5108    170.419     89.707      350.419     
1 1 1 16 7  37 o 18 151.643 2.68622 420.327     21.3863  395.666     19.4212  39.7171    161.96      125.096     341.96      
1 1 1 16 7  38 o 13 299.638 3.34902 1623.38     50.212   1562.64     50.3498  210.778    191.116     8.64248     191.116     
1 1 1 16 7  39 o 13 377.025 3.86676 2551.73     72.9977  2494.9      73.1133  304.942    207.519     89.3176     207.519     
1 1 1 16 7  40 o 13 72.9299 2.8281  98.5303     9.79728  90.7843     10.7211  15.2528    145.539     3.44958     325.539     
1 1 1 16 7  41 o 17 299.68  3.48316 1651.26     50.8923  1537.33     53.5499  195.375    249.965     19.9523     69.9653     
1 1 1 16 7  42 o 5  225.316 3.31531 880.198     36.0833  921.753     38.7849  141.833    90.9156     20.9219     270.916     
1 1 1 16 7  43 o 6  229.28  3.08202 936.75      35.3595  928.633     35.4652  137.417    339.761     35.084      159.761     
1 1 1 16 7  44 o 18 335.763 3.65939 1982.95     60.0686  2019.98     63.0678  301.106    127.068     146.719     127.068     
1 1 1 16 7  45 o 11 442.575 4.47923 3428.01     96.9485  3534.6      101.741  324.872    116.809     44.2476     116.809     
1 1 1 16 7  46 o 16 148.259 2.64643 392.402     19.2153  387.653     20.0769  75.7462    338.221     42.1462     158.221     
1 1 1 16 7  47 o 10 146.807 2.62809 392.419     18.3452  372.606     20.2012  61.2393    270.682     70.1449     90.682      
1 1 1 16 7  48 o 17 130.118 2.46477 303.117     15.9904  297.952     16.1227  26.6768    102.84      117.164     282.84      
1 1 1 16 7  49 o 17 250.078 2.72149 1090.57     33.3028  1129.03     34.912   152.157    306.857     31.6314     126.857     
1 1 1 16 7  50 o 9  175.039 2.32323 533.634     20.1816  553.48      20.5771  125.9      123.764     21.7164     123.764     
1 1 1 16 7  51 o 15 87.5676 2.51633 133.272     10.6687  139.356     11.3708  60.8998    288.68      26.3162     288.68      
1 1 1 16 7  52 o 19 171.857 2.52604 501.754     20.4082  547.15      23.105   149.566    331.345     75.6985     331.345     
1 1 1 16 7  53 o 17 26.3223 4.9769  10.9087     6.3268   14.7675     7.10271  18.8931    132.482     53.3154     132.482     
1 1 1 16 7  54 o 1  106.693 2.56349 205.162     12.5904  199.604     14.6706  50.7085    122.91      35.0185     302.91      
1 1 1 16 7  55 o 5  55.4022 3.31149 55.1798     8.45898  54.8071     9.70393  3.66548    322.654     1.20224     322.654     
1 1 1 16 7  56 f 0  100.577 2.64305 164.576     11.8419  196.129     14.7734  16.052     41.1764     0           0           
1 1 1 16 7  57 o 5  81.829  2.53088 112.103     9.63839  126.572     11.0772  44.6347    37.681      10.8046     217.681     
1 1 1 16 7  58 o 13 26.3834 4.98235 5.36819     6.90575  20.2349     7.58694  9.95617    242.412     35.2784     242.412     
1 1 1 16 7  59 o 9  187.414 2.62695 637.84      24.4975  612.138     24.8318  142.249    21.5234     40.7418     21.5234     
1 1 1 16 7  60 f 0  190.947 2.80658 662.459     26.0436  636.479     27.6066  99.746     72.8825     0           0           
1 1 1 16 7  61 f 0  194.198 2.57476 686.06      26.7037  656.896     23.3627  117.404    200.31      0           0           
1 1 1 16 7  62 o 19 114.651 2.36617 249.276     13.5871  219.452     13.5353  91.8622    307.905     39.2245     307.905     
1 1 1 16 7  63 o 10 37.7111 4.41104 27.291      8.63302  25.2593     7.44991  5.79341    143.611     31.1652     323.611     
1 1 1 16 7  64 o 7  147.148 2.61716 402.414     19.4797  370.548     19.0915  106.502    231.013     23.7582     231.013     
1 1 1 16 7  65 o 1  95.2119 2.72863 169.71      13.3231  154.804     12.6633  55.3585    30.153      10.0223     210.153     
1 1 1 16 7  66 o 2  30.0924 5.20655 16.2538     8.43143  18.0543     7.18284  0.517413   195.217     31.8366     15.2173     
1 1 1 16 7  67 o 6  146.487 2.57029 403.672     19.165   364.097     18.5452  118.901    2.6145      51.5912     2.6145      
1 1 1 16 7  68 o 13 99.1335 2.76435 189.884     14.3545  163.16      13.0664  66.6667    12.7929     8.80408     12.7929     
1 1 1 16 7  69 o 17 65.7169 3.18471 81.9717     11.1096  74.1894     9.74335  45.3444    314.393     10.9841     314.393     
1 1 1 16 7  70 o 8  14.2749 4.50783 -5.16375    7.98117  -0.412434   5.36024  12.1397    158.943     35.0845     158.943     
1 1 1 16 7  71 o 6  44.0813 4.66896 43.7981     10.0382  29.5967     9.70699  21.6329    91.8387     7.89467     271.839     
1 1 1 16 7  72 o 3  37.2496 4.60054 26.2375     9.6202   26.0346     6.71393  23.3955    172.441     10.7794     172.441     
1 1 1 16 7  73 o 10 50.6319 4.55649 49.7549     10.7408  46.1244     11.7566  24.13      303.763     12.5178     123.763     
1 1 1 16 7  74 o 9  140.364 2.93477 363.312     20.0646  348.659     21.1325  103.339    77.4432     32.1285     77.4432     
1 1 1 16 7  75 o 7  83.1622 3.27386 121.008     13.3831  131.283     13.7937  60.9852    5.80712     20.393      5.80712     
1 1 1 16 7  76 o 6  29.9116 5.92352 16.668      8.74422  19.164      9.72288  14.0509    266.605     2.83338     86.6051     
1 1 1 16 7  77 o 14 49.6882 4.38357 49.1965     10.2642  44.3601     10.9904  26.4048    300.061     5.81266     120.061     
1 1 1 16 7  78 o 18 63.3572 3.73493 87.2888     11.7597  62.8257     11.5007  36.841     88.9577     2.02332     268.958     
1 1 1 16 7  79 o 9  52.2456 5.10627 61.7336     11.7607  44.8337     13.4707  31.0529    63.8973     1.53951     63.8972     
1 1 1 16 7  80 o 9  61.872  4.44655 74.7675     12.5136  70.8665     14.488   34.5375    10.9995     3.67919     191         
1 1 1 16 7  81 o 1  18.784  5.70133 4.864       8.98713  -5.20118    11.143   0.601165   25.3341     12.4588     205.334     
1 1 1 16 7  82 o 10 23.2698 6.30913 11.133      9.50578  5.34687     11.6269  2.0062     225.541     19.6092     45.5415     
1 1 1 16 7  83 o 9  36.8075 6.99537 24.4941     13.4519  33.8453     13.1914  18.905     151.752     2.08313     331.752     
1 1 1 16 7  84 o 17 24.1578 7.01776 3.70861     15.7132  10.933      12.2393  7.88938    247.724     4.85883     67.7241     
1 1 1 16 7  85 o 12 66.5336 6.16946 106.705     21.6302  78.6102     18.5092  36.254     81.9521     4.60843     261.952     
1 1 1 16 7  86 o 16 29.6911 7.9723  25.5206     18.105   15.1087     14.6239  8.78063    9.30762     11.3125     189.308     
1 1 1 16 7  87 o 12 24.2294 7.32206 8.07578     17.4853  8.67292     14.1324  3.73277    339.107     2.86262     159.107     
1 1 1 16 7  88 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 8  0  o 15 189.12  2.60072 634.5       24.6275  634.5       24.6275  139.576    180         80.371      180         
1 1 1 16 8  1  o 13 90.4855 2.44798 142.614     10.8095  148.031     11.3513  12.0748    238.364     88.9009     238.364     
1 1 1 16 8  2  o 2  127.537 2.46857 288.3       15.7734  288.641     15.7521  36.8979    25.9785     49.0424     205.979     
1 1 1 16 8  3  o 10 298.53  3.20602 1567.43     47.9603  1591.79     47.9653  127.277    24.6599     165.458     204.66      
1 1 1 16 8  4  o 7  298.661 3.19083 1594.1      47.7546  1567.91     47.758   204.505    222.293     5.10994     42.2927     
1 1 1 16 8  5  o 18 408.196 3.88019 2953.9      77.7676  2953.72     80.9498  248.24     37.1649     85.5963     217.165     
1 1 1 16 8  6  o 16 302.676 3.1592  1638.5      46.9326  1609.11     48.8671  189.992    135.415     42.6458     315.415     
1 1 1 16 8  7  o 18 330.724 3.40619 1925.29     56.4475  1952.33     56.4588  263.19     190.969     65.8513     190.969     
1 1 1 16 8  8  o 1  348.86  3.60505 2163.27     61.6364  2151.51     64.3791  255.377    327.787     19.9528     327.787     
1 1 1 16 8  9  o 14 421.328 3.99097 3138.27     79.0637  3156.07     89.1936  365.788    221.88      135.25      221.88      
1 1 1 16 8  10 o 8  455.203 4.13271 3648.01     90.5988  3699.69     97.8606  302.371    183.188     46.6193     3.18847     
1 1 1 16 8  11 o 3  314.693 3.19064 1752.1      48.3519  1758.63     52.2171  250.438    353.15      63.5151     353.15      
1 1 1 16 8  12 o 4  305.182 3.20056 1639.29     45.9494  1662.53     51.8126  275.821    91.3169     134.529     91.3169     
1 1 1 16 8  13 o 11 152.168 2.51632 405.506     18.7838  415.272     19.593   54.488     136.558     30.2387     136.558     
1 1 1 16 8  14 o 10 445.892 4.14697 3465.25     86.9991  3586.03     98.1663  337.442    288.782     39.4569     288.782     
1 1 1 16 8  15 o 8  285.509 3.11021 1449.89     44.5015  1440        44.5001  175.961    184.757     46.9026     4.75656     
1 1 1 16 8  16 o 2  706.692 6.15151 8884.34     204.33   8845.16     230.532  487.644    333.118     42.365      153.118     
1 1 1 16 8  17 o 4  289.747 3.09975 1487        44.1077  1489.41     45.8953  172.997    74.8141     59.9325     254.814     
1 1 1 16 8  18 o 9  280.299 2.97736 1386.65     40.1823  1398.79     43.4143  183.27     288.309     24.2641     108.309     
1 1 1 16 8  19 o 14 407.54  3.8967  2917.6      74.694   2972.98     84.2701  268.244    293.483     43.0329     113.483     
1 1 1 16 8  20 o 16 131.913 2.27898 307.951     14.4652  309.054     15.632   45.1884    258.88      76.039      78.8802     
1 1 1 16 8  21 o 15 272.427 2.93709 1299.79     39.2886  1331.63     40.907   202.697    258.171     27.7588     258.171     
1 1 1 16 8  22 o 15 218.274 2.67152 818.592     28.6259  870.89      29.8234  180.253    59.5162     70.555      59.5162     
1 1 1 16 8  23 f 0  191.982 2.51367 652.656     23.6971  653.979     24.6626  187.457    308.137     0           0           
1 1 1 16 8  24 o 3  264.923 3.02407 1244.29     39.2502  1244.38     41.0274  226.929    341.048     92.6058     341.048     
1 1 1 16 8  25 o 13 513.48  4.83335 4635.47     121.641  4724.22     127.092  359.31     161.836     10.9211     341.836     
1 1 1 16 8  26 o 9  53.4689 2.82135 52.1927     7.33074  49.7579     7.66387  28.6769    6.409       90.6317     6.409       
1 1 1 16 8  27 o 15 429.774 4.19288 3280.27     88.3019  3274.43     92.2616  386.343    5.89161     169.514     5.89161     
1 1 1 16 8  28 o 10 447.71  4.2928  3541.1      94.1934  3573.08     98.4096  357.303    171.955     84.2242     171.955     
1 1 1 16 8  29 o 12 382.559 3.85265 2600.26     72.198   2592.66     75.4834  286.781    344.553     37.1477     344.553     
1 1 1 16 8  30 o 9  374.313 3.82503 2480.03     73.2506  2491.57     70.2124  318.261    268.493     113.785     268.493     
1 1 1 16 8  31 o 2  39.848  3.50432 26.9488     7.04472  30.303      6.58311  47.2757    277.953     123.262     277.953     
1 1 1 16 8  32 o 5  324.286 3.48925 1839.33     57.8532  1891.82     55.4902  176.257    35.3919     101.494     215.392     
1 1 1 16 8  33 o 1  205.108 2.65749 742.823     27.2678  749.048     27.3639  147.617    34.6585     15.9055     34.6586     
1 1 1 16 8  34 o 17 172.23  2.69585 534.214     23.1861  517.83      23.3437  89.8069    190.826     54.3332     10.8256     
1 1 1 16 8  35 o 4  135.294 2.61697 339.418     16.7055  310.329     18.5948  98.2639    22.9025     25.0528     22.9025     
1 1 1 16 8  36 f 0  97.5737 2.65303 172.575     12.2447  165.61      13.5847  75.7328    343.224     0           0           
1 1 1 16 8  37 o 4  436.457 4.36376 3410.44     90.9351  3355.77     99.681   357.132    252.758     106.55      252.758     
1 1 1 16 8  38 o 2  133.37  2.51791 327.557     16.2883  303.747     17.28    89.7573    312.001     10.4422     312.001     
1 1 1 16 8  39 o 10 36.1046 3.79033 22.7047     6.34484  24.5969     6.95797  1.84181    298.811     5.36674     298.811     
1 1 1 16 8  40 o 3  353.587 3.73758 2225.7      66.193   2213.12     66.264   280.651    328.106     74.1959     328.106     
1 1 1 16 8  41 f 0  394.365 4.09103 2787.27     82.7272  2737.06     78.9623  246.55     47.385      0           0           
1 1 1 16 8  42 o 15 112.673 2.73951 216.561     14.7688  234.515     16.1285  73.1533    177.696     13.5093     177.696     
1 1 1 16 8  43 o 19 53.4116 3.23538 51.928      7.96841  50.0722     9.11571  0.84424    328.915     9.26003     148.915     
1 1 1 16 8  44 o 2  238.762 2.89689 1009.45     33.8398  1013.32     35.4687  126.135    209.987     71.8002     29.9866     
1 1 1 16 8  45 f 0  168.284 2.57147 506.105     21.5108  498.541     21.8569  115.002    2.58082     0           0           
1 1 1 16 8  46 o 2  130.813 2.48608 309.998     16.0884  297.546     16.4624  79.5327    336.22      7.93697     156.22      
1 1 1 16 8  47 o 6  92.2924 2.75649 143.854     12.8138  159.153     12.5893  46.392     217.172     16.2869     37.1724     
1 1 1 16 8  48 o 9  201.493 2.97163 700.391     28.1194  741.255     31.8643  113.494    302.688     43.0263     122.688     
1 1 1 16 8  49 o 2  151.351 2.78479 404.026     19.6538  409.477     22.489   62.7842    53.8427     75.2672     233.843     
1 1 1 16 8  50 o 11 194.596 2.74776 663.575     24.6151  680.917     28.8594  123.944    145.619     12.0307     325.619     
1 1 1 16 8  51 o 5  109.533 2.64261 206.182     13.2973  220.408     15.6418  64.64      100.025     10.5938     280.025     
1 1 1 16 8  52 o 3  104.339 2.65449 185.819     12.3794  201.476     15.2815  69.9891    217.104     9.22395     217.104     
1 1 1 16 8  53 o 8  25.7591 5.35382 7.06807     6.31195  17.5464     8.79482  62.881     58.3732     152.902     58.3732     
1 1 1 16 8  54 o 15 146.372 2.61681 362.271     17.0771  399.693     21.2346  113.495    142.445     37.2707     142.445     
1 1 1 16 8  55 o 3  152.555 2.44153 411.57      18.2242  415.264     19.1008  119.311    148.258     40.4429     148.258     
1 1 1 16 8  56 o 17 95.3853 2.70953 158.077     11.5293  166.051     14.237   42.8292    193.795     35.8258     13.7955     
1 1 1 16 8  57 o 5  42.9483 3.7623  29.3865     7.44568  37.728      8.39507  9.81971    260.779     18.1488     80.7793     
1 1 1 16 8  58 o 15 89.1483 2.58434 146.435     11.2651  136.893     11.7453  66.8564    220.334     26.5979     220.334     
1 1 1 16 8  59 o 3  38.6805 4.12149 22.7922     7.63762  32.4018     7.65901  3.00108    140.586     29.1367     320.586     
1 1 1 16 8  60 f 0  62.4942 2.98369 75.3574     9.43812  64.7603     9.12051  13.5505    230.276     0           0           
1 1 1 16 8  61 o 10 155.861 2.37023 434.654     18.8039  430.053     18.221   102.802    317.811     3.43125     317.811     
1 1 1 16 8  62 o 6  113.618 2.35065 235.871     14.5053  224.259     12.1838  73.9765    84.4144     1.913       84.4144     
1 1 1 16 8  63 o 7  139.836 2.26775 363.163     16.4164  333.566     15.3731  111.854    205.365     43.6157     205.365     
1 1 1 16 8  64 o 14 88.4376 2.72643 142.052     12.5714  137.876     11.5277  44.8772    56.2596     22.821      236.26      
1 1 1 16 8  65 o 10 111.029 2.58976 234.481     14.9191  206.775     13.8651  81.4343    133.636     21.564      133.636     
1 1 1 16 8  66 o 16 41.3694 4.19252 29.0675     8.90579  34.2356     7.77012  17.674     277.508     12.3633     97.5079     
1 1 1 16 8  67 f 0  22.7167 5.24018 3.25139     8.35408  12.9601     6.5695   10.5317    233.02      0           0           
1 1 1 16 8  68 o 10 44.5502 3.93723 39.4855     9.31195  33.6368     7.89931  22.2533    102.443     7.55849     282.443     
1 1 1 16 8  69 o 5  37.5563 4.74076 25.2665     9.37079  27.86       7.68591  10.3861    187.036     22.7673     7.03635     
1 1 1 16 8  70 o 7  72.0396 3.0852  98.525      11.8401  89.0749     10.3343  30.711     192.49      28.1482     12.4901     
1 1 1 16 8  71 o 9  57.0244 3.52699 70.0452     10.9027  49.471      9.05692  19.3591    82.5425     31.3112     262.542     
1 1 1 16 8  72 o 8  45.0791 4.24216 36.0892     10.218   39.613      8.1731   27.3654    208.935     2.06778     208.935     
1 1 1 16 8  73 o 4  79.6834 3.1696  120.402     13.5293  110.308     11.6746  37.1456    169.662     24.5354     349.662     
1 1 1 16 8  74 o 12 61.6541 3.22092 87.9317     11.237   53.0517     8.54429  39.7505    258.075     4.73504     258.075     
1 1 1 16 8  75 o 8  31.5757 6.03715 13.4468     10.218   26.5112     10.0542  16.1316    166.721     1.1284      346.721     
1 1 1 16 8  76 f 0  15.6609 4.95013 0.491418    7.49426  -6.9909     8.86109  17.317     292.531     0           0           
1 1 1 16 8  77 o 19 42.8956 4.96987 34.8488     9.78263  36.6596     10.8369  30.0965    79.6316     12.8197     79.6316     
1 1 1 16 8  78 o 7  18.8326 5.62358 -1.65799    8.53137  5.62043     9.87993  1.36777    244.036     9.40898     64.0363     
1 1 1 16 8  79 o 8  26.4672 6.55538 12.5591     9.84739  14.7263     11.6194  7.96711    30.0175     0.467174    30.0175     
1 1 1 16 8  80 o 16 59.9017 5.00355 75.5249     14.6329  63.8367     14.7021  35.3964    132.572     0.468122    132.572     
1 1 1 16 8  81 o 6  52.0917 5.52471 55.6723     13.7941  51.8102     14.1251  31.3436    283.749     2.4118      283.749     
1 1 1 16 8  82 o 18 34.9875 7.4332  23.4016     15.7643  29.5525     12.9531  18.1817    35.5359     0.923183    215.536     
1 1 1 16 8  83 o 1  35.5207 7.94237 22.0757     17.5959  34.5155     15.2294  13.4826    248.505     12.0128     68.5046     
1 1 1 16 8  84 o 4  21.5122 6.76226 -5.9142     15.9748  4.93013     13.9384  4.73466    73.967      5.3949      253.967     
1 1 1 16 8  85 o 16 21.8502 6.81669 0.676527    12.8887  5.12824     16.1337  3.77779    259.296     5.38335     79.2961     
1 1 1 16 8  86 o 14 25.03   7.37325 11.1835     13.5805  10.0401     17.2856  5.25706    119.993     9.27592     299.993     
1 1 1 16 8  87 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 9  0  o 1  57.2123 2.70158 58.7763     7.66536  58.7763     7.66536  13.0694    180         38.0224     180         
1 1 1 16 9  1  o 15 460.743 4.34129 3785.31     100.24   3743.13     100.237  409.262    242.41      160.416     242.41      
1 1 1 16 9  2  o 18 29.3886 4.27577 20.8124     5.89004  11.3061     6.28928  57.6212    334.788     123.429     334.788     
1 1 1 16 9  3  o 6  311.365 3.31872 1725.34     52.8988  1711.73     50.6547  253.68     58.8332     73.2008     58.8332     
1 1 1 16 9  4  o 11 455.774 4.29924 3709.2      98.1954  3657.77     98.1967  445.323    19.0041     243.271     19.0041     
1 1 1 16 9  5  o 5  266.874 3.00466 1254.97     40.1842  1269.84     40.1844  206.959    268.969     47.3789     268.969     
1 1 1 16 9  6  o 5  336.72  3.46144 2023.28     58.4057  1996.61     58.412   287.971    161.076     104.14      161.076     
1 1 1 16 9  7  o 11 393.332 3.92679 2775.37     79.0958  2710.87     75.7048  214.526    230.095     134.64      50.0948     
1 1 1 16 9  8  o 19 284.56  3.18015 1449.06     44.3533  1421.73     46.3051  224.666    91.0954     55.086      91.0954     
1 1 1 16 9  9  o 2  303.914 3.33465 1654.29     50.7874  1620.48     50.7845  248.219    294.218     73.1071     294.218     
1 1 1 16 9  10 o 14 442.24  4.21299 3455.49     89.4073  3480.79     97.1977  347.524    330.915     62.5297     330.915     
1 1 1 16 9  11 o 16 147.694 2.3793  385.929     17.2272  387.271     17.9869  59.1992    117.35      69.794      297.35      
1 1 1 16 9  12 o 12 173.016 2.51417 528.45      21.7794  532.653     21.8189  74.2171    203.405     82.4167     23.4046     
1 1 1 16 9  13 o 1  270.576 3.15347 1284.27     42.7514  1311.46     42.7656  189.514    103.051     2.20064     103.051     
1 1 1 16 9  14 o 8  437.484 4.07833 3395.11     87.6019  3393.1      91.1886  254.37     105.082     118.867     285.082     
1 1 1 16 9  15 o 11 119.232 2.50128 265.055     14.161   239.652     15.5636  46.1959    171.043     44.8445     351.043     
1 1 1 16 9  16 o 11 295.751 3.25629 1554.19     49.2901  1547.25     47.2169  214.749    202.69      14.3855     202.69      
1 1 1 16 9  17 o 19 394.907 3.80921 2770.44     70.7162  2760.69     79.7667  321.421    83.8395     81.6214     83.8395     
1 1 1 16 9  18 o 6  261.582 2.87805 1216.14     36.2443  1209.85     39.1484  122.819    148.01      122.409     328.01      
1 1 1 16 9  19 o 4  265.162 3.06638 1254.18     39.8543  1238.92     41.6092  184.382    141.167     0.661864    321.165     
1 1 1 16 9  20 o 17 371.025 3.89994 2420.55     70.7734  2462.75     74.2388  270.578    104.518     15.2024     104.518     
1 1 1 16 9  21 o 6  149.19  2.43997 379.279     17.8441  410.082     18.6425  60.1489    227.077     75.5391     47.077      
1 1 1 16 9  22 o 12 332.941 3.59193 1944.8      57.1647  1987.2      62.6273  195.123    77.1436     80.4708     257.144     
1 1 1 16 9  23 o 18 336.694 3.6076  2014.99     58.0316  2006.25     63.5724  276.607    25.7579     81.3731     25.7579     
1 1 1 16 9  24 o 3  253.325 3.12445 1132.36     38.7082  1143.53     40.6084  168.366    41.8008     13.775      221.801     
1 1 1 16 9  25 f 0  57.9346 2.90767 65.1491     7.92903  54.7058     8.70108  44.8053    59.6304     0           0           
1 1 1 16 9  26 o 10 327.805 3.40296 1873.29     53.5494  1938.67     58.2259  250.709    137.254     42.6804     137.254     
1 1 1 16 9  27 f 0  203.009 2.62632 726.062     25.6036  735.275     27.8025  51.3095    132.135     0           0           
1 1 1 16 9  28 o 2  169.226 2.48289 509.298     20.1612  506.087     21.9097  144.092    8.99089     79.0942     8.99089     
1 1 1 16 9  29 o 19 207.926 2.71574 769.973     27.1021  763.141     29.4351  159.92     148.832     38.1094     148.832     
1 1 1 16 9  30 f 0  217.337 2.65292 844.695     28.3134  830.356     29.4535  137.475    187.57      0           0           
1 1 1 16 9  31 o 16 294.607 3.21294 1529.68     45.4229  1549.29     49.3895  221.567    268.145     31.612      268.145     
1 1 1 16 9  32 o 17 205.158 2.6236  732.44      25.828   760.312     28.1074  169.325    111.287     59.787      111.287     
1 1 1 16 9  33 o 9  272.513 3.11357 1324.88     43.3795  1309.65     41.6544  171.795    83.6943     36.1574     263.694     
1 1 1 16 9  34 o 14 145.647 2.52457 365.867     17.8816  386.543     18.9753  73.1312    159.29      48.4612     339.29      
1 1 1 16 9  35 o 13 157.709 2.72191 434.704     22.502   447.806     20.4164  121.738    348.759     37.3339     348.759     
1 1 1 16 9  36 o 13 244.337 3.05085 1031.58     36.4076  1086.85     38.3125  158.103    268.991     20.5033     88.9908     
1 1 1 16 9  37 o 5  288.693 3.51059 1466.43     49.398   1491.8      52.1645  271.305    8.19058     147.578     8.19058     
1 1 1 16 9  38 o 10 389.221 3.97214 2659.16     72.2614  2720.94     82.4667  309.075    55.0395     77.6615     55.0395     
1 1 1 16 9  39 o 12 221.251 2.83143 865.313     29.2065  871.317     33.4522  197.218    116.288     98.0461     116.288     
1 1 1 16 9  40 o 18 344.986 3.81411 2045.01     61.0788  2182.53     70.7104  252.61     163.02      28.9533     163.02      
1 1 1 16 9  41 o 7  96.5647 2.53054 163.157     11.1158  168.065     13.2671  48.6294    210.573     15.0942     30.5725     
1 1 1 16 9  42 o 18 126.871 2.48772 280.673     15.465   290.744     16.1395  25.9024    325.361     115.837     145.361     
1 1 1 16 9  43 o 8  95.4364 2.59069 149.62      11.4294  174.438     13.3238  57.4335    73.4514     20.0115     73.4514     
1 1 1 16 9  44 o 19 44.3985 3.7838  33.1023     7.37773  38.0105     9.11685  14.4579    114.733     62.5569     114.733     
1 1 1 16 9  45 o 11 209.577 2.82264 769.852     27.9684  788.931     31.2675  111.153    222.504     60.856      42.5036     
1 1 1 16 9  46 o 6  130.487 2.84127 304.275     16.1282  300.639     20.6739  62.3645    137.923     45.8985     317.923     
1 1 1 16 9  47 o 17 240.808 2.79396 979.474     32.0506  1080.19     35.4038  183.992    325.763     43.2325     325.763     
1 1 1 16 9  48 o 19 212.174 2.73094 778.703     27.6067  819.68      30.4578  98.1319    124.527     90.5234     304.527     
1 1 1 16 9  49 o 13 197.249 2.60237 659.243     25.0079  722.657     26.4461  107.998    211.366     49.3431     31.3661     
1 1 1 16 9  50 o 17 195.79  2.73746 653.711     26.0614  708.246     27.6658  168.371    328.672     76.8997     328.672     
1 1 1 16 9  51 o 7  118.882 2.56527 243.214     15.6217  259.279     14.8624  89.7833    80.0259     28.0892     80.0259     
1 1 1 16 9  52 o 3  78.4735 2.79262 103.446     10.3448  116.12      11.5584  38.4416    274.578     18.8912     94.5777     
1 1 1 16 9  53 o 5  117.949 2.45772 247.082     14.2483  247.525     14.7703  81.2694    1.69011     10.9508     1.69011     
1 1 1 16 9  54 o 18 85.2048 2.71474 126.278     10.7818  132.389     12.3216  52.6511    289.347     0.566311    289.347     
1 1 1 16 9  55 o 18 78.1161 2.81617 95.4786     10.617   123.05      11.2993  38.8169    221.411     18.9427     41.4108     
1 1 1 16 9  56 o 14 187.943 2.57905 602.059     23.3121  654.883     25.2807  133.762    34.8343     19.7245     34.8344     
1 1 1 16 9  57 o 18 65.1639 2.90893 70.5418     8.77977  81.5255     10.1346  33.0648    118.105     10.005      298.105     
1 1 1 16 9  58 o 9  93.7875 2.49865 155.171     11.2469  158.318     12.188   65.448     2.27734     14.6937     2.27735     
1 1 1 16 9  59 o 8  204.33  2.58952 755.988     26.9257  730.991     26.1085  151.868    23.5053     35.8454     23.5053     
1 1 1 16 9  60 o 17 64.0351 2.84934 77.468      9.25909  69.4747     8.9297   42.1341    141.633     8.83801     141.633     
1 1 1 16 9  61 o 18 24.5711 4.96239 5.45414     6.87425  16.2663     6.80135  10.3607    316.981     46.0592     316.981     
1 1 1 16 9  62 o 2  90.9296 2.65364 158.461     13.1368  137.458     11.0067  65.9626    274.338     16.2767     274.338     
1 1 1 16 9  63 o 3  55.5987 3.19851 55.5034     8.87987  55.9791     8.7893   39.4265    138.166     13.2632     138.166     
1 1 1 16 9  64 o 15 118.088 2.6386  278.727     16.521   221.721     14.6729  74.7823    209.868     2.26357     29.8682     
1 1 1 16 9  65 o 4  90.3141 2.6636  160.821     13.3065  132.169     10.7791  57.0456    312.015     0.489448    132.016     
1 1 1 16 9  66 o 17 17.2716 5.07929 2.64027     8.16145  0.863788    6.2985   1.78035    212.082     9.36771     212.082     
1 1 1 16 9  67 o 12 51.9641 3.67537 51.2572     10.2831  47.3426     8.57351  31.5529    274.244     0.994429    274.244     
1 1 1 16 9  68 o 17 57.9143 3.83054 55.5519     11.9797  67.2945     9.42186  28.5374    112.064     14.0408     292.064     
1 1 1 16 9  69 o 2  22.4202 5.59956 11.1367     8.7965   5.91493     6.96619  0.566788   211.538     22.2367     211.538     
1 1 1 16 9  70 o 4  42.1482 4.49308 32.8151     10.0311  33.6757     8.21996  20.8593    26.3826     7.59681     206.383     
1 1 1 16 9  71 o 6  83.9452 3.04177 130.056     13.7151  124.835     11.7467  43.0526    225.733     18.891      45.7325     
1 1 1 16 9  72 o 16 84.7213 2.9333  147.341     13.2766  113.468     11.5608  51.6795    24.5329     2.1442      204.533     
1 1 1 16 9  73 o 7  67.7893 3.36385 86.1873     12.1987  81.8977     10.4777  34.3024    258.615     15.0319     78.6153     
1 1 1 16 9  74 o 7  44.6893 4.3527  40.3014     10.4241  35.2826     8.54612  21.6251    178.118     10.0208     358.118     
1 1 1 16 9  75 o 19 66.913  3.86046 81.2141     12.7254  85.2406     12.9385  40.4983    106.988     0.502302    286.988     
1 1 1 16 9  76 o 9  45.4009 5.59831 31.9864     12.5573  50.4364     11.4498  16.0635    29.8253     21.817      209.825     
1 1 1 16 9  77 o 4  24.0419 6.39646 6.90476     11.164   12.1865     10.1065  7.28745    285.594     3.81486     105.594     
1 1 1 16 9  78 o 19 28.0255 6.43936 9.24083     10.6604  21.8721     10.9421  5.91964    10.8459     17.5371     190.846     
1 1 1 16 9  79 o 11 31.7575 7.13241 19.458      11.2685  23.4549     14.2615  15.6992    140.569     1.76052     140.569     
1 1 1 16 9  80 o 14 39.7696 6.83705 33.7035     12.2014  33.1464     14.8436  10.668     302.933     24.5066     122.933     
1 1 1 16 9  81 o 16 66.6003 4.85952 78.0904     13.5392  93.7334     18.3457  41.7071    101.089     4.41649     101.089     
1 1 1 16 9  82 o 7  20.4746 6.33695 -7.67295    11.7276  7.67856     13.6116  4.52096    354.355     3.87123     174.355     
1 1 1 16 9  83 o 3  21.4247 6.49613 6.06022     12.9749  1.20777     12.0323  4.33596    150.236     1.60214     330.236     
1 1 1 16 9  84 o 6  20.7578 6.30361 10.3008     12.5993  -7.09341    12.1802  1.9805     353.882     1.83409     173.882     
1 1 1 16 9  85 o 8  35.8864 7.81771 31.0087     14.6961  31.8908     16.2248  17.1421    33.6568     8.94378     33.6568     
1 1 1 16 9  86 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 10 0  o 11 48.775  3.01258 43.1174     7.2289   43.1174     7.2289   22.4463    180         59.9263     180         
1 1 1 16 10 1  o 7  805.955 7.02926 11545.5     283.91   11529.7     283.91   677.665    69.2839     183.175     69.2839     
1 1 1 16 10 2  o 8  216.816 2.85468 840.72      31.0022  825.819     31.0311  150.397    259.675     6.21641     259.675     
1 1 1 16 10 3  o 1  366.786 3.82718 2383.19     70.3402  2387.64     70.3557  230.131    243.026     65.3766     63.0256     
1 1 1 16 10 4  o 5  201.584 2.70448 727.482     26.7241  713.079     27.892   103.518    72.4865     69.2429     252.486     
1 1 1 16 10 5  o 19 495.868 4.60261 4316.07     114.365  4406.93     114.375  354.475    83.6983     7.20166     263.698     
1 1 1 16 10 6  o 6  142.357 2.40981 358.655     17.1909  359.697     17.1929  53.7205    105.622     75.5696     285.622     
1 1 1 16 10 7  o 5  402.699 4.01023 2892.72     82.6825  2858.81     79.1579  319.183    212.481     61.8882     212.481     
1 1 1 16 10 8  o 1  522.882 4.91927 4881.91     126.055  4819.41     131.65   414.643    213.881     74.6108     213.881     
1 1 1 16 10 9  o 3  80.896  2.52509 112.609     10.4193  119.881     9.97695  9.45493    149.832     98.0341     149.832     
1 1 1 16 10 10 o 18 266.248 3.07221 1262.75     40.0866  1250.61     41.8686  154.92     7.00026     65.6478     187         
1 1 1 16 10 11 o 1  286.02  3.1312  1458.32     44.8759  1442.31     44.8862  184.636    112.875     35.12       292.875     
1 1 1 16 10 12 o 5  207.08  2.68674 753.225     27.8803  767.047     27.8822  101.501    331.96      84.1625     151.96      
1 1 1 16 10 13 o 3  432.861 4.20608 3323.73     89.2353  3323.2      93.2018  361.575    193.043     103.164     193.043     
1 1 1 16 10 14 o 6  428.01  4.18699 3270.13     87.814   3228.9      91.7321  367.837    211.809     123.751     211.809     
1 1 1 16 10 15 o 13 286.731 3.45647 1473.38     47.0726  1442.38     52.0771  131.469    14.2202     144.432     194.22      
1 1 1 16 10 16 o 19 445.98  4.73204 3506.66     108.475  3552.49     102.933  279.706    290.728     81.0959     110.728     
1 1 1 16 10 17 o 14 306.708 3.68006 1709.98     55.0022  1627.23     57.9861  205.542    8.84964     22.7081     188.85      
1 1 1 16 10 18 f 0  292.496 3.55973 1523.63     50.7796  1510.93     53.5303  213.204    293.581     0           0           
1 1 1 16 10 19 o 1  282.71  3.4057  1445.12     48.2295  1389.91     48.2583  259.828    315.664     129.878     315.664     
1 1 1 16 10 20 o 16 274.015 3.28142 1379.05     43.9037  1284.77     46.0721  127.201    228.891     132.313     48.8914     
1 1 1 16 10 21 o 3  264.686 3.12016 1242.39     41.3681  1242.22     41.4066  195.698    0.697146    23.4424     0.697145    
1 1 1 16 10 22 o 11 194.859 2.61403 684.845     24.4501  661.557     26.5195  144.293    125.094     29.3443     125.094     
1 1 1 16 10 23 o 10 329.295 3.49623 1947.92     53.7672  1898.89     61.276   280.583    252.658     99.5966     252.658     
1 1 1 16 10 24 o 12 309     3.26329 1711.17     48.3664  1675.66     52.5638  249.364    286.114     65.9783     286.114     
1 1 1 16 10 25 o 16 376.936 3.78342 2531.77     69.8999  2509.77     72.9886  281.528    304.941     29.3358     304.941     
1 1 1 16 10 26 o 2  370.423 3.77668 2422.49     65.4119  2446.5      74.5488  275.969    256.013     27.8088     256.013     
1 1 1 16 10 27 o 9  55.0455 2.91881 62.4632     7.20829  46.2264     8.38917  49.2819    142.658     159.585     142.658     
1 1 1 16 10 28 o 13 98.9485 2.48664 173.87      11.2402  173.736     13.2933  51.3467    212.504     20.6138     212.504     
1 1 1 16 10 29 o 12 416.062 4.12508 3045.37     80.231   3100.24     91.5127  308.956    61.3451     28.3        61.3451     
1 1 1 16 10 30 o 5  128.71  2.56333 288.755     15.7485  299.231     17.2743  56.4281    127.527     58.7601     307.527     
1 1 1 16 10 31 o 10 223.065 2.97525 856.738     30.8841  908.688     35.5851  152.23     70.5687     4.5509      250.569     
1 1 1 16 10 32 o 5  337.825 3.7704  1982.18     60.6176  2069.32     67.0014  230.64     320.537     13.4194     140.537     
1 1 1 16 10 33 o 19 194.185 2.95689 648.712     26.492   689.268     30.9973  160.905    357.971     59.8858     357.971     
1 1 1 16 10 34 o 2  339.563 3.99266 2041.32     67.9937  2052.98     67.8909  251.731    69.2055     28.5989     69.2055     
1 1 1 16 10 35 o 2  155.911 2.59388 415.761     19.3556  446.676     21.1829  77.0537    144.77      56.0034     324.77      
1 1 1 16 10 36 o 12 125.043 2.64467 285.027     15.7848  270.172     17.242   80.874     303.498     3.47211     303.498     
1 1 1 16 10 37 o 9  399.955 3.93874 2838.18     80.6335  2842.82     77.2181  231.292    248.77      96.5511     68.7701     
1 1 1 16 10 38 o 13 403.653 4.14016 2881.61     79.8515  2906.77     87.5046  350.704    275.284     140.429     275.284     
1 1 1 16 10 39 o 16 149.514 2.54295 391.484     19.3096  401.479     18.7855  85.4607    208.595     27.0366     28.5947     
1 1 1 16 10 40 o 5  143.502 2.57611 358.331     17.468   372.48      19.5428  100.381    64.1982     15.0799     64.1982     
1 1 1 16 10 41 o 7  101.128 2.52679 181.082     11.9728  182.144     13.5529  48.0425    224.528     28.3948     44.5276     
1 1 1 16 10 42 o 11 95.7553 2.59054 160.515     11.2387  165.264     13.5034  38.5409    197.626     40.9183     17.6264     
1 1 1 16 10 43 o 11 102.699 2.41059 171.735     11.7907  203.489     12.9938  37.7853    187.104     54.7772     7.10445     
1 1 1 16 10 44 o 10 277.62  2.93223 1337.41     39.1043  1398.67     42.4765  217.584    15.7022     56.6595     15.7022     
1 1 1 16 10 45 o 5  180.131 2.5226  568.665     22.1567  582.736     23.3829  107.445    131.334     27.3878     311.334     
1 1 1 16 10 46 o 13 106.555 2.49781 205.814     13.3219  197.598     13.3134  45.6298    357.156     46.7658     177.156     
1 1 1 16 10 47 o 11 61.1603 2.93709 62.5207     8.65937  71.0663     9.23789  18.7697    278.324     30.4898     98.3237     
1 1 1 16 10 48 o 8  203.022 2.61552 700.122     26.4102  763.955     26.7889  169.675    325.271     67.2116     325.271     
1 1 1 16 10 49 f 0  195.381 2.49258 649.076     23.7106  706.911     25.1074  127.062    17.2139     0           0           
1 1 1 16 10 50 o 7  47.1853 3.61191 36.6201     8.24135  43.704      8.5343   9.99133    116.264     21.3227     296.264     
1 1 1 16 10 51 o 2  36.2301 4.69428 25.9649     7.96051  22.4236     8.41869  0.12781    138.45      16.7071     318.451     
1 1 1 16 10 52 o 6  152.136 2.67074 411.542     19.8225  411.374     20.8702  112.5      79.3085     24.5918     79.3085     
1 1 1 16 10 53 o 10 160.487 2.4853  438.915     19.7005  476.83      20.2703  93.2636    302.855     26.524      122.855     
1 1 1 16 10 54 o 18 113.027 2.59637 214.091     14.6402  241.084     14.6975  80.6832    274.955     16.0249     274.955     
1 1 1 16 10 55 o 10 113.834 2.55828 219.019     13.9672  242.701     15.1925  60.3821    86.8149     27.2396     266.815     
1 1 1 16 10 56 o 7  98.6456 2.62138 167.749     13.0114  179.199     12.8431  46.2096    231.114     34.4125     51.1142     
1 1 1 16 10 57 o 14 66.7768 3.03558 76.0818     9.93558  83.6996     10.269   44.371     70.7821     23.4        70.7821     
1 1 1 16 10 58 o 18 61.0194 3.05048 66.6901     9.14547  66.8406     9.38912  38.0505    85.2586     7.58417     85.2586     
1 1 1 16 10 59 o 1  93.8827 2.57184 156.655     12.1069  157.873     12.0471  60.1412    288.963     0.230141    288.962     
1 1 1 16 10 60 f 0  119.657 2.52251 244.612     15.4527  266.391     14.7024  81.8737    25.5253     0           0           
1 1 1 16 10 61 o 12 92.364  2.4292  139.54      10.7682  165.561     11.6785  54.9419    132.445     9.09382     312.445     
1 1 1 16 10 62 o 16 26.1115 5.13786 10.4338     6.13193  15.4086     7.85236  3.58672    329.4       15.4644     149.4       
1 1 1 16 10 63 o 14 22.9151 5.62816 7.68112     8.11628  9.88379     7.75442  0.597228   304.964     16.0212     124.964     
1 1 1 16 10 64 o 10 56.7749 3.38329 62.5088     10.3054  54.4196     8.77762  38.4472    304.984     8.2736      304.984     
1 1 1 16 10 65 o 17 24.0917 5.31939 4.34202     8.43088  15.1174     7.03925  3.91602    331.268     6.37331     151.268     
1 1 1 16 10 66 o 1  92.9655 2.82629 162.284     13.6972  148.458     12.5823  68.383     9.21657     19.1595     9.21657     
1 1 1 16 10 67 o 13 95.6973 2.86046 177.077     14.0318  152.738     13.3286  73.9326    86.1449     27.1814     86.1449     
1 1 1 16 10 68 o 11 40.137  4.72195 37.901      9.59858  23.5461     8.60703  17.3752    255.72      12.0895     75.7201     
1 1 1 16 10 69 f 0  37.9515 5.06984 22.1966     9.65801  33.0858     8.7266   20.6386    68.1609     0           0           
1 1 1 16 10 70 o 14 127.893 2.69638 308.292     17.9916  280.497     16.5424  89.9733    214.945     18.0307     214.945     
1 1 1 16 10 71 o 6  47.7311 4.38748 44.6722     10.4586  40.7274     10.0324  13.6338    302.78      31.2698     122.78      
1 1 1 16 10 72 o 13 45.2481 4.35021 48.9523     10.3679  29.3452     8.69302  18.5996    238.732     17.5349     58.7324     
1 1 1 16 10 73 o 13 27.8324 5.91168 11.1576     10.761   18.275      7.89509  7.21843    87.9678     16.4074     267.968     
1 1 1 16 10 74 o 18 33.4166 5.95392 24.6946     11.2824  20.6037     8.66785  19.4391    301.601     3.57045     301.601     
1 1 1 16 10 75 o 14 64.1805 4.42566 78.052      14.0517  77.921      14.0559  45.5942    67.6547     13.7591     67.6547     
1 1 1 16 10 76 o 18 53.8174 5.0799  52.7683     13.4635  59.8596     13.1648  38.7363    152.175     14.5887     152.175     
1 1 1 16 10 77 o 17 53.5677 5.27581 48.665      13.1534  64.4696     14.3102  30.9499    320.251     1.23567     140.251     
1 1 1 16 10 78 o 11 48.2899 6.33219 65.2073     13.1972  32.3095     15.4303  20.9854    243.371     14.5766     63.3713     
1 1 1 16 10 79 o 9  39.3722 6.24876 33.4162     11.0619  30.5788     13.0092  24.9488    264.722     7.21391     264.722     
1 1 1 16 10 80 o 15 27.909  6.73535 13.3354     10.0428  18.4541     12.5624  4.76755    166.199     21.0715     346.199     
1 1 1 16 10 81 o 2  28.5446 7.22809 16.1499     13.7098  17.2789     12.5664  12.1352    142.299     4.44349     322.299     
1 1 1 16 10 82 o 17 28.4715 7.23458 14.0756     13.5376  19.7761     13.0087  8.34858    76.4378     13.3172     256.438     
1 1 1 16 10 83 o 9  47.9941 6.93864 50.58       15.9401  51.2842     16.3097  32.8876    187.97      13.1673     187.97      
1 1 1 16 10 84 f 0  31.0789 7.12233 35.2567     14.2208  6.60825     14.7012  14.2988    219.742     0           0           
1 1 1 16 10 85 o 3  16.507  5.55534 -6.15372    12.3771  -16.3497    13.1414  0.906843   157.293     5.66918     157.293     
1 1 1 16 10 86 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 11 0  o 8  168.371 2.50091 503.046     21.0811  503.046     21.0811  86.7966    180         72.6801     8.6481e-06  
1 1 1 16 11 1  o 12 266.634 3.00043 1250.23     40.0841  1270.49     40.0985  169.667    333.211     38.3767     153.211     
1 1 1 16 11 2  o 18 667.695 6.07363 7849.15     207.543  7985.18     198.732  508.626    23.3899     45.3592     23.3899     
1 1 1 16 11 3  o 8  369.769 3.77836 2412.75     68.4729  2436.71     71.5381  245.657    307.701     40.8838     127.701     
1 1 1 16 11 4  o 15 391.275 3.91602 2719.5      78.4421  2710.84     75.1004  300.646    257.906     38.5618     257.906     
1 1 1 16 11 5  o 19 106.812 2.39279 208.024     12.7805  196.887     12.7956  38.1756    171.146     3.46304     171.146     
1 1 1 16 11 6  o 7  33.6728 3.75719 20.1435     6.09331  21.0582     6.16625  75.324     193.771     171.224     193.771     
1 1 1 16 11 7  o 11 335.301 3.51654 1994.05     60.3618  1993.14     57.7899  245.038    54.4847     10.8415     54.4848     
1 1 1 16 11 8  o 3  31.4342 4.24436 21.13       6.33189  15.2739     6.50653  27.4635    305.206     61.9807     305.206     
1 1 1 16 11 9  o 8  166.586 2.82299 494.117     22.9196  489.805     24.1918  113.859    115.275     10.5646     115.275     
1 1 1 16 11 10 o 6  397.061 4.78345 2772.54     100.889  2823.21     88.988   286.503    81.7635     2.23361     81.7633     
1 1 1 16 11 11 f 0  409.811 4.56861 2946.48     93.8112  3013.83     93.8341  281.351    57.7262     0           0           
1 1 1 16 11 12 o 13 429.571 4.88245 3281.71     108.151  3268.7      101.984  281.799    96.8037     55.37       276.804     
1 1 1 16 11 13 o 15 109.085 2.93481 207.282     15.0209  215.306     16.9801  35.2874    240.31      57.807      60.3103     
1 1 1 16 11 14 o 7  344.901 4.05746 2139.4      70.1151  2081.49     70.1365  176.193    205.361     142.012     25.361      
1 1 1 16 11 15 o 9  278.772 3.66829 1399.39     52.7532  1357.58     49.7344  150.008    160.079     95.4387     340.079     
1 1 1 16 11 16 o 16 208.03  3.07455 786.357     29.3566  748.603     34.4102  173.565    340.543     69.3018     340.543     
1 1 1 16 11 17 o 14 211.637 3.14811 809.392     31.4534  779.261     35.1431  183.983    16.7726     86.8988     16.7726     
1 1 1 16 11 18 o 3  391.133 4.02813 2724.38     75.2632  2704.39     82.4578  256.049    76.831      47.4501     256.831     
1 1 1 16 11 19 f 0  387.945 3.90199 2667.55     74.1817  2672.79     77.5062  187.11     102.593     0           0           
1 1 1 16 11 20 o 5  151.651 2.43845 403.293     17.7128  412.129     19.3315  106.207    249.089     21.7347     249.089     
1 1 1 16 11 21 o 15 308.173 3.26915 1683.27     48.3219  1685.45     52.5677  163.04     223.668     111.898     43.6677     
1 1 1 16 11 22 f 0  296.173 3.1855  1539.2      45.2622  1572.27     49.2531  132.706    44.6646     0           0           
1 1 1 16 11 23 o 4  54.4661 2.91546 58.4187     7.41944  47.6725     8.20257  26.2687    154.286     101.243     154.286     
1 1 1 16 11 24 o 8  157.901 2.59254 441.008     19.5272  443.103     21.4613  125.396    87.6862     45.8565     87.6862     
1 1 1 16 11 25 o 6  384.671 4.05594 2643.06     76.2696  2609.46     80.0345  321.302    246.293     95.9457     246.293     
1 1 1 16 11 26 o 6  306.029 3.48018 1641.51     52.1175  1681.67     54.6246  220.518    61.4072     7.8481      61.4071     
1 1 1 16 11 27 o 9  343.518 3.64924 2080.48     59.9407  2107.4      65.6094  246.645    153.364     5.92189     153.364     
1 1 1 16 11 28 o 11 220.409 2.9652  845.606     32.0071  877.785     33.5001  209.613    77.6757     118.42      77.6757     
1 1 1 16 11 29 o 19 125.822 2.57451 286.67      16.7093  275.291     15.7235  58.9297    21.1894     49.3052     201.189     
1 1 1 16 11 30 o 18 171.933 2.58147 529.848     21.7888  518.564     22.6763  130.276    101.54      28.5343     101.54      
1 1 1 16 11 31 o 1  332.485 3.51065 1949.11     57.2486  1974.41     59.7295  276.413    194.204     85.8669     194.204     
1 1 1 16 11 32 o 12 173.829 2.61292 534.438     22.7324  537.276     22.7914  118.389    159.955     1.09852     159.956     
1 1 1 16 11 33 o 3  45.3593 3.7192  41.0898     7.49716  33.1557     8.77782  4.27261    218.974     22.0499     218.974     
1 1 1 16 11 34 o 4  33.5613 4.03509 21.011      6.27522  20.1036     6.79288  16.0214    40.2046     43.4256     40.2046     
1 1 1 16 11 35 o 5  35.8279 3.78685 21.7186     6.21849  24.9172     6.97058  14.3731    298.157     41.7432     298.157     
1 1 1 16 11 36 o 17 63.7343 2.82819 75.0576     8.35371  69.6737     9.5247   9.68322    14.4165     10.4751     194.416     
1 1 1 16 11 37 o 4  28.7383 4.54535 9.89045     6.25222  21.1349     6.74854  30.0546    231.561     73.1614     231.561     
1 1 1 16 11 38 o 18 92.1799 2.49611 149.112     11.0024  152.738     12.0053  29.2893    251.3       55.3344     71.2997     
1 1 1 16 11 39 o 14 338.964 3.5648  2015.9      55.3093  2064.12     65.4835  265.746    74.3083     61.5056     74.3083     
1 1 1 16 11 40 f 0  364.99  3.76891 2327.12     64.3152  2405.35     73.3947  231.316    126.89      0           0           
1 1 1 16 11 41 o 16 244.31  2.94438 1050.02     36.8463  1068.4      35.2173  192.138    60.1006     50.6692     60.1006     
1 1 1 16 11 42 o 2  179.119 2.58025 558.535     23.1797  579.945     23.1362  162.887    305.062     90.7711     305.062     
1 1 1 16 11 43 o 10 280.473 3.07059 1372.71     43.8932  1420.57     42.3762  222.275    6.92571     60.1582     6.92571     
1 1 1 16 11 44 o 6  121.025 2.43104 258.672     14.5501  261.491     14.9084  80.1667    231.737     3.67578     231.737     
1 1 1 16 11 45 o 14 156.868 2.55496 435.319     19.9774  438.089     20.1932  110.617    305.58      11.5935     305.58      
1 1 1 16 11 46 o 13 275.04  2.91481 1333.57     40.0211  1353.26     40.3309  213.465    106.877     51.2093     106.877     
1 1 1 16 11 47 o 5  153.374 2.39401 412         18.2055  423.063     18.5969  135.726    319.333     70.0774     319.333     
1 1 1 16 11 48 o 9  129.133 2.45551 283.93      16.5564  308.669     15.0875  80.2724    243.169     10.0325     63.1693     
1 1 1 16 11 49 o 9  154.121 2.57998 424.15      19.5999  419.618     20.2445  95.4358    94.9492     15.0222     274.949     
1 1 1 16 11 50 o 13 42.9759 4.03187 37.6187     8.48831  29.6298     8.35415  7.47195    205.509     18.3968     25.5088     
1 1 1 16 11 51 o 16 56.7509 3.32788 51.6299     8.83322  64.1809     9.92794  19.2072    257.689     26.5203     77.6892     
1 1 1 16 11 52 o 10 166.263 2.677   486.699     22.547   496.397     22.054   111.636    131.426     1.69798     131.426     
1 1 1 16 11 53 o 15 67.3477 3.043   74.9668     10.2493  87.4751     10.1236  22.5778    177.22      38.3875     357.22      
1 1 1 16 11 54 o 6  48.3045 3.77692 42.8816     9.34939  41.5249     8.62512  15.8265    141.982     2.11648     141.982     
1 1 1 16 11 55 o 6  20.793  5.23754 7.64232     6.47113  5.62198     7.37682  3.30992    83.7963     9.31076     83.7963     
1 1 1 16 11 56 o 12 88.1033 2.65159 135.78      11.5315  141.221     11.8302  47.3628    71.6173     17.1482     251.617     
1 1 1 16 11 57 o 16 53.5773 3.49152 55.5299     8.67399  48.1496     9.70267  20.3309    351.045     22.8731     171.045     
1 1 1 16 11 58 f 0  69.1347 2.87465 87.5654     9.7255   83.6196     10.089   30.8039    241.455     0           0           
1 1 1 16 11 59 o 8  60.3387 3.1869  63.1748     9.67141  67.8292     9.44176  23.4351    109.812     29.6914     289.813     
1 1 1 16 11 60 o 15 20.9784 5.18276 3.02942     6.49374  10.85       7.39211  1.71028    110.269     16.8866     110.269     
1 1 1 16 11 61 o 9  53.5791 3.3073  49.0424     8.60647  54.8129     8.97125  31.9952    233.121     1.31495     53.1213     
1 1 1 16 11 62 o 13 20.5498 5.3429  6.22856     6.51414  6.46802     7.95267  3.22965    269.04      22.6614     269.04      
1 1 1 16 11 63 o 17 33.809  5.8384  27.0001     11.3228  17.5237     8.37894  15.5358    335.799     1.6092      155.799     
1 1 1 16 11 64 o 2  68.1994 3.42157 85.9903     12.6745  82.5048     10.4897  42.5664    184.96      0.479012    4.95974     
1 1 1 16 11 65 o 9  19.5258 5.54789 1.70655     9.00418  5.29681     7.78015  4.91602    134.285     26.9716     134.285     
1 1 1 16 11 66 o 1  49.0008 3.99144 45.8461     10.6871  42.5389     8.47968  26.8704    254.084     5.43738     74.0844     
1 1 1 16 11 67 o 3  70.0719 3.48467 84.9079     12.5809  93.6639     11.6379  47.6543    284.99      8.00983     284.99      
1 1 1 16 11 68 o 13 104.509 3.05593 197.297     16.3821  197.048     15.5475  67.4909    23.9717     2.08835     23.9716     
1 1 1 16 11 69 o 18 43.2628 4.83537 40.5792     11.6049  30.6679     8.71191  20.6181    174.149     10.7622     354.149     
1 1 1 16 11 70 o 15 72.1627 3.63736 101.37      14.3532  89.6868     11.7685  55.7522    81.7909     22.0483     81.7909     
1 1 1 16 11 71 o 1  37.8733 5.80013 35.07       11.8634  22.395      9.62826  11.9753    125.406     21.2505     305.406     
1 1 1 16 11 72 o 7  54.6639 4.64478 50.7901     13.1648  62.7848     11.2254  27.285     57.3605     12.5237     237.36      
1 1 1 16 11 73 o 19 28.3235 6.22858 18.836      10.4819  13.4592     9.13386  11.4945    6.71177     6.91576     186.712     
1 1 1 16 11 74 o 14 49.0106 5.15857 46.0366     11.9339  47.6164     12.6325  32.2199    279.386     6.53263     279.386     
1 1 1 16 11 75 o 14 25.7941 6.59322 14.038      10.7125  10.6391     11.2909  7.28628    235.772     11.2347     55.7718     
1 1 1 16 11 76 o 15 57.2008 5.16109 64.1256     14.7746  63.6849     14.1326  38.4197    110.922     9.11763     110.922     
1 1 1 16 11 77 o 15 20.2818 6.1205  1.06625     11.5328  3.73486     10.5151  1.82912    35.42       12.1125     215.42      
1 1 1 16 11 78 o 8  52.4572 5.78997 65.7979     14.9609  45.3595     14.2078  30.6605    52.5431     0.515048    232.543     
1 1 1 16 11 79 o 15 25.4528 7.05623 10.2897     12.9899  11.3868     13.2374  10.5284    48.4632     0.597951    48.4632     
1 1 1 16 11 80 o 11 50.657  6.70375 57.141      16.9827  51.301      15.8121  41.521     262.25      27.5635     262.25      
1 1 1 16 11 81 o 16 24.6772 7.0405  2.71361     13.4523  15.5955     14.0992  8.66722    291.425     5.14765     111.425     
1 1 1 16 11 82 o 8  22.9718 6.78864 -1.9611     13.8033  13.1806     13.4403  5.95052    15.9122     5.25392     195.912     
1 1 1 16 11 83 o 17 65.7843 5.53695 95.3245     18.7215  83.7827     17.0829  46.312     347.968     16.6395     347.968     
1 1 1 16 11 84 o 5  21.1161 6.5722  1.29449     13.7035  4.58371     13.3358  1.71499    264.833     5.03514     84.8335     
1 1 1 16 11 85 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 12 0  o 15 517.441 5.51196 4752.53     142.858  4752.53     142.858  419.789    180         80.935      180         
1 1 1 16 12 1  o 7  495.603 5.18399 4368.61     125.322  4352.79     132.083  387.805    178.833     56.6184     178.833     
1 1 1 16 12 2  o 3  439.056 4.85975 3420.73     106.923  3422.4      106.935  395.203    148.458     157.38      148.458     
1 1 1 16 12 3  o 1  176.551 2.89302 554.743     25.5891  550.514     25.6039  79.1005    25.0043     84.8556     205.004     
1 1 1 16 12 4  o 19 377.785 4.34525 2541.91     82.2609  2522.87     82.2701  295.481    106.601     47.4815     106.601     
1 1 1 16 12 5  o 15 159.278 3.16837 449.817     26.0974  450.583     24.4024  53.7005    332.003     110.209     152.003     
1 1 1 16 12 6  o 13 200.238 3.25405 727.475     32.642   694.694     32.6519  102.949    197.894     72.8907     17.8942     
1 1 1 16 12 7  o 7  427.78  5.02903 3280.9      107.817  3216.81     107.798  230.539    291.376     158.848     111.376     
1 1 1 16 12 8  o 4  290.231 3.7631  1524.67     56.3664  1463.95     53.1006  177.901    49.1132     58.3765     229.113     
1 1 1 16 12 9  o 2  210.908 3.49569 792.671     40.4535  785.681     33.0632  90.9301    241.19      114.432     61.1896     
1 1 1 16 12 10 o 4  190.96  2.8611  649.182     27.372   643.898     27.3878  113.434    250.53      35.3084     70.5301     
1 1 1 16 12 11 o 8  245.125 3.08945 1079.53     38.8543  1051.5      37.0461  150.296    252.823     44.8586     72.8229     
1 1 1 16 12 12 f 0  395.064 4.04994 2754.56     80.1826  2783.94     80.1797  297.155    311.69      0           0           
1 1 1 16 12 13 o 19 605.632 5.69016 6505.08     172.704  6529.21     172.697  488.007    282.409     98.4625     282.409     
1 1 1 16 12 14 o 3  259.015 3.10325 1202.28     42.088   1177.19     38.4261  180.556    333.821     3.31025     153.822     
1 1 1 16 12 15 o 16 112.042 2.43695 223.651     13.9876  221.853     13.341   55.391     219.533     12.1598     39.533      
1 1 1 16 12 16 o 1  164.009 2.54632 487.759     21.4024  466.126     20.4577  122.151    15.9229     90.6026     15.9229     
1 1 1 16 12 17 o 6  56.5685 3.01617 54.5234     8.66514  59.6714     8.27113  23.6545    288.632     93.5462     288.632     
1 1 1 16 12 18 o 16 141.976 2.59994 359.103     18.9352  356.133     18.0231  67.8857    281.289     53.3177     101.289     
1 1 1 16 12 19 o 15 375.841 3.97891 2510.26     76.7142  2503.07     73.1328  341.511    24.2259     147.213     24.2259     
1 1 1 16 12 20 o 8  578.632 5.89667 5937.92     175.423  5967.97     166.412  403.78     76.8122     27.3629     256.812     
1 1 1 16 12 21 o 2  54.8457 3.18452 53.5433     8.95515  53.8785     8.38383  5.6138     16.8646     46.8613     16.8646     
1 1 1 16 12 22 o 8  150.872 2.79357 411.945     21.694   395.963     20.5137  127.387    255.048     60.341      255.048     
1 1 1 16 12 23 o 2  226.775 3.08242 923.38      35.9745  900.951     34.0803  147.845    56.095      23.9537     236.095     
1 1 1 16 12 24 o 7  110.177 2.70898 219.169     15.3825  211.893     14.4852  45.5952    227.158     53.6898     47.1577     
1 1 1 16 12 25 o 16 78.7624 2.74028 108.197     10.8337  112.375     10.7268  23.9709    41.6767     4.48302     41.6767     
1 1 1 16 12 26 o 12 218.936 3.07549 833.439     32.8884  867.214     34.6011  135.513    166.813     36.1424     346.813     
1 1 1 16 12 27 o 15 225.717 2.84799 874.706     32.1705  932.968     32.2372  180.092    356.166     45.9857     356.166     
1 1 1 16 12 28 o 13 91.8233 2.56714 151.967     11.7386  147.547     11.8373  48.6465    177.002     6.00737     357.002     
1 1 1 16 12 29 o 3  69.2823 2.63104 85.1008     8.86227  85.6388     9.33584  16.5451    334.691     33.7752     154.691     
1 1 1 16 12 30 o 9  78.835  2.6371  108.234     10.1736  112.721     10.6055  4.64864    145.09      108.037     145.09      
1 1 1 16 12 31 o 9  160.479 2.58271 454.188     20.7557  459.266     20.7856  140.358    34.8603     72.0428     34.8603     
1 1 1 16 12 32 o 7  126.93  2.72248 289.717     16.4467  282.352     18.0854  73.5946    294.57      18.8149     114.57      
1 1 1 16 12 33 o 3  140.993 2.52368 358.72      17.4275  346.668     18.1938  115.851    310.519     53.3751     310.519     
1 1 1 16 12 34 o 13 207.372 2.79371 775.178     28.4196  750.587     29.6091  137.393    1.83316     10.8734     181.833     
1 1 1 16 12 35 o 5  192.864 2.60877 668.395     25.2473  651.159     25.179   143.148    287.161     23.8364     287.161     
1 1 1 16 12 36 o 12 98.8007 2.62713 182.041     13.3259  164.951     12.6442  42.5872    140.272     38.1854     320.272     
1 1 1 16 12 37 o 7  57.4285 3.06566 59.6597     8.95588  58.0589     8.55924  0.324183   356.434     53.5792     176.434     
1 1 1 16 12 38 o 6  198.347 2.88972 691.835     28.0265  704.319     29.4151  190.92     243.098     118.817     243.098     
1 1 1 16 12 39 o 7  140.148 2.49507 349.156     17.5574  348.088     17.4625  105.373    322.171     28.6987     322.172     
1 1 1 16 12 40 o 12 59.7415 3.06242 64.283      9.08631  63.0843     9.12519  9.46544    43.3999     38.6439     223.4       
1 1 1 16 12 41 o 6  192.393 2.58051 653.966     25.4083  659.538     24.3357  118.972    258.152     24.6578     78.1515     
1 1 1 16 12 42 o 18 101.194 2.49746 176.79      12.4196  187.112     12.8731  31.0111    240.976     70.6315     60.9763     
1 1 1 16 12 43 o 18 176.144 2.51013 544.082     22.1936  557.137     22.1185  105.037    236.026     29.6482     56.0258     
1 1 1 16 12 44 o 17 98.2208 2.55724 165.713     12.6933  177.309     12.4163  60.734     357.233     4.26492     177.233     
1 1 1 16 12 45 o 2  244.952 2.8891  1056.93     36.9665  1074.58     33.8681  160.944    203.728     14.0059     23.728      
1 1 1 16 12 46 o 2  106.328 2.56839 207.379     13.7624  194.679     13.5641  53.1332    28.4946     33.4902     208.495     
1 1 1 16 12 47 o 13 46.4617 3.66727 38.702      8.62104  39.1023     8.15438  9.30431    236.123     23.8731     56.1226     
1 1 1 16 12 48 o 12 179.359 2.52933 572.035     22.5639  570.798     22.904   155.51     290.705     70.9339     290.705     
1 1 1 16 12 49 o 3  71.0718 2.77014 94.7001     9.71428  85.5451     9.91053  39.7778    231.725     5.42777     51.7246     
1 1 1 16 12 50 o 4  90.8128 2.61587 137.07      12.0869  156.947     11.5907  77.1969    6.3564      50.93       6.3564      
1 1 1 16 12 51 f 0  87.3531 2.68381 132.974     11.6641  139.001     11.7751  64.0065    151.07      0           0           
1 1 1 16 12 52 o 11 49.9949 3.55046 43.0708     8.84832  47.0836     8.67563  18.7003    334.999     15.465      154.999     
1 1 1 16 12 53 f 0  97.7424 2.62633 162.059     12.7402  178.7       12.9269  55.2848    18.7963     0           0           
1 1 1 16 12 54 o 12 215.685 2.89995 804.39      31.7747  854.368     30.8593  145.383    310.893     1.98276     310.893     
1 1 1 16 12 55 o 10 147.978 2.57048 374.243     19.182   406.221     18.8874  101.611    251.98      7.65309     251.98      
1 1 1 16 12 56 o 13 54.2125 3.57503 47.1463     9.51872  59.3393     9.57579  30.1869    157.503     2.4463      337.503     
1 1 1 16 12 57 o 6  72.2132 2.91537 90.7557     10.0412  96.0945     10.9712  52.8045    82.6362     14.9772     82.6362     
1 1 1 16 12 58 o 11 47.9897 3.69105 36.6524     8.40768  47.3431     9.00412  3.78296    202.158     53.1168     22.1582     
1 1 1 16 12 59 o 9  33.3891 4.93581 17.7291     7.88316  24.4485     8.12323  14.1396    149.859     3.38875     329.859     
1 1 1 16 12 60 o 2  51.9941 3.61671 46.3902     9.03768  51.8928     9.56558  36.1168    52.8775     10.3814     52.8776     
1 1 1 16 12 61 o 13 62.5642 3.13832 66.4956     9.76251  74.8215     9.7605   29.7857    149.392     19.8228     329.392     
1 1 1 16 12 62 f 0  69.9531 2.92944 77.4707     10.0008  99.3368     10.3629  46.5904    120.707     0           0           
1 1 1 16 12 63 o 12 59.9099 3.7601  60.9264     12.1094  70.0797     9.85904  46.7557    15.0033     20.7889     15.0033     
1 1 1 16 12 64 o 7  40.689  5.15197 41.1365     10.3378  22.8057     9.69968  15.7657    118.783     17.0001     298.784     
1 1 1 16 12 65 o 13 30.1972 6.04614 13.6315     10.8366  20.9569     8.82533  10.8983    267.086     9.25241     87.0864     
1 1 1 16 12 66 o 14 24.3886 6.25082 13.5572     11.0118  6.22927     8.81782  2.61596    346.682     18.8734     166.682     
1 1 1 16 12 67 o 14 58.1432 4.49536 56.7935     13.9677  69.0677     11.0886  42.3173    176.683     13.5345     176.683     
1 1 1 16 12 68 o 11 45.721  5.38301 50.124      12.7572  31.1715     10.9578  16.6163    147.661     22.9727     327.661     
1 1 1 16 12 69 o 10 50.2191 4.83078 41.9357     11.9457  53.9391     11.4611  29.4277    10.8546     2.57742     190.855     
1 1 1 16 12 70 o 10 40.4458 5.37974 31.1412     10.9287  32.6807     10.0531  25.315     175.151     3.4225      175.151     
1 1 1 16 12 71 o 15 68.0812 3.76846 90.7205     13.3231  81.0437     12.195   42.7384    218.205     0.7061      218.205     
1 1 1 16 12 72 f 0  51.7537 4.62282 52.7673     12.4044  49.5055     11.0279  36.2629    296.018     0           0           
1 1 1 16 12 73 o 13 29.5269 6.00266 13.3288     10.963   21.2622     8.51735  7.1782     17.9509     19.0282     197.951     
1 1 1 16 12 74 o 1  23.5727 6.36031 10.8222     10.6687  7.54761     10.2682  0.262186   10.3599     24.4974     190.36      
1 1 1 16 12 75 o 19 22.0754 6.06755 -9.08238    11.8522  15.0225     10.6052  4.77326    331.791     6.33316     151.791     
1 1 1 16 12 76 o 6  19.9545 6.10373 7.03166     12.0616  -6.5387     11.0361  2.32963    226.563     8.68793     46.5625     
1 1 1 16 12 77 o 17 50.7068 5.98478 56.0311     15.2388  48.256      14.1114  21.2664    169.759     18.1248     349.759     
1 1 1 16 12 78 o 7  40.4675 7.35262 44.2251     15.293   27.6634     15.2584  22.5278    231.256     1.06563     51.2554     
1 1 1 16 12 79 o 7  19.4146 6.16873 1.62281     12.7607  -6.6613     12.5218  3.62069    44.1244     3.50526     224.124     
1 1 1 16 12 80 o 11 31.1982 7.46144 17.3001     14.4178  25.669      13.7802  16.7968    326.684     2.70121     326.684     
1 1 1 16 12 81 o 19 42.5621 7.24043 25.9101     16.867   57.8167     15.4891  23.4637    160.752     0.720674    340.752     
1 1 1 16 12 82 o 3  35.0478 7.36877 39.287      14.5242  18.8465     14.9485  15.5262    266.013     9.10532     266.013     
1 1 1 16 12 83 f 0  23.1023 6.98177 9.50331     15.4137  5.44499     13.1902  11.5137    96.1052     0           0           
1 1 1 16 12 84 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 13 0  o 13 37.8631 4.32476 27.3248     7.56427  27.3248     7.56427  60.6149    180         146.686     180         
1 1 1 16 13 1  o 10 427.003 4.74541 3214.82     101.539  3259.17     101.551  295.355    321.252     28.6765     141.252     
1 1 1 16 13 2  o 13 91.6984 2.74017 143.484     12.8518  155.33      12.2269  21.0246    45.4909     53.5703     225.491     
1 1 1 16 13 3  o 16 228.792 3.14061 932.916     36.9353  923.65      35.0679  102.938    90.9332     118.884     270.933     
1 1 1 16 13 4  o 10 317.643 3.88991 1805.18     58.3399  1775.1      65.2471  220.883    352.451     14.0015     172.451     
1 1 1 16 13 5  o 8  323.219 3.89803 1861.43     63.1323  1845.65     63.1462  207.94     128.939     48.8689     308.939     
1 1 1 16 13 6  o 15 352.716 3.92359 2215.41     72.7445  2199.29     65.8134  228.224    40.1424     52.3386     220.142     
1 1 1 16 13 7  o 19 287.775 3.36855 1471.84     47.3957  1465.82     49.731   140.588    124.866     132.102     304.866     
1 1 1 16 13 8  o 3  248.122 3.03722 1110.56     37.75    1073.05     37.7735  188.241    262.225     27.361      262.225     
1 1 1 16 13 9  o 11 299.353 3.38556 1604.4      48.4015  1574.54     53.025   185.801    77.7169     57.6421     257.717     
1 1 1 16 13 10 o 9  372.104 3.88216 2456.23     72.3909  2457.23     72.3958  304.512    142.81      73.7235     142.81      
1 1 1 16 13 11 o 13 172.141 2.68246 533.777     23.6932  517.061     22.5883  106.537    98.9842     21.7734     278.984     
1 1 1 16 13 12 o 16 170.617 2.76071 510.565     23.5905  521.772     23.6177  75.7603    115.324     84.9655     295.324     
1 1 1 16 13 13 o 6  501.329 4.97262 4465.2      121.919  4462.46     127.869  370.835    107.819     14.5797     107.819     
1 1 1 16 13 14 o 7  116.158 2.61893 246.161     15.2416  232.87      15.202   74.9645    354.076     23.3543     354.076     
1 1 1 16 13 15 o 13 505.132 5.40671 4506.41     136.859  4562.17     136.871  383.084    154.667     34.2836     154.667     
1 1 1 16 13 16 o 12 208.597 3.10774 776.67      32.4804  766.791     32.4931  181.694    96.4992     75.6689     96.4992     
1 1 1 16 13 17 o 12 370.565 4.39308 2441.78     79.15    2434.13     83.9354  244.149    29.3988     45.9297     209.399     
1 1 1 16 13 18 o 4  380.785 4.78367 2574.45     88.1904  2576.37     94.2804  315.763    291.044     83.8842     291.044     
1 1 1 16 13 19 o 17 153.157 3.01736 417.659     23.1273  415.048     23.1458  125.757    266.79      47.0765     266.79      
1 1 1 16 13 20 o 5  131.765 2.97196 311.407     19.5978  305.097     19.5999  107.152    139.593     46.8287     139.593     
1 1 1 16 13 21 o 7  110.889 2.87675 222.704     15.4975  214.078     16.3857  6.1925     30.3828     138.975     210.383     
1 1 1 16 13 22 o 18 255.656 3.34108 1182.12     43.9353  1137.3      41.6784  184.421    209.137     6.03743     209.137     
1 1 1 16 13 23 o 19 413.013 4.29648 3036.17     86.7671  3022.17     91.0267  308.602    253.555     24.3497     253.555     
1 1 1 16 13 24 o 14 202.414 2.92552 734.348     28.1049  719.114     31.1348  99.7322    281.235     85.7209     101.235     
1 1 1 16 13 25 o 6  370.741 3.99518 2470.44     72.4043  2410.47     75.9566  261.304    274.289     7.37417     94.2891     
1 1 1 16 13 26 o 1  340.92  3.84028 2079.28     65.5917  2047.5      65.6267  246.868    41.3083     8.12416     41.3081     
1 1 1 16 13 27 o 11 274.003 3.3499  1335.67     43.592   1328.87     48.2737  188.043    117.384     11.3936     297.384     
1 1 1 16 13 28 o 7  230.501 2.90306 936.527     33.4936  948.461     33.5745  174.321    10.2502     26.6037     10.2502     
1 1 1 16 13 29 o 16 206.588 2.82297 774.725     29.1905  739.568     29.2484  190.672    232.169     99.9148     232.169     
1 1 1 16 13 30 f 0  144.479 2.56474 368.958     18.4974  371.925     18.613   165.921    148.595     0           0           
1 1 1 16 13 31 o 5  171.094 2.85604 521.897     23.7391  516.723     25.2077  118.47     182.23      3.89736     182.23      
1 1 1 16 13 32 o 11 98.1183 2.59936 181.784     12.714   160.533     12.7625  59.945     108.354     26.7521     108.354     
1 1 1 16 13 33 o 15 265.836 3.09402 1252.92     40.2789  1255.12     42.1397  189.494    136.333     7.22448     136.334     
1 1 1 16 13 34 o 14 118.355 2.5323  255.845     14.4068  241.617     15.5346  85.364     6.39716     23.8608     6.39716     
1 1 1 16 13 35 o 9  443.39  4.48184 3529.96     94.9529  3460.36     103.919  314.088    139.578     2.66323     139.578     
1 1 1 16 13 36 o 13 191.653 2.72121 646.422     25.6392  656.9       26.6299  158.171    322.287     56.2414     322.287     
1 1 1 16 13 37 o 9  83.7068 2.72496 125.362     11.1528  123.802     11.6388  39.4395    165.627     17.8143     345.627     
1 1 1 16 13 38 o 7  246.411 2.87133 1076.59     35.4436  1078.53     35.4706  190.432    310.183     40.1531     310.183     
1 1 1 16 13 39 o 13 250.67  2.86582 1144.02     35.3097  1086.87     36.6279  201.338    232.521     56.3338     232.521     
1 1 1 16 13 40 o 18 343.44  3.46104 2088.29     58.3826  2103.07     60.7389  256.804    139.169     35.0295     139.169     
1 1 1 16 13 41 o 6  310.081 3.25717 1678.51     49.5849  1737.96     51.6476  224.966    102.46      19.0335     102.46      
1 1 1 16 13 42 o 12 83.6668 2.69061 118.4       10.5981  130.805     11.9118  43.8536    252.518     17.7204     72.5183     
1 1 1 16 13 43 o 9  78.1262 2.74349 106.009     10.1807  111.326     11.2297  49.6303    65.1709     7.08713     65.1709     
1 1 1 16 13 44 o 1  225.723 2.7579  905.756     29.9757  904.244     32.3703  165.536    5.45        21.248      5.45001     
1 1 1 16 13 45 o 14 71.333  2.86829 91.3646     10.0915  90.0576     10.3274  39.4396    64.516      5.72526     244.516     
1 1 1 16 13 46 o 7  284.444 3.04505 1435.52     41.709   1441.87     45.0454  169.782    129.698     51.7824     309.698     
1 1 1 16 13 47 o 4  219.208 2.7745  856.021     29.8844  852.362     31.0596  183.321    39.5446     68.5229     39.5446     
1 1 1 16 13 48 o 8  33.7391 4.86538 22.1787     7.52711  20.0449     8.35018  0.378683   307.591     10.6772     127.591     
1 1 1 16 13 49 o 8  71.1072 2.90454 102.419     9.82869  78.8985     10.5341  24.7859    354.767     40.706      174.767     
1 1 1 16 13 50 o 13 58.8496 3.1689  57.3421     9.31777  66.9827     9.17292  31.4136    204.837     3.20505     24.8368     
1 1 1 16 13 51 o 16 74.6942 2.69558 102.214     9.78723  96.9545     10.2997  53.1644    335.009     17.5542     335.009     
1 1 1 16 13 52 o 1  34.7777 4.35511 25.9959     7.29531  18.9192     7.25621  0.0436185  196.446     29.5745     16.4451     
1 1 1 16 13 53 o 14 112.259 2.4267  221.716     14.0872  227.255     13.155   82.5524    127.66      19.1101     127.66      
1 1 1 16 13 54 o 6  50.8266 3.51923 51.8123     8.24693  41.7729     9.20344  23.954     91.5565     9.86957     271.556     
1 1 1 16 13 55 o 3  85.8428 2.68796 125.678     11.2003  137.753     11.872   53.5957    349.433     4.094       169.433     
1 1 1 16 13 56 o 14 40.9217 4.56818 18.4087     8.51904  46.3786     8.59661  13.4572    181.832     22.293      1.83223     
1 1 1 16 13 57 f 0  101.364 2.67556 186.42      13.3007  180.95      13.8185  81.4622    174.264     0           0           
1 1 1 16 13 58 o 17 119.664 2.79592 256.869     15.7571  255.715     17.6683  90.5449    328.593     23.644      328.593     
1 1 1 16 13 59 o 4  41.9625 4.2292  25.2104     8.27715  40.6897     8.68549  19.0523    323.495     11.9315     143.495     
1 1 1 16 13 60 o 14 94.7485 2.62237 154.968     12.1165  166.776     12.7412  71.2148    305.738     19.6216     305.738     
1 1 1 16 13 61 o 8  84.2021 2.75329 119.703     11.4517  135.126     11.7024  49.1663    352.141     10.6469     172.141     
1 1 1 16 13 62 o 6  23.0938 5.87875 9.65583     8.73948  7.6844      8.66199  2.8531     4.17286     12.5056     184.173     
1 1 1 16 13 63 o 7  43.4666 4.79768 27.7612     9.9109   44.0272     9.91616  13.4593    255.754     26.533      75.7535     
1 1 1 16 13 64 o 4  18.5451 5.53018 3.35566     8.82489  -1.10042    8.90488  0.086271   151.975     1.83856     331.975     
1 1 1 16 13 65 o 17 80.7552 3.26748 124.539     13.5182  111.942     12.8179  51.3627    72.7702     0.364749    252.771     
1 1 1 16 13 66 o 10 34.1989 5.58104 21.6944     9.75751  23.8169     8.99869  15.5337    307.604     8.00133     127.604     
1 1 1 16 13 67 o 8  26.4146 5.87516 12.6412     9.43306  13.8566     8.00079  10.7479    193.04      4.45586     13.0397     
1 1 1 16 13 68 f 0  62.6562 3.82039 70.98       12.1205  73.8823     11.6135  32.298     222.025     0           0           
1 1 1 16 13 69 o 18 25.2889 6.07085 6.88951     9.79556  16.0575     9.28112  8.9767     82.3532     7.91462     262.353     
1 1 1 16 13 70 o 8  21.7917 5.99148 3.55718     9.68828  9.51395     9.40449  4.54979    70.1215     12.1313     250.122     
1 1 1 16 13 71 o 4  30.8725 6.56578 22.8792     10.6285  15.9936     11.733   11.2091    14.7911     12.5179     194.791     
1 1 1 16 13 72 o 5  44.4635 5.64498 36.3688     12.3848  42.5985     11.7666  25.6735    169.163     1.54751     349.163     
1 1 1 16 13 73 o 18 42.756  6.07224 48.5013     12.1065  27.0273     12.9328  18.1898    123.686     14.5139     303.686     
1 1 1 16 13 74 o 5  29.0259 6.96575 19.8762     12.2566  14.7102     12.0509  12.5836    136.723     2.87776     136.723     
1 1 1 16 13 75 o 7  20.859  6.19107 -5.68239    11.4073  9.79772     11.6309  3.54487    237.407     4.78829     57.4066     
1 1 1 16 13 76 o 8  19.1828 5.93964 1.17093     10.8331  -0.818764   10.9664  1.47036    129.185     13.4974     309.185     
1 1 1 16 13 77 o 9  17.244  5.49403 -14.405     10.6231  3.1197      10.5475  1.90548    347.893     7.07618     167.893     
1 1 1 16 13 78 o 10 22.9521 6.69515 10.4268     11.8854  1.2228      13.786   7.80378    43.177      1.88574     223.177     
1 1 1 16 13 79 o 5  19.1846 6.08522 -1.52251    12.3156  -1.25501    11.9421  3.52079    48.0178     6.23194     228.018     
1 1 1 16 13 80 o 2  49.6857 6.49213 54.522      15.5976  52.1978     15.5398  22.4634    41.8831     13.3895     221.883     
1 1 1 16 13 81 o 19 37.015  7.45383 38.204      14.7969  27.3782     14.5242  19.478     314.291     0.124022    314.291     
1 1 1 16 13 82 o 1  22.2896 6.88518 -4.21152    15.7083  10.8973     14.4789  2.91903    174.147     9.29797     354.147     
1 1 1 16 13 83 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 14 0  o 11 107.429 2.66994 205.313     14.3339  205.313     14.3339  72.7504    7.43187e-06 14.1885     7.43187e-06 
1 1 1 16 14 1  o 4  249.906 3.12282 1123.78     40.0525  1091.57     38.1651  204.887    148.534     55.5653     148.534     
1 1 1 16 14 2  o 17 175.442 2.66859 540.615     23.4671  550.901     23.4564  86.2185    182.24      73.0765     2.24038     
1 1 1 16 14 3  o 3  180.852 2.68671 577.332     24.339   582.529     24.3613  160.524    2.1754      80.4556     2.1754      
1 1 1 16 14 4  o 5  287.784 3.28994 1461.13     47.4408  1476.88     47.4536  170.805    195.06      73.5339     15.0596     
1 1 1 16 14 5  o 1  207.464 3.11568 750.327     30.5537  776.485     34.1858  160.825    154.481     31.623      154.481     
1 1 1 16 14 6  o 14 124.1   2.64873 272.132     16.4862  274.495     16.4211  58.5664    247.515     46.7075     67.5151     
1 1 1 16 14 7  o 7  184.004 3.10277 611.473     31.0269  589.97      26.0306  46.5107    255.306     168.714     75.3063     
1 1 1 16 14 8  o 12 83.8942 2.92788 123.967     11.9545  126.272     12.5855  12.8983    92.9051     1.49793     92.9051     
1 1 1 16 14 9  o 18 454.238 5.10759 3755.29     119.712  3577.24     112.837  291.559    282.825     78.6881     102.825     
1 1 1 16 14 10 f 0  213.587 3.33585 813.932     35.7281  804.542     35.6832  179.327    100.27      0           0           
1 1 1 16 14 11 o 19 308.793 4.00964 1710.39     62.0639  1674.45     62.0288  255.675    328.483     67.2442     328.483     
1 1 1 16 14 12 o 1  151.401 2.97847 413.072     22.5913  400.659     22.5585  76.3476    308.689     57.5319     128.689     
1 1 1 16 14 13 o 5  283.672 3.94217 1426.59     54.1721  1429.84     57.8547  227.492    294.6       47.8337     294.6       
1 1 1 16 14 14 o 9  69.6292 3.2319  82.2922     11.5406  90.5511     10.8195  18.857     250.563     32.4319     70.5632     
1 1 1 16 14 15 o 3  302.411 3.84672 1651.04     60.0123  1595.43     56.5774  228.44     327.312     21.4697     327.312     
1 1 1 16 14 16 o 1  148.858 2.71753 391.725     20.2174  394.703     20.2937  47.7188    191.631     113.469     11.6312     
1 1 1 16 14 17 o 6  140.873 2.63556 355.066     19.0278  349.259     18.1481  83.0399    253.285     26.8771     73.2849     
1 1 1 16 14 18 o 4  89.3634 2.66897 140.127     11.5738  143.62      12.2745  17.0667    176.195     81.6354     356.195     
1 1 1 16 14 19 o 14 56.3176 3.30038 54.7689     9.86365  58.5782     8.47967  4.31756    182.463     21.3175     2.46314     
1 1 1 16 14 20 o 10 174.936 2.62273 534.738     23.4634  550.698     22.4941  125.004    122.227     7.24653     122.227     
1 1 1 16 14 21 o 13 301.325 3.23283 1618.93     48.8279  1602.96     48.807   145.431    149.052     142.148     329.052     
1 1 1 16 14 22 o 18 158.298 2.55468 437.446     19.8334  451.352     20.6995  142.828    300.642     77.7602     300.642     
1 1 1 16 14 23 o 1  281.125 3.17163 1410.26     45.6421  1394.18     43.7131  187.864    110.694     25.2809     290.694     
1 1 1 16 14 24 o 9  290.805 3.23492 1511.13     46.1019  1490.03     48.1474  196.291    192.446     22.0869     12.4455     
1 1 1 16 14 25 o 11 187.489 2.61739 612.909     24.5947  634.052     24.585   91.6407    148.882     79.8282     328.882     
1 1 1 16 14 26 o 10 192.636 2.58488 651.515     24.4537  664.789     25.4523  121.169    218.812     26.6166     38.8122     
1 1 1 16 14 27 f 0  240.611 2.84669 1043.72     33.6062  1010.41     35.0008  178.933    34.9616     0           0           
1 1 1 16 14 28 o 19 336.51  3.43572 2020.93     56.746   1999.1      59.0955  324.045    219.152     172.527     219.152     
1 1 1 16 14 29 o 15 81.8755 2.59034 121.507     10.605   116.79      10.5952  35.2899    286.072     19.6822     106.072     
1 1 1 16 14 30 o 2  71.6778 2.88732 92.994      9.6783   89.9116     10.9155  53.3767    105.262     200.5       105.262     
1 1 1 16 14 31 o 10 95.0515 2.54105 160.871     12.2645  160.082     11.8981  45.1288    162.865     27.3198     342.865     
1 1 1 16 14 32 o 19 126.934 2.48059 289.127     15.3683  282.868     16.1408  83.0714    57.1985     0.307244    237.199     
1 1 1 16 14 33 o 14 203.672 2.64737 740.27      26.4603  731.523     27.5639  138.191    309.548     6.09988     129.548     
1 1 1 16 14 34 o 3  153.157 2.47768 425.704     18.6057  406.568     19.3945  137.918    82.5897     76.9588     82.5897     
1 1 1 16 14 35 o 14 640.638 5.77323 7319.71     177.466  7317.32     192.901  515.455    345.962     123.06      345.962     
1 1 1 16 14 36 o 18 88.3321 2.7049  142.347     12.3623  135.124     11.5295  29.5444    205.951     18.6735     205.951     
1 1 1 16 14 37 o 16 132.517 2.43724 315.537     15.6147  307.819     16.7059  98.461     136.986     21.6422     136.986     
1 1 1 16 14 38 o 17 64.6784 2.70546 78.0804     8.63844  71.0197     8.79724  3.71508    65.2826     72.0729     245.283     
1 1 1 16 14 39 o 6  94.5687 2.42841 162.992     11.3792  154.868     11.588   59.4664    262.402     1.54469     82.4016     
1 1 1 16 14 40 f 0  94.444  2.57562 162.059     12.2429  155.103     12.0906  31.4941    176.201     0           0           
1 1 1 16 14 41 o 4  246.496 2.77277 1075.34     34.2519  1082.76     34.2515  154.816    2.17285     32.9111     182.173     
1 1 1 16 14 42 o 19 44.2522 3.9229  36.6087     8.72105  34.2329     8.29867  2.79998    341.533     37.9143     161.533     
1 1 1 16 14 43 o 2  104.849 2.63644 199.929     13.5013  191.147     14.1333  91.4845    216.063     52.9366     216.063     
1 1 1 16 14 44 o 14 28.0802 4.99502 14.0198     7.00118  15.2908     7.04822  23.2138    37.9443     70.9101     37.9443     
1 1 1 16 14 45 o 16 117.882 2.41199 244.867     14.0523  249.2       14.4157  84.213     157.39      12.121      157.39      
1 1 1 16 14 46 o 8  169.837 2.41003 508.85      20.1809  516.089     20.8423  135.301    333.745     40.42       333.745     
1 1 1 16 14 47 o 15 71.2227 2.708   90.4351     9.45554  90.5179     9.80138  35.1465    151.482     19.0453     331.482     
1 1 1 16 14 48 o 1  209.387 2.58495 781.431     27.0512  778.115     27.1973  168.878    302.198     52.7456     302.198     
1 1 1 16 14 49 o 12 22.8865 5.1563  6.68819     6.7518   11.5999     6.79521  22.3615    102.717     62.9181     102.717     
1 1 1 16 14 50 o 4  104.042 2.49709 203.501     13.2396  182.46      12.7548  55.4032    33.9571     26.6391     213.957     
1 1 1 16 14 51 o 7  75.8686 2.80828 103.762     10.6188  101.961     10.6604  52.8016    204.731     13.0582     204.731     
1 1 1 16 14 52 o 8  83.3248 2.76191 124.304     11.21    123.756     11.783   69.1908    297.932     36.2823     297.932     
1 1 1 16 14 53 o 6  32.7933 4.7048  22.1095     7.47271  18.1324     7.46028  6.46076    56.8722     6.11416     236.872     
1 1 1 16 14 54 o 14 73.7619 2.8553  94.3393     10.1999  100.552     10.8316  48.7389    226.839     2.28943     226.839     
1 1 1 16 14 55 o 3  85.3505 2.63316 129.802     10.7888  130.659     11.6672  61.5038    280.068     11.3627     280.068     
1 1 1 16 14 56 o 18 85.2071 2.67465 126.348     11.2761  133.554     11.5075  50.1075    281.237     11.7356     101.237     
1 1 1 16 14 57 o 8  38.6228 4.6554  22.7273     8.11676  33.4289     9.23152  18.2895    15.7649     7.85325     195.765     
1 1 1 16 14 58 o 7  147.83  2.94775 398.834     19.9788  385.277     23.4409  103.868    117.894     11.4528     117.894     
1 1 1 16 14 59 o 5  17.2373 5.33466 2.76589     9.24393  -8.29686    8.95311  15.7483    285.257     48.5037     285.257     
1 1 1 16 14 60 o 8  94.0686 2.92059 150.864     13.0637  167.637     14.4147  50.6716    34.7677     21.8068     214.768     
1 1 1 16 14 61 o 9  95.0668 2.85442 152.863     12.7636  172.507     14.3846  57.2711    144.294     9.44194     324.294     
1 1 1 16 14 62 o 15 20.3052 5.58306 7.05882     8.10342  2.98744     8.37958  1.15305    250.185     9.69269     70.1845     
1 1 1 16 14 63 o 7  55.2988 4.04782 52.3199     10.5841  60.4204     11.5308  26.8238    16.1662     16.0507     196.166     
1 1 1 16 14 64 o 13 64.5282 3.77337 79.8428     11.9307  72.6903     12.2141  34.698     222.854     12.7555     42.854      
1 1 1 16 14 65 o 11 129.929 2.7567  304.627     17.714   303.341     18.1411  92.1589    232.572     15.6998     232.572     
1 1 1 16 14 66 o 15 54.3204 4.16295 48.7134     10.8212  61.3719     11.4103  21.8367    72.4488     25.0392     252.449     
1 1 1 16 14 67 o 11 66.6911 3.76465 84.8864     12.6118  79.1937     12.3395  57.5176    55.1897     32.0994     55.1897     
1 1 1 16 14 68 o 18 59.8471 4.53032 63.0205     13.9689  72.2959     12.5247  45.2654    352.285     16.2666     352.285     
1 1 1 16 14 69 o 14 28.4696 6.6181  14.7064     10.5271  17.6494     11.334   14.645     210.159     1.32704     210.159     
1 1 1 16 14 70 o 14 24.7039 6.48041 10.6079     10.2013  10.9847     11.1498  9.10555    325.849     5.25046     145.849     
1 1 1 16 14 71 o 12 34.8172 6.69918 17.434      12.7206  33.4885     12.2347  14.5287    243.738     11.2768     63.7381     
1 1 1 16 14 72 o 10 31.5704 6.38282 24.0915     10.5643  17.3796     10.8903  16.7552    258.858     1.08106     258.858     
1 1 1 16 14 73 o 12 18.9953 5.69026 8.04887     9.81791  -10.1737    10.7892  1.44681    94.2338     19.7942     94.2338     
1 1 1 16 14 74 o 6  33.2072 6.77945 31.8031     12.1155  14.433      13.2046  18.3207    0.0988905   2.39303     0.0988904   
1 1 1 16 14 75 o 16 30.7232 6.73529 28.2318     12.1513  10.4832     12.2994  12.4595    34.8502     8.90243     214.85      
1 1 1 16 14 76 o 4  22.0874 6.38953 0.595475    11.1449  10.5565     11.8117  3.00816    283.569     16.7432     103.569     
1 1 1 16 14 77 o 19 26.5567 6.91203 7.22281     12.0854  19.7495     12.8619  1.87945    317.287     0.973971    317.287     
1 1 1 16 14 78 o 4  18.7882 6.04216 -9.43153    13.3177  0.974939    12.1038  0.0722982  15.3891     17.7281     15.3892     
1 1 1 16 14 79 o 2  35.5056 7.89849 38.0511     17.3549  23.697      14.1924  17.5992    242.247     3.13484     62.2471     
1 1 1 16 14 80 o 8  27.0755 7.36712 8.22395     16.1268  21.1382     13.5713  7.62528    217.488     10.8616     37.4878     
1 1 1 16 14 81 o 3  40.2178 8.38316 45.2069     18.0397  39.1672     18.1679  21.2813    94.4447     0.0615215   94.4444     
1 1 1 16 14 82 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 15 0  o 15 153.998 3.05281 421.398     23.518   421.398     23.518   73.8217    180         79.1424     8.65261e-06 
1 1 1 16 15 1  o 19 315.876 3.87866 1790.82     61.3908  1751.03     61.4002  251.177    356.312     43.9132     356.312     
1 1 1 16 15 2  o 8  111.485 2.8086  218.884     15.6514  222.509     15.6811  54.8937    304.965     38.9437     124.965     
1 1 1 16 15 3  o 19 190.35  3.03637 659.397     28.9707  626.125     28.9446  145.2      162.707     21.3308     162.707     
1 1 1 16 15 4  o 1  399.336 4.67465 2845.83     90.7344  2819.31     96.2573  277.235    29.071      28.9605     209.071     
1 1 1 16 15 5  o 2  319.499 4.60597 1812.57     70.8295  1813.58     76.5558  239.043    17.2754     13.8709     17.2754     
1 1 1 16 15 6  o 3  197.016 3.63015 700.328     37.2015  678.255     34.4032  62.9295    29.6425     157.889     209.643     
1 1 1 16 15 7  o 5  197.433 3.37512 701.582     32.2396  682.067     34.4458  163.084    357.696     47.596      357.696     
1 1 1 16 15 8  o 15 47.1249 3.84855 39.9795     8.95422  39.8979     8.88972  39.1717    81.1602     130.249     81.1602     
1 1 1 16 15 9  o 17 187.506 3.00683 629.665     28.2577  617.595     28.2491  131.117    141.157     3.16602     321.157     
1 1 1 16 15 10 o 4  73.721  3.02102 94.5837     11.1054  98.8857     11.117   27.7021    282.572     11.6406     102.572     
1 1 1 16 15 11 o 3  328.918 3.57806 1902.11     58.9827  1937.7      58.9709  244.987    39.5703     12.9995     39.5703     
1 1 1 16 15 12 o 7  242.619 3.02873 1046.7      36.8279  1041.58     36.8226  199.066    8.81171     51.4175     8.8117      
1 1 1 16 15 13 o 15 197.523 2.84371 692.741     28.7825  691.215     27.5023  150.609    75.1732     22.3006     75.1732     
1 1 1 16 15 14 o 11 246.332 3.38116 1067.93     39.4018  1085.48     43.9859  137.426    60.2962     79.7346     240.296     
1 1 1 16 15 15 f 0  271.882 3.36664 1314.69     45.8778  1308.58     45.8641  186.364    213.904     0           0           
1 1 1 16 15 16 o 4  205.89  3.15301 745.071     34.3022  759.096     30.6223  122.874    38.4292     47.3399     218.429     
1 1 1 16 15 17 o 18 388.794 4.11656 2723.74     78.2631  2645.32     82.0386  290.955    354.674     18.866      354.674     
1 1 1 16 15 18 o 11 162.176 2.77885 467.216     21.4851  466.082     23.6105  113.904    341.599     3.6234      341.598     
1 1 1 16 15 19 o 7  120.442 2.76717 260.118     16.2866  255.031     17.0555  12.3571    2.70814     141.95      182.708     
1 1 1 16 15 20 o 15 255.669 3.36485 1176.75     41.9712  1143.44     44.1868  177.379    83.8983     10.426      263.898     
1 1 1 16 15 21 o 12 354.963 3.86341 2243.49     67.082   2231.08     70.3202  252.167    321.733     6.91476     141.733     
1 1 1 16 15 22 o 5  212.29  2.88923 822.04      30.0149  777.241     31.3885  180.041    357.902     63.1007     357.902     
1 1 1 16 15 23 o 1  86.2748 2.7415  134.172     11.6043  130.433     12.0294  44.0308    253.769     6.68568     73.7694     
1 1 1 16 15 24 o 5  438.008 4.39492 3431.07     96.4779  3387.59     96.4595  341.389    57.1818     52.4579     57.1818     
1 1 1 16 15 25 o 16 161.393 2.66158 469.53      21.5051  454.59      21.5442  61.0882    273.713     103.458     93.7131     
1 1 1 16 15 26 o 19 117.908 2.61538 249.427     15.4741  244.248     15.3949  87.749     14.3384     28.8164     14.3384     
1 1 1 16 15 27 o 15 243.926 2.97617 1065.58     35.5815  1045.96     37.1469  157.106    230.522     31.08       50.5222     
1 1 1 16 15 28 o 5  310.126 3.45794 1711.24     53.7342  1703.72     53.7502  269.537    4.27314     99.439      4.27314     
1 1 1 16 15 29 o 14 70.1955 2.92618 93.6535     10.0783  82.0084     10.36    22.4539    60.5083     27.0858     240.508     
1 1 1 16 15 30 o 18 114.835 2.63846 230.737     15.1641  237.656     15.161   44.9005    133.22      64.1343     313.22      
1 1 1 16 15 31 o 16 230.778 2.86669 944.758     31.7363  945.362     34.5139  194.426    144.398     66.8318     144.398     
1 1 1 16 15 32 o 5  132.474 2.43267 315.044     15.7691  307.984     16.4859  102.409    60.776      31.1681     60.776      
1 1 1 16 15 33 o 6  216.769 2.66794 820.938     28.9802  846.668     28.9794  153.385    109.958     3.96773     109.958     
1 1 1 16 15 34 f 0  176.229 2.70212 549.583     23.426   552.678     24.296   169.188    169.95      0           0           
1 1 1 16 15 35 o 5  152.653 2.64554 413.213     20.2689  413.904     20.2082  111.804    91.5409     15.5417     91.5409     
1 1 1 16 15 36 o 18 308.302 3.29583 1697.93     48.7551  1679.44     52.975   319.164    236.976     207.426     236.976     
1 1 1 16 15 37 o 15 75.6721 2.72857 100.087     10.1446  103.774     10.4827  4.36102    200.956     90.8355     20.9563     
1 1 1 16 15 38 o 10 94.6434 2.62666 163.448     12.4297  155.135     12.4317  70.3674    44.8111     21.1165     44.8111     
1 1 1 16 15 39 o 13 17.5966 4.95391 1.48494     6.53927  3.99656     6.63592  21.2914    22.5954     48.9751     22.5954     
1 1 1 16 15 40 o 10 146.245 2.42701 377.73      17.2558  381.703     18.3086  95.8708    157.056     8.34873     337.056     
1 1 1 16 15 41 o 10 143.25  2.5146  373.434     17.8033  355.771     18.2623  83.6606    191.685     28.7596     11.6852     
1 1 1 16 15 42 o 5  160.327 2.62475 474.642     20.3735  439.08      21.7068  96.9622    174.449     26.341      354.449     
1 1 1 16 15 43 o 6  62.2252 3.1066  70.0443     9.69934  68.4222     9.55127  26.4917    95.4841     22.0683     275.484     
1 1 1 16 15 44 o 14 105.227 2.48592 198.596     12.7665  195.372     13.401   63.3581    332.733     13.4783     152.733     
1 1 1 16 15 45 o 1  138.364 2.34492 352.814     15.9789  327.989     16.4873  107.913    196.157     29.2426     196.157     
1 1 1 16 15 46 o 6  120.946 2.60912 254.304     15.0764  266.633     16.5095  104.504    151.44      49.3477     151.44      
1 1 1 16 15 47 o 15 63.6438 2.96082 72.7121     9.298    72.2318     9.48215  41.7377    150.639     12.5589     150.639     
1 1 1 16 15 48 o 2  102.287 2.48322 188.742     12.4946  184.038     12.9151  62.0178    115.803     11.3144     295.803     
1 1 1 16 15 49 o 1  116.727 2.45665 243.055     14.3678  242.366     14.3415  74.2587    309.299     7.08851     129.299     
1 1 1 16 15 50 o 1  33.5401 4.65027 19.4173     7.47258  22.5187     7.5991   3.60016    66.3514     7.61679     246.351     
1 1 1 16 15 51 o 5  161.049 2.38836 471.289     18.9366  452.396     19.5903  117.206    28.7924     16.7629     28.7924     
1 1 1 16 15 52 o 15 40.9349 4.05426 29.6359     7.87732  31.7787     8.30307  7.09382    212.763     35.6575     32.7631     
1 1 1 16 15 53 f 0  84.3826 3.02449 135.161     13.1342  120.331     12.3627  48.67      200.387     0           0           
1 1 1 16 15 54 o 12 16.0063 4.8276  -2.83373    6.82471  2.31841     7.0472   9.25502    331.812     29.3484     331.812     
1 1 1 16 15 55 o 7  82.42   2.95231 125.117     11.6742  118.782     12.5846  50.3692    90.7415     7.85422     270.741     
1 1 1 16 15 56 o 17 55.6133 3.52436 57.0001     9.41092  55.2393     10.0019  22.5174    44.0285     26.5275     224.028     
1 1 1 16 15 57 o 4  34.5197 4.87663 23.6381     8.09924  21.4519     8.17959  17.6144    69.4809     0.294201    249.481     
1 1 1 16 15 58 o 9  97.2514 2.64525 164.05      13.2389  175.249     12.4457  68.7646    151.821     9.61377     151.821     
1 1 1 16 15 59 o 6  40.3925 4.79138 27.8417     8.99732  33.6743     9.71091  17.1764    245.44      14.6648     65.44       
1 1 1 16 15 60 o 18 66.7182 3.42611 78.9316     11.2361  82.7433     11.5185  26.8171    229.531     32.9372     49.5306     
1 1 1 16 15 61 o 15 82.1459 3.15398 122.657     12.7073  121.298     13.1557  43.2555    312.912     20.5314     132.912     
1 1 1 16 15 62 o 19 57.3202 3.82152 60.9873     10.6469  59.5531     11.0374  34.8456    201.077     2.73694     21.0768     
1 1 1 16 15 63 o 9  34.3172 5.61792 22.7844     9.39516  23.1211     9.54641  9.79022    168.726     21.5952     348.726     
1 1 1 16 15 64 o 18 104.429 3.31599 194.927     16.9406  201.401     17.6789  67.5916    21.8961     0.658808    201.896     
1 1 1 16 15 65 o 14 83.3032 3.40498 134.831     13.676   118.791     14.5112  69.4796    46.6626     32.3359     46.6626     
1 1 1 16 15 66 o 8  69.2196 4.04203 95.9198     12.5349  82.2792     14.8421  37.6216    235.48      13.3257     55.4802     
1 1 1 16 15 67 o 8  35.4441 6.35828 28.5093     10.6523  22.7135     12.1566  11.9049    32.7618     19.0253     212.762     
1 1 1 16 15 68 o 13 46.4245 5.06057 33.4712     11.0842  51.0694     11.3533  22.3021    169.842     12.8865     349.842     
1 1 1 16 15 69 o 9  72.3746 3.74662 84.2744     13.1574  111.601     13.6748  58.5725    344.418     26.5108     344.418     
1 1 1 16 15 70 o 12 18.2272 5.47325 -10.5       9.51303  7.69497     9.58297  1.94163    230.253     4.44207     50.2534     
1 1 1 16 15 71 o 7  36.4482 6.1509  34.28       11.4895  21.2237     10.94    24.1476    340.027     10.9881     340.027     
1 1 1 16 15 72 o 14 18.4416 5.73184 0.450427    9.72134  -0.992358   10.7543  1.10579    318.957     4.82957     138.957     
1 1 1 16 15 73 o 18 31.6002 6.79612 25.6316     11.7785  16.6464     12.1092  17.1616    118.032     2.47399     118.032     
1 1 1 16 15 74 o 2  37.2596 7.0875  24.2954     14.4322  35.7718     13.1754  14.2533    109.835     15.307      289.835     
1 1 1 16 15 75 o 1  57.6863 5.75123 65.4713     16.2028  68.789      16.113   36.4993    1.16676     2.7938      1.16676     
1 1 1 16 15 76 o 8  33.6158 7.58268 28.8194     14.3768  22.3049     14.6529  16.1937    350.967     5.14919     170.967     
1 1 1 16 15 77 o 3  33.9795 7.54884 37.0714     14.9874  15.2907     15.8351  18.1228    245.676     0.668205    65.6764     
1 1 1 16 15 78 o 4  27.7577 7.42331 -4.2343     16.5524  29.9013     16.072   10.3092    9.93815     6.69932     189.938     
1 1 1 16 15 79 o 6  20.5813 6.58163 4.81693     12.6872  -10.3678    17.899   1.35032    154.933     13.6259     334.933     
1 1 1 16 15 80 o 4  20.7089 6.49821 7.38929     14.0782  -3.73544    13.1159  1.52083    29.2919     4.18647     209.292     
1 1 1 16 15 81 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 16 16 0  f 0  675.967 10.5423 8136.59     356.734  8136.59     356.734  408.837    180         0           0           
1 1 1 16 16 1  o 4  528.189 5.35782 4955.21     141.755  4955.21     141.755  438.717    210         98.3484     210         
1 1 1 16 16 2  f 0  283.643 3.56907 1427.99     50.6964  1427.99     50.6964  147.672    60          0           0           
1 1 1 16 16 3  o 12 174.308 2.82512 539.455     24.649   539.455     24.649   190.577    270         125.037     270         
1 1 1 16 16 4  o 13 195.45  2.88611 678.092     28.2411  678.092     28.2411  162.14     120         36.1078     120         
1 1 1 16 16 5  o 13 248.113 3.18921 1092.53     39.625   1092.53     39.625   241.096    330         116.464     330         
1 1 1 16 16 6  o 10 511.703 5.20551 4650.4      133.426  4650.4      133.426  414.923    180         75.8066     180         
1 1 1 16 16 7  o 3  410.582 4.40275 2992.75     90.544   2992.75     90.544   450.165    210         295.519     210         
1 1 1 16 16 8  o 19 109.494 2.54755 213.2       13.9446  213.2       13.9446  86.7791    60          17.0821     60          
1 1 1 16 16 9  o 17 42.275  3.73722 33.1478     7.58335  33.1478     7.58335  47.6582    90          146.043     90          
1 1 1 16 16 10 o 14 347.305 3.89775 2141        67.8014  2141        67.8014  290.1      120         69.3207     120         
1 1 1 16 16 11 o 16 57.9003 3.07873 60.4383     8.81439  60.4383     8.81439  4.11925    330         8.17171     150         
1 1 1 16 16 12 o 18 153.879 2.58897 420.447     19.9393  420.447     19.9393  56.3234    180         113.431     8.64367e-06 
1 1 1 16 16 13 o 7  166.885 2.64538 494.445     22.099   494.445     22.099   116.535    210         11.9436     30          
1 1 1 16 16 14 o 4  204.948 3.10837 745.763     31.8923  745.763     31.8923  114.442    240         71.793      60          
1 1 1 16 16 15 o 6  135.492 2.87413 326.34      19.4757  326.34      19.4757  130.563    270         100.437     270         
1 1 1 16 16 16 o 18 91.4456 2.65947 148.991     12.1406  148.991     12.1406  11.7373    120         6.785       120         
1 1 1 16 16 17 o 16 596.126 5.65967 6314.84     169.01   6314.84     169.01   522.882    150         173.442     150         
1 1 1 16 16 18 o 1  104.374 2.63675 193.859     13.7519  193.859     13.7519  11.4236    180         129.655     8.80704e-06 
1 1 1 16 16 19 o 12 80.6028 2.74275 115.974     11.0202  115.974     11.0202  37.3313    30          192.161     30          
1 1 1 16 16 20 o 14 148.446 2.88599 391.58      21.4329  391.58      21.4329  31.4135    240         153.732     60          
1 1 1 16 16 21 o 17 291.49  3.3508  1507.98     48.9186  1507.98     48.9186  168.294    90          88.1661     270         
1 1 1 16 16 22 o 11 558.696 5.36163 5546.46     150.056  5546.46     150.056  489.079    300         165.002     300         
1 1 1 16 16 23 o 9  177.065 2.709   556.609     24.0128  556.609     24.0128  179.273    330         101.341     330         
1 1 1 16 16 24 o 13 376.031 4.12075 2510.69     77.6115  2510.69     77.6115  278.162    180         10.4173     180         
1 1 1 16 16 25 o 2  164.562 2.80756 480.974     23.1232  480.974     23.1232  101.787    30          35.0057     210         
1 1 1 16 16 26 o 7  112.123 2.78061 223.716     15.5805  223.716     15.5805  48.2716    240         65.6578     60          
1 1 1 16 16 27 o 11 165.459 2.84213 486.276     23.5351  486.276     23.5351  47.994     90          143.205     270         
1 1 1 16 16 28 o 9  157.292 2.90157 439.595     22.8366  439.595     22.8366  176.245    300         129.169     300         
1 1 1 16 16 29 o 6  113.662 3.11689 230.147     17.6933  230.147     17.6933  73.1896    330         17.074      150         
1 1 1 16 16 30 o 1  166.284 3.00166 491.322     24.9765  491.322     24.9765  154.601    180         69.9747     180         
1 1 1 16 16 31 o 7  57.0403 3.27395 58.8442     9.21224  58.8442     9.21224  8.18929    210         94.3279     210         
1 1 1 16 16 32 o 11 79.0708 2.87392 111.758     11.3191  111.758     11.3191  53.7449    60          24.9713     60          
1 1 1 16 16 33 o 8  445.153 4.4987  3522.04     100.313  3522.04     100.313  361.635    270         86.1132     270         
1 1 1 16 16 34 o 8  144.455 2.71685 370.871     19.6365  370.871     19.6365  101.994    300         2.39123     120         
1 1 1 16 16 35 o 4  87.7673 2.91517 137.547     12.7574  137.547     12.7574  71.8981    330         20.7046     330         
1 1 1 16 16 36 o 6  167.983 2.58129 501.185     21.7069  501.185     21.7069  110.84     2.29857e-06 17.3854     180         
1 1 1 16 16 37 o 12 25.4985 6.29541 15.1308     7.2755   15.1308     7.2755   52.3483    210         134.653     210         
1 1 1 16 16 38 o 19 163.355 2.5766  474.074     21.0694  474.074     21.0694  137.524    240         43.5159     240         
1 1 1 16 16 39 o 15 166.961 2.56923 495.235     21.4741  495.235     21.4741  144.213    270         52.2885     270         
1 1 1 16 16 40 o 13 12.4833 5.47239 1.91902     6.82125  1.91902     6.82125  20.0685    120         43.3415     120         
1 1 1 16 16 41 o 4  286.694 3.18593 1460.73     45.7481  1460.73     45.7481  208.302    330         12.913      330         
1 1 1 16 16 42 o 16 185.365 2.61052 610.537     24.2285  610.537     24.2285  122.423    360         15.5665     180         
1 1 1 16 16 43 o 11 52.9706 3.45006 51.1212     8.97018  51.1212     8.97018  31.5307    210         5.71431     210         
1 1 1 16 16 44 o 9  64.1904 3.00547 74.1516     9.56947  74.1516     9.56947  15.7425    60          58.1609     240         
1 1 1 16 16 45 o 3  108.504 2.51775 209.694     13.657   209.694     13.657   93.6028    90          35.8814     90          
1 1 1 16 16 46 o 14 16.2457 6.1522  6.78618     6.86158  6.78618     6.86158  4.679      120         11.2918     120         
1 1 1 16 16 47 f 0  36.8749 4.68263 26.461      7.82388  26.461      7.82388  27.7211    330         0           0           
1 1 1 16 16 48 o 7  178.811 2.53842 568.652     22.726   568.652     22.726   171.047    1.02201e-11 94.6096     1.02201e-11 
1 1 1 16 16 49 o 17 67.2655 3.11226 81.521      10.3868  81.521      10.3868  63.6296    210         39.2667     210         
1 1 1 16 16 50 o 12 38.9162 4.66448 29.2651     8.3124   29.2651     8.3124   17.9801    240         6.30894     240         
1 1 1 16 16 51 o 1  15.604  6.20209 5.92581     7.34563  5.92581     7.34563  1.68172    90.0001     5.70718     90.0001     
1 1 1 16 16 52 o 9  21.4521 6.87508 12.0758     7.97117  12.0758     7.97117  8.44456    300         42.1537     300         
1 1 1 16 16 53 o 2  122.809 2.72966 269.209     16.762   269.209     16.762   84.4349    330         1.25073     330         
1 1 1 16 16 54 o 1  18.0072 6.37116 8.67185     7.02484  8.67185     7.02484  4.54077    180         23.0664     180         
1 1 1 16 16 55 o 8  118.176 2.48769 249.178     14.7032  249.178     14.7032  97.6521    210         34.9695     210         
1 1 1 16 16 56 o 11 26.4937 6.83108 16.934      8.35085  16.934      8.35085  2.67078    240         28.2394     60          
1 1 1 16 16 57 o 11 22.7808 6.74662 13.3069     7.72355  13.3069     7.72355  4.32135    270         6.46977     90          
1 1 1 16 16 58 o 16 52.1467 3.77002 50.2205     9.59638  50.2205     9.59638  33.4263    300         3.2227      120         
1 1 1 16 16 59 o 13 59.704  3.67992 65.3039     10.8097  65.3039     10.8097  32.9066    150         14.1755     330         
1 1 1 16 16 60 o 2  13.8    5.86723 3.67679     7.32599  3.67679     7.32599  8.00142    180         26.3589     180         
1 1 1 16 16 61 o 1  26.5957 7.53838 18.0146     9.75563  18.0146     9.75563  10.5108    210         11.01       30          
1 1 1 16 16 62 o 2  82.4778 3.44197 123.241     14.1122  123.241     14.1122  64.6502    60          19.9032     60          
1 1 1 16 16 63 o 11 26.6869 7.59518 18.3012     9.89029  18.3012     9.89029  13.6665    90          4.94915     90          
1 1 1 16 16 64 o 5  72.2239 3.76222 95.5071     13.4435  95.5071     13.4435  51.7247    120         8.31762     120         
1 1 1 16 16 65 o 1  10.4692 5.11469 -6.48646    9.06802  -6.48646    9.06802  3.90769    330         12.032      330         
1 1 1 16 16 66 o 17 60.641  4.13213 68.5251     12.2722  68.5251     12.2722  43.6459    1.35019e-06 7.98864     1.35019e-06 
1 1 1 16 16 67 o 10 59.3402 4.24772 65.9899     12.3112  65.9899     12.3112  20.3646    210         36.588      30          
1 1 1 16 16 68 o 17 20.3088 7.57477 11.7913     10.2689  11.7913     10.2689  2.61046    60          0.701905    240         
1 1 1 16 16 69 o 11 28.16   8.55946 21.8933     12.3789  21.8933     12.3789  11.4184    90          12.5151     270         
1 1 1 16 16 70 o 2  36.912  8.26178 32.6971     13.4372  32.6971     13.4372  18.8791    120         9.61195     300         
1 1 1 16 16 71 o 7  10.193  5.13722 -15.1724    11.5816  -15.1724    11.5816  2.20338    330         6.01967     330         
1 1 1 16 16 72 o 11 16.545  7.46264 3.40661     13.7098  3.40661     13.7098  0.7119     9.1675e-06  3.93186     180         
1 1 1 16 16 73 o 17 41.5018 8.46209 40.2417     15.2627  40.2417     15.2627  28.2843    210         3.79241     210         
1 1 1 16 16 74 o 7  14.5327 6.82696 -1.4527     13.2534  -1.4527     13.2534  5.85929    60          27.3012     60          
1 1 1 16 16 75 o 15 28.8094 9.15017 24.2813     14.1145  24.2813     14.1145  10.5955    90          14.8255     270         
1 1 1 16 16 76 o 12 16.6251 7.40997 4.91494     13.0599  4.91494     13.0599  1.18495    120         8.88515     300         
1 1 1 16 16 77 o 19 21.9136 8.76431 15.2106     14.7875  15.2106     14.7875  4.71601    330         1.76957     150         
1 1 1 16 16 78 o 13 25.7988 9.43865 22.1459     15.7202  22.1459     15.7202  9.57168    180         7.54846     8.65142e-06 
1 1 1 16 16 79 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 0  0  o 9  803.598 8.59035 11453.1     345.769  11453.1     345.769  632.025    180         98.083      180         
1 1 1 17 0  1  o 15 491.791 3.97218 4287.5      97.8685  4287.5      97.8685  432.402    60          151.267     60          
1 1 1 17 0  2  o 19 131.664 2.16434 307.658     14.2633  307.658     14.2633  17.2301    120         128.327     300         
1 1 1 17 0  3  o 9  286.389 3.00955 1454.28     43.172   1454.28     43.172   280.087    360         150.915     360         
1 1 1 17 0  4  o 16 857.674 6.35705 13042.2     273.168  13042.2     273.168  600.77     240         42.3381     60          
1 1 1 17 0  5  o 14 471.053 3.81019 3933.49     89.9185  3933.49     89.9185  119.909    300         113.99      300         
1 1 1 17 0  6  o 3  412.963 3.57237 3023.29     73.9064  3023.29     73.9064  176.489    0.000153694 164.76      0.000153694 
1 1 1 17 0  7  o 18 521.53  4.44199 4822.11     116.058  4822.11     116.058  482.015    60          208.349     60          
1 1 1 17 0  8  o 6  280.164 3.07333 1391.84     43.1267  1391.84     43.1267  204.24     120         3.18949     120         
1 1 1 17 0  9  o 16 270.035 3.02149 1293.05     40.8654  1293.05     40.8654  264.021    8.12439e-06 152.327     8.12439e-06 
1 1 1 17 0  10 o 17 846.833 7.40768 12718       314.261  12718       314.261  675.676    60          126.044     60          
1 1 1 17 0  11 o 10 325.146 3.28645 1874.47     53.5261  1874.47     53.5261  357.052    300         264.37      300         
1 1 1 17 0  12 o 16 159.525 2.67086 451.678     21.325   451.678     21.325   28.1533    8.57054e-07 164.313     180         
1 1 1 17 0  13 f 0  566.351 5.18557 5687.38     147.122  5687.38     147.122  335.558    60          0           0           
1 1 1 17 0  14 o 19 1357.79 11.5276 32719.5     784.133  32719.5     784.133  1077.77    300         196.115     300         
1 1 1 17 0  15 o 3  303.347 3.10701 1631.58     47.2103  1631.58     47.2103  219.514    7.29505e-06 1.98666     7.29509e-06 
1 1 1 17 0  16 o 17 565.51  4.98121 5670.28     141.118  5670.28     141.118  526.682    240         238.632     240         
1 1 1 17 0  17 o 11 338.078 3.20154 2026.41     54.2202  2026.41     54.2202  174.242    300         138.136     120         
1 1 1 17 0  18 o 19 499.547 4.44144 4424.5      111.149  4424.5      111.149  159.538    180         399.273     360         
1 1 1 17 0  19 o 12 35.7811 3.18628 23.7438     5.46777  23.7438     5.46777  151.381    240         318.942     240         
1 1 1 17 0  20 o 6  212.094 2.59183 797.8       27.5298  797.8       27.5298  102.778    120         92.5152     300         
1 1 1 17 0  21 o 11 395.226 3.89886 2769.74     77.1885  2769.74     77.1885  309.518    180         52.5449     180         
1 1 1 17 0  22 o 2  828.523 7.24358 12176.2     300.655  12176.2     300.655  629.924    240         73.6889     240         
1 1 1 17 0  23 o 7  886.556 7.38846 13942.1     328.159  13942.1     328.159  715.297    120         162.928     120         
1 1 1 17 0  24 o 1  438.411 4.03426 3408.02     88.6013  3408.02     88.6013  329.333    360         32.6065     360         
1 1 1 17 0  25 o 14 284.287 2.92372 1433.06     41.6338  1433.06     41.6338  127.109    60          151.196     240         
1 1 1 17 0  26 o 4  304.731 3.12783 1646.63     47.7435  1646.63     47.7435  222.899    120         11.8545     120         
1 1 1 17 0  27 o 14 1091.38 8.96174 21143.7     490.001  21143.7     490.001  844.856    180         137.776     180         
1 1 1 17 0  28 o 13 40.4041 2.89237 29.8081     5.70787  29.8081     5.70787  56.7054    60          129.569     60          
1 1 1 17 0  29 o 2  539.949 4.46635 5169.91     120.818  5169.91     120.818  434.791    300         104.151     300         
1 1 1 17 0  30 o 9  220.645 2.55407 863.411     28.2245  863.411     28.2245  130.812    360         50.5661     180         
1 1 1 17 0  31 o 14 188.644 2.40927 631.232     22.7598  631.232     22.7598  75.0113    60          116.416     240         
1 1 1 17 0  32 o 10 359.612 3.41827 2293.27     61.5778  2293.27     61.5778  155.864    300         195.486     120         
1 1 1 17 0  33 o 13 87.451  2.22632 136.048     9.72819  136.048     9.72819  0.447365   180         103.443     360         
1 1 1 17 0  34 o 3  790.24  6.56795 11084.2     260.024  11084.2     260.024  616.812    60          123.089     60          
1 1 1 17 0  35 o 3  455.178 4.00429 3674.67     91.3096  3674.67     91.3096  350.928    300         63.4071     300         
1 1 1 17 0  36 o 3  42.1606 2.85847 32.3629     5.90385  32.3629     5.90385  66.4735    180         163.996     180         
1 1 1 17 0  37 o 2  222.102 2.68845 875.03      29.9039  875.03      29.9039  161.356    240         12.4679     240         
1 1 1 17 0  38 o 15 261.066 3.25585 1209.23     42.5667  1209.23     42.5667  247.295    120         130.696     120         
1 1 1 17 0  39 o 13 297.117 3.29879 1566        49.0909  1566        49.0909  176.038    1.83027e-06 61.2738     180         
1 1 1 17 0  40 o 1  334.094 3.37873 1979.9      56.5435  1979.9      56.5435  220.385    60          23.0106     240         
1 1 1 17 0  41 o 3  280.551 3.17194 1396.3      44.5705  1396.3      44.5705  204.375    120         20.1674     120         
1 1 1 17 0  42 o 19 49.5093 2.9393  44.3598     7.1701   44.3598     7.1701   0.226653   180         2.14007     180         
1 1 1 17 0  43 o 18 316.608 3.29303 1778.24     52.2236  1778.24     52.2236  205.581    240         25.329      60          
1 1 1 17 0  44 o 5  38.4062 3.43434 27.3784     6.32281  27.3784     6.32281  25.0335    300         73.6936     300         
1 1 1 17 0  45 o 18 352.718 3.66562 2207.47     64.7626  2207.47     64.7626  260.395    3.44731e-06 36.8752     3.44731e-06 
1 1 1 17 0  46 o 15 49.4071 3.05074 44.2558     7.4154   44.2558     7.4154   8.39228    60          48.0459     60          
1 1 1 17 0  47 f 0  39.7893 3.88888 29.6403     7.33268  29.6403     7.33268  6.90494    300         0           0           
1 1 1 17 0  48 o 17 169.759 2.62594 511.568     22.3156  511.568     22.3156  147.828    5.40152e-08 64.831      5.40152e-08 
1 1 1 17 0  49 f 0  347.55  3.79595 2143.86     66.0793  2143.86     66.0793  242.684    60          0           0           
1 1 1 17 0  50 o 12 136.292 2.48436 329.923     16.9431  329.923     16.9431  122.159    300         64.9662     300         
1 1 1 17 0  51 o 13 322.493 3.28733 1845.36     53.1033  1845.36     53.1033  303.33     360         171.199     360         
1 1 1 17 0  52 o 17 41.8179 3.58426 32.3544     7.21805  32.3544     7.21805  38.4484    240         120.394     240         
1 1 1 17 0  53 o 10 181.71  2.57734 586.068     23.4486  586.068     23.4486  108.932    120         26.0919     300         
1 1 1 17 0  54 o 9  56.7982 2.67827 57.9568     7.54444  57.9568     7.54444  11.4228    360         26.5425     180         
1 1 1 17 0  55 o 16 20.7829 6.48101 11.0435     7.08204  11.0435     7.08204  54.2804    60          123.188     60          
1 1 1 17 0  56 o 5  101.493 2.98247 183.647     15.1099  183.647     15.1099  42.1922    300         50.6222     120         
1 1 1 17 0  57 o 17 62.5335 3.45777 70.6567     10.6793  70.6567     10.6793  31.6474    180         3.52317     180         
1 1 1 17 0  58 o 4  49.1585 3.69172 44.3313     8.83687  44.3313     8.83687  6.55624    60          2.73511     240         
1 1 1 17 0  59 o 10 496.261 4.92308 4384.14     122.381  4384.14     122.381  369.459    300         84.9194     300         
1 1 1 17 0  60 o 11 143.229 2.9245  364.981     20.9518  364.981     20.9518  96.5144    1.18658e-06 4.89491     1.18658e-06 
1 1 1 17 0  61 o 12 86.149  2.83227 132.576     12.1673  132.576     12.1673  72.3277    240         34.7514     240         
1 1 1 17 0  62 o 16 161.508 2.80798 463.913     22.6963  463.913     22.6963  141.852    300         72.984      300         
1 1 1 17 0  63 o 19 51.604  3.51497 48.6397     8.88375  48.6397     8.88375  16.9171    180         29.5925     8.76117e-06 
1 1 1 17 0  64 f 0  15.01   5.78419 5.67381     6.16723  5.67381     6.16723  25.0473    240         0           0           
1 1 1 17 0  65 o 11 114.856 2.64125 235.031     15.1663  235.031     15.1663  106.687    300         65.1923     300         
1 1 1 17 0  66 o 10 38.4062 4.35662 28.2308     7.73883  28.2308     7.73883  11.0724    360         20.1939     180         
1 1 1 17 0  67 o 7  139.504 2.69125 346.631     18.7832  346.631     18.7832  70.4743    240         37.8454     60          
1 1 1 17 0  68 o 14 154.853 2.39795 426.628     18.5887  426.628     18.5887  95.799     120         6.1286      300         
1 1 1 17 0  69 o 3  27.4349 6.10021 16.9565     7.36422  16.9565     7.36422  6.40002    180         12.6619     360         
1 1 1 17 0  70 o 2  51.7449 2.60856 48.3451     6.68388  48.3451     6.68388  28.857     240         22.9651     240         
1 1 1 17 0  71 o 1  44.2249 4.60133 37.2491     9.55162  37.2491     9.55162  33.3251    120         19.1281     120         
1 1 1 17 0  72 o 2  48.2392 4.45406 43.8061     10.26    43.8061     10.26    31.7565    180         3.20402     180         
1 1 1 17 0  73 o 1  63.7776 4.01749 74.5965     12.5952  74.5965     12.5952  47.3274    60          14.8042     60          
1 1 1 17 0  74 o 1  93.364  3.19323 156.728     14.8606  156.728     14.8606  78.8834    120         41.3275     120         
1 1 1 17 0  75 o 13 11.9161 5.52727 -0.982845   8.26267  -0.982845   8.26267  1.49895    180         4.18808     180         
1 1 1 17 0  76 f 0  9.36271 4.60976 -6.87342    7.7439   -6.87342    7.7439   20.8704    240         0           0           
1 1 1 17 0  77 o 4  74.307  3.69819 100.596     13.6119  100.596     13.6119  52.8456    300         14.1719     300         
1 1 1 17 0  78 f 0  50.9452 4.65693 49.2634     11.3432  49.2634     11.3432  35.0472    180         0           0           
1 1 1 17 0  79 o 8  14.2747 6.27674 2.9953      9.04177  2.9953      9.04177  0.571418   240         4.60008     240         
1 1 1 17 0  80 o 16 11.656  5.49046 -2.07169    8.67079  -2.07169    8.67079  5.34643    120         16.8995     120         
1 1 1 17 0  81 o 9  37.4015 6.75632 30.3697     10.9464  30.3697     10.9464  17.9289    180         9.29987     360         
1 1 1 17 0  82 o 19 80.9954 3.70467 120.053     14.8911  120.053     14.8911  65.314     60          33.039      60          
1 1 1 17 0  83 o 9  14.9817 6.73328 2.43891     11.0422  2.43891     11.0422  2.52218    120         11.9718     120         
1 1 1 17 0  84 o 15 48.3088 7.19823 49.0942     15.3388  49.0942     15.3388  32.8074    360         8.01815     360         
1 1 1 17 0  85 o 5  39.5651 8.46522 36.7738     14.6391  36.7738     14.6391  20.7919    240         5.34812     60          
1 1 1 17 0  86 o 12 24.1298 8.71002 17.2079     13.2727  17.2079     13.2727  1.93751    300         0.58112     300         
1 1 1 17 0  87 o 6  12.9332 6.40189 -12.9402    15.5048  -12.9402    15.5048  6.67093    180         23.7679     180         
1 1 1 17 0  88 o 14 20.4449 8.83734 10.5531     17.2116  10.5531     17.2116  0.592081   240         0.484131    60.0003     
1 1 1 17 0  89 o 8  13.5406 6.65768 -10.3441    16.0063  -10.3441    16.0063  0.160211   120         0.590926    120         
1 1 1 17 0  90 o 19 22.6952 9.47664 16.2538     18.4743  16.2538     18.4743  3.23737    360         7.36815     180         
1 1 1 17 0  91 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 1  0  o 1  711.209 5.60166 8967.91     199.596  8967.91     199.596  520.07     8.82023e-06 7.58228     8.82028e-06 
1 1 1 17 1  1  o 18 1257.95 10.0199 28170.9     631.668  28003.7     631.663  793.401    310.819     234.039     130.819     
1 1 1 17 1  2  o 19 521.328 4.64713 4817        116.653  4817.58     125.989  254.748    18.4111     235.878     198.411     
1 1 1 17 1  3  o 15 687.545 5.87259 8410.71     210.011  8350.8      194.432  653.554    205.144     326.387     205.144     
1 1 1 17 1  4  o 14 540.712 4.66556 5175.46     124.056  5188.92     128.754  424.391    15.6469     80.5965     15.6469     
1 1 1 17 1  5  o 8  208.035 2.40332 774.282     25.4896  759.539     24.6212  111.164    111.025     38.3501     291.025     
1 1 1 17 1  6  o 7  702.3   5.64096 8705.3      201.905  8782.63     195.072  611.666    31.4008     219.336     31.4008     
1 1 1 17 1  7  o 16 885.115 7.01918 13894.6     316.665  13891.4     305.94   700.308    214.788     127.392     214.788     
1 1 1 17 1  8  o 19 264.893 2.60825 1280.54     35.2235  1206.79     34.0273  146.53     57.0613     61.8782     237.061     
1 1 1 17 1  9  o 10 589.781 4.97214 6117.92     152.065  6213.92     141.575  387.44     216.859     66.4565     36.8589     
1 1 1 17 1  10 o 9  560.509 5.01056 5512.04     143.487  5626.38     137.877  570.023    273.074     356.87      273.074     
1 1 1 17 1  11 o 11 932.584 7.99001 15232       394.832  15625.5     350.036  697.089    51.6793     54.1537     51.6794     
1 1 1 17 1  12 o 14 454.428 4.70911 3676.21     112.507  3644.65     101.752  361.48     322.246     88.57       322.246     
1 1 1 17 1  13 o 11 781.636 7.10518 10718.9     278.274  10953.1     278.337  540.267    184.472     38.2106     4.47177     
1 1 1 17 1  14 o 7  1166.49 9.82937 24290.1     586.019  24022       563.066  872.537    46.6964     68.5612     46.6964     
1 1 1 17 1  15 o 15 616.827 5.54662 6813.47     171.439  6678.05     171.46   480.645    305.213     87.7433     305.213     
1 1 1 17 1  16 o 4  120.882 2.39022 254.385     14.0969  263.933     14.8346  4.04972    192.204     65.3174     12.2044     
1 1 1 17 1  17 o 7  1066.08 8.8619  20298.6     454.739  20045.8     491.213  840.735    330.68      155.753     330.68      
1 1 1 17 1  18 o 1  157.315 2.40487 432.441     18.5516  444.695     19.367   20.2528    309.505     1.67118     129.505     
1 1 1 17 1  19 o 17 562.608 4.80502 5619.88     132.926  5602.87     137.97   478.047    1.7416      167.738     1.7416      
1 1 1 17 1  20 o 11 284.434 2.93674 1422.78     41.8415  1444.75     41.8785  233.41     353.082     110.255     353.082     
1 1 1 17 1  21 o 11 572.483 5.11426 5770.64     143.765  5851.3      149.663  410.242    26.0851     13.5403     26.0851     
1 1 1 17 1  22 o 1  120.486 2.28076 260.111     13.4473  254.769     14.0563  14.8367    64.4307     66.6349     244.431     
1 1 1 17 1  23 o 7  905.471 7.69892 14579       342.271  14526.5     356.268  711.08     234.696     135.097     234.696     
1 1 1 17 1  24 o 9  1130.06 9.71514 22444.5     550.108  22949.2     550.214  885.113    157.851     161.702     157.851     
1 1 1 17 1  25 o 9  155.018 2.44478 428.254     18.9894  423.476     18.9951  45.9066    46.1315     98.7373     226.132     
1 1 1 17 1  26 o 10 416.541 4.0364  3071        84.2577  3081.18     84.2586  196.677    292.521     190.439     112.521     
1 1 1 17 1  27 o 19 314.235 3.27354 1750.57     51.556   1750.04     51.5449  237.364    350.612     46.6325     350.612     
1 1 1 17 1  28 o 15 242.39  2.84965 1057        33.8498  1025.83     35.3366  145.487    82.2473     34.2172     262.247     
1 1 1 17 1  29 o 3  357.034 3.66672 2266.58     64.1565  2253.43     67.0167  241.514    154.17      10.814      334.17      
1 1 1 17 1  30 o 6  283.812 3.05663 1399.64     42.6118  1456.35     44.3414  144.781    217.417     100.231     37.4173     
1 1 1 17 1  31 o 13 171.977 2.45463 518.822     19.872   529.613     22.3877  117.577    172.676     23.113      172.676     
1 1 1 17 1  32 o 17 303.998 3.02536 1645.89     45.2231  1630.72     46.9326  125.355    97.5282     169.543     277.528     
1 1 1 17 1  33 o 3  204.189 2.49141 735.376     25.0267  742.667     25.957   111.319    190.247     48.7261     10.2472     
1 1 1 17 1  34 o 13 273.528 2.86696 1314.06     38.572   1338.75     40.024   175.165    202.466     21.3741     22.4663     
1 1 1 17 1  35 o 19 259.177 2.86631 1175.06     35.7745  1206.84     38.6609  208.549    351.825     71.8527     351.825     
1 1 1 17 1  36 o 17 382.143 3.47259 2600.1      65.2589  2579.68     67.7136  305.158    340.816     86.2449     340.816     
1 1 1 17 1  37 o 8  367.253 3.47927 2364.82     64.0318  2419.53     64.0306  290.783    349.994     79.3076     349.994     
1 1 1 17 1  38 o 3  475.243 4.51406 4067.97     105.151  3949.97     109.732  420.837    291.378     187.742     291.378     
1 1 1 17 1  39 o 19 687.581 5.9524  8495.35     213.595  8311.88     196.421  452.879    165.877     47.6783     345.877     
1 1 1 17 1  40 o 17 490.254 4.5242  4363.22     111.171  4171.45     111.096  393.042    300.289     110.832     300.289     
1 1 1 17 1  41 o 19 291.222 3.23106 1462.54     48.1004  1546.55     46.1053  245.385    225.227     96.3798     225.227     
1 1 1 17 1  42 o 3  164.711 2.48945 483.241     20.5906  478.765     20.5069  129.938    158.548     49.358      158.548     
1 1 1 17 1  43 o 6  363.425 3.84238 2332.11     71.6317  2355.93     68.2697  265.039    317.348     34.5744     317.348     
1 1 1 17 1  44 o 18 198.696 2.76931 691.718     28.2409  708.612     26.8732  118.013    356.872     28.0888     176.872     
1 1 1 17 1  45 o 18 215.619 2.99457 848.517     33.24    801.109     31.4825  176.746    167.089     70.4156     167.089     
1 1 1 17 1  46 o 7  245.802 3.29036 1056.33     40.5061  1087.76     40.5505  159.456    38.6273     9.73873     218.627     
1 1 1 17 1  47 o 2  202.468 3.06122 729.429     28.3886  725.024     33.5049  139.085    172.945     12.138      172.945     
1 1 1 17 1  48 o 18 106.528 2.5367  209.985     12.785   193.141     14.1497  53.7542    103.981     18.0814     283.981     
1 1 1 17 1  49 o 6  153.766 2.57554 424.378     18.8452  414.566     20.7593  49.3081    195.67      101.776     15.6703     
1 1 1 17 1  50 o 10 368.266 3.73812 2400.69     65.7499  2415.21     72.0984  298.342    157.636     103.951     157.636     
1 1 1 17 1  51 o 6  232.579 3.01268 959.565     33.2704  960.055     36.8666  204.411    187.541     106.478     187.541     
1 1 1 17 1  52 o 7  186.449 2.72755 609.63      25.4271  623.849     25.5425  160.598    91.8388     84.718      91.8388     
1 1 1 17 1  53 o 18 156.488 2.60529 460.741     19.8867  409.175     20.8352  66.5471    150.604     69.8696     330.604     
1 1 1 17 1  54 o 17 275.092 3.0334  1358.8      42.7329  1328.12     40.9007  190.08     71.4868     16.6348     71.4868     
1 1 1 17 1  55 o 11 121.943 2.426   278.047     14.3871  250.385     15.1527  59.6428    337.711     35.7509     157.711     
1 1 1 17 1  56 o 8  311.582 3.32833 1765.99     53.2574  1684.6      50.6913  204.109    275.506     3.41854     95.506      
1 1 1 17 1  57 o 11 207.468 2.98768 759.594     32.5741  769.726     29.4512  170.204    3.44322     71.4232     3.44323     
1 1 1 17 1  58 o 10 35.8417 4.82632 14.5695     8.3461   34.2224     8.16581  6.0922     252.545     37.1172     252.545     
1 1 1 17 1  59 o 2  326.427 3.70236 1908.62     60.5717  1886.41     60.5576  220.516    134.458     13.2423     134.458     
1 1 1 17 1  60 o 15 147.546 2.80682 392.6       21.3243  381.961     20.1422  107.673    36.5094     27.8655     36.5094     
1 1 1 17 1  61 o 10 274.464 3.32902 1365.92     45.857   1317.73     45.7125  205.494    44.8815     54.551      44.8815     
1 1 1 17 1  62 o 2  113.583 2.65632 237.765     15.3843  221.77      14.8151  70.7027    189.047     0.52728     9.04663     
1 1 1 17 1  63 o 6  44.8809 3.85786 42.0397     8.32652  31.405      8.46854  7.09468    325.25      30.7942     145.25      
1 1 1 17 1  64 o 2  149.28  2.76225 398.005     20.6476  396.237     20.646   103.416    237.927     18.2823     237.927     
1 1 1 17 1  65 o 13 50.5051 3.69029 48.6265     9.73895  43.6678     8.67913  23.8267    125.584     6.7766      125.584     
1 1 1 17 1  66 f 0  56.0151 3.30729 52.9507     9.19838  60.0886     9.16614  43.8606    51.2681     0           0           
1 1 1 17 1  67 o 16 80.8468 2.75444 121.51      10.9063  112.298     11.3132  32.0951    29.7641     36.7128     209.764     
1 1 1 17 1  68 o 4  18.4781 5.00974 -0.890564   7.14143  7.44639     6.63846  5.39695    90.7894     21.4995     90.7894     
1 1 1 17 1  69 o 13 51.1604 2.9797  49.1123     7.89875  45.2154     7.24816  28.1815    178.081     3.00857     358.081     
1 1 1 17 1  70 o 17 163.638 2.72871 496.264     22.5718  461.733     22.173   123.614    326.817     41.7103     326.817     
1 1 1 17 1  71 o 2  31.9985 4.84904 17.2532     8.39682  21.4213     6.66432  8.84157    328.889     15.3521     148.889     
1 1 1 17 1  72 o 13 44.9092 4.01656 40.8241     9.82202  33.5563     7.87166  25.7419    36.0662     1.40578     36.0663     
1 1 1 17 1  73 o 3  28.66   5.93152 14.116      8.80056  17.2568     9.35116  1.02301    276.132     28.3742     96.132      
1 1 1 17 1  74 o 4  25.0953 5.95562 11.4245     8.597    11.1723     9.078    4.51861    129.69      12.2656     309.69      
1 1 1 17 1  75 o 1  33.3348 5.65091 13.2995     9.30045  30.3714     9.95567  3.64416    190.852     2.16937     190.852     
1 1 1 17 1  76 o 14 34.3286 5.93605 19.3267     9.69822  27.0787     10.6492  17.3434    130.854     1.35924     310.854     
1 1 1 17 1  77 o 8  77.5035 3.81032 117.901     14.8124  102.726     14.5604  55.4572    95.1923     17.8985     95.1923     
1 1 1 17 1  78 o 6  62.4136 4.44157 78.6378     12.5381  67.2557     14.489   34.5392    299.683     5.21415     119.683     
1 1 1 17 1  79 o 6  16.8833 5.29032 -2.52365    8.6252   -0.956886   9.13459  0.639453   94.7813     5.00774     274.781     
1 1 1 17 1  80 o 8  20.6423 5.70298 -4.78912    9.16345  12.1248     9.64703  2.41808    44.3316     12.7556     224.332     
1 1 1 17 1  81 o 8  29.25   6.15214 8.61855     10.0677  25.3663     10.6084  8.5044     295.038     13.4595     115.038     
1 1 1 17 1  82 o 1  60.1033 4.43191 60.1599     13.0402  77.3031     13.0543  32.924     234.827     3.85212     54.8272     
1 1 1 17 1  83 o 2  64.2041 4.96883 89.8638     17.2016  69.8329     14.2961  37.2048    72.4433     0.264815    72.4432     
1 1 1 17 1  84 o 6  38.6247 6.94684 31.6026     13.2525  31.5061     13.7018  16.8938    172.916     8.14872     352.916     
1 1 1 17 1  85 o 11 55.5236 7.68413 64.1784     24.5785  67.9839     15.8109  30.0339    16.7405     3.15085     196.741     
1 1 1 17 1  86 o 10 28.8086 7.6184  14.1826     17.1276  17.7305     13.0141  10.8568    166.566     6.51012     346.566     
1 1 1 17 1  87 o 12 45.909  8.22952 55.1819     19.4936  42.6426     18.5853  18.4469    183.232     14.1747     3.23159     
1 1 1 17 1  88 o 8  26.1601 7.82326 9.4614      17.6523  11.1965     17.695   5.82911    9.90197     12.205      189.902     
1 1 1 17 1  89 o 19 27.5818 8.03184 20.4077     17.8932  7.82879     18.6651  7.97301    198.125     2.12106     18.1252     
1 1 1 17 1  90 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 2  0  o 7  1314.85 10.4426 30673.7     687.898  30673.7     687.898  962.771    180         15.2799     180         
1 1 1 17 2  1  o 10 52.8051 2.38646 46.1898     6.11979  53.1563     6.43911  90.6956    318.878     209.122     318.878     
1 1 1 17 2  2  o 6  353.424 3.38019 2243.37     60.9824  2184.01     58.7554  169.635    241.477     155.766     61.4772     
1 1 1 17 2  3  o 13 925.063 7.42993 15151.7     344.44   15203.3     344.444  699.565    15.6959     64.844      15.6959     
1 1 1 17 2  4  o 3  1644.97 13.4905 48354.6     1112.12  47856.5     1112.08  1203.57    140.918     23.4178     140.918     
1 1 1 17 2  5  o 17 564.903 4.8498  5667.96     134.723  5645.22     139.811  338.372    154.114     130.604     334.114     
1 1 1 17 2  6  o 5  748.505 6.1871  9905.17     227.751  9962.6      236.358  588.201    156.425     102.459     156.425     
1 1 1 17 2  7  o 11 147.231 2.212   389.37      16.3104  378.882     16.3289  15.8556    100.785     135.632     280.785     
1 1 1 17 2  8  o 13 576.376 4.84509 5854.39     139.942  5923.26     139.952  372.681    36.6388     76.855      216.639     
1 1 1 17 2  9  o 11 729.85  6.10221 9459.58     227.295  9430.41     219.027  431.853    59.2729     184.212     239.273     
1 1 1 17 2  10 o 15 423.879 3.92321 3145.44     80.0933  3223.67     86.5281  272.518    218.533     49.4198     38.5331     
1 1 1 17 2  11 o 5  357.547 3.39877 2288.25     62.023   2243.07     59.7734  298.156    74.6299     114.17      74.6299     
1 1 1 17 2  12 o 5  219.099 2.51574 877.323     27.63    824.397     27.5964  68.4965    162.338     148.962     342.338     
1 1 1 17 2  13 o 16 497.267 4.7828  4361.63     126.675  4405.15     111.112  429.109    93.674      164.035     93.674      
1 1 1 17 2  14 o 6  415.077 3.8882  3060.61     82.4849  3046.66     79.2482  292.151    302.435     8.1534      302.435     
1 1 1 17 2  15 o 3  439.859 4.01752 3429.79     91.8951  3428.77     85.0932  213.558    44.4959     191.247     224.496     
1 1 1 17 2  16 o 17 802.868 6.89061 11454.4     282.729  11413.1     271.667  580.777    253.383     14.8024     253.383     
1 1 1 17 2  17 o 3  814.917 6.98591 11892.7     290.978  11668.6     279.591  637.153    146.201     111.588     146.201     
1 1 1 17 2  18 o 2  493.573 4.59508 4344.4      113.644  4293.07     113.671  338.643    15.0292     16.7105     195.029     
1 1 1 17 2  19 o 19 124.588 2.37483 283.044     14.7534  267.595     14.8625  18.0374    297.483     41.0647     117.483     
1 1 1 17 2  20 o 8  266.312 2.99894 1255.38     38.2847  1258.46     41.6944  42.2659    153.601     281.632     333.601     
1 1 1 17 2  21 o 6  125.266 2.30888 274.002     13.5303  282.372     15.4071  26.8996    240.389     35.6217     60.3885     
1 1 1 17 2  22 f 0  269.829 3.00533 1301.69     38.0712  1279.14     43.0107  180.719    283.047     0           0           
1 1 1 17 2  23 o 19 512.526 4.57788 4723.22     112.887  4592.42     121.957  382.804    356.742     44.2634     356.742     
1 1 1 17 2  24 o 14 738.976 6.22867 9712.86     221.571  9666.1      239.373  605.869    349.605     163.787     349.605     
1 1 1 17 2  25 o 11 113.606 2.2429  231.99      12.1664  225.83      13.3045  27.5601    116.783     50.4034     296.783     
1 1 1 17 2  26 o 5  643.355 5.5323  7392.5      171.304  7293.86     185.066  415.936    85.6955     78.5011     265.695     
1 1 1 17 2  27 o 10 399.234 3.82573 2853.9      74.9545  2798.07     78.0624  387.224    212.996     226.646     212.996     
1 1 1 17 2  28 o 19 614.794 5.62418 6611.24     169.449  6803.94     177.11   420.618    267.44      25.9245     87.4404     
1 1 1 17 2  29 o 17 195.491 2.61919 685.462     25.642   669.326     25.6747  121.242    304.795     12.7697     124.795     
1 1 1 17 2  30 o 2  292.763 3.2279  1516.69     46.3087  1522.34     48.389   206.179    281.604     11.2658     281.604     
1 1 1 17 2  31 o 10 416.057 4.2123  3053.84     83.7517  3086.97     91.7621  328.531    85.8215     78.7819     85.8215     
1 1 1 17 2  32 o 11 75.1771 2.50015 94.1997     8.78716  106.793     10.0076  4.97917    135.745     69.0428     135.745     
1 1 1 17 2  33 o 12 339.702 3.49647 2038.09     56.9905  2054.69     61.9714  214.367    355.161     40.2762     175.161     
1 1 1 17 2  34 o 15 118.757 2.33324 245.931     13.2958  254.456     14.442   51.8001    171.203     14.6448     171.203     
1 1 1 17 2  35 o 19 491.204 4.59912 4313.94     108.355  4250.64     117.799  399.472    236.484     117.74      236.484     
1 1 1 17 2  36 o 15 317.088 3.25626 1760.09     50.6892  1806.12     52.7979  250.86     220.328     70.1942     220.328     
1 1 1 17 2  37 o 6  357.74  3.70378 2202.25     67.7267  2339.22     64.9142  242.662    93.1908     6.73172     273.191     
1 1 1 17 2  38 o 3  301.131 3.4452  1611.03     50.7058  1605.78     53.2412  191.271    158.773     29.4224     338.773     
1 1 1 17 2  39 o 11 333.363 3.61666 1956.34     57.6401  1986.68     63.1157  274.61     9.38122     93.7755     9.38122     
1 1 1 17 2  40 o 17 148.647 2.72154 368.795     21.1685  415.795     19.1234  106.099    127.222     22.6194     127.222     
1 1 1 17 2  41 o 4  162.119 2.69438 449.275     21.8712  483.101     21.8885  62.968     126.066     90.0157     306.066     
1 1 1 17 2  42 o 16 212.895 2.77705 795.755     29.6663  811.781     29.5876  180.906    241.987     80.9175     241.987     
1 1 1 17 2  43 o 16 471.238 4.74492 3895.79     106.372  3994.43     117.581  355.535    147.865     65.1985     147.865     
1 1 1 17 2  44 o 4  262.937 3.03241 1216.26     39.9741  1236.45     39.9389  237.978    199.409     126.068     199.409     
1 1 1 17 2  45 o 9  372.919 3.82396 2415.23     71.4572  2522.64     71.4453  239.87     350.542     27.5577     170.542     
1 1 1 17 2  46 o 1  259.607 3.01553 1179.75     37.4082  1211.49     41.0152  163.956    193.993     20.6581     13.9927     
1 1 1 17 2  47 o 16 94.85   2.57847 163.755     11.6     155.861     12.8007  50.7042    14.8538     8.59033     14.8538     
1 1 1 17 2  48 o 13 357.66  3.80445 2232.78     68.1345  2310.01     68.2329  288.588    226.725     96.2759     226.725     
1 1 1 17 2  49 o 6  136.286 2.40101 340.452     16.3685  318.692     16.3997  77.8026    54.4541     16.2825     234.454     
1 1 1 17 2  50 o 2  91.9584 2.52833 153.118     11.371   147.325     11.8692  49.6908    196.989     14.6929     196.989     
1 1 1 17 2  51 o 13 185.613 2.61238 612.704     24.8044  609.547     23.7871  130.635    25.9568     20.4609     25.9568     
1 1 1 17 2  52 o 4  96.5356 2.51319 163.175     11.779   167.907     12.4938  53.7617    76.6313     31.3788     76.6313     
1 1 1 17 2  53 o 10 43.382  3.59688 34.7676     7.18006  33.0229     8.09427  15.1199    104.273     68.3936     104.273     
1 1 1 17 2  54 o 3  129.511 2.55288 297.835     15.7604  297.882     17.3087  90.4154    156.565     18.0829     156.565     
1 1 1 17 2  55 o 17 312.377 3.17087 1682.14     47.2802  1785.21     51.9916  216.161    23.7082     18.2652     23.7082     
1 1 1 17 2  56 o 19 92.574  2.7278  164.526     13.0137  140.795     12.2316  53.31      0.991155    5.39499     180.991     
1 1 1 17 2  57 o 18 156.332 2.80387 455.969     23.2636  413.345     20.6449  92.5013    235.757     17.108      55.757      
1 1 1 17 2  58 o 7  225.166 2.89664 957.112     34.4009  846.589     30.9983  174.282    52.7295     55.2165     52.7295     
1 1 1 17 2  59 o 17 76.1564 3.03028 105.014     11.4738  101.926     11.5595  21.1425    47.0553     50.6677     227.055     
1 1 1 17 2  60 o 17 30.4597 4.79166 18.5668     8.45577  15.9365     5.80041  2.84843    50.4642     16.7984     50.4642     
1 1 1 17 2  61 o 13 48.6525 4.10579 45.7006     8.73255  40.165      10.5907  3.11057    201.349     61.6292     201.349     
1 1 1 17 2  62 o 15 89.1185 2.85344 147.213     12.1004  136.245     13.2339  45.4834    239.722     18.4227     59.7221     
1 1 1 17 2  63 o 2  207.206 3.04433 770.488     30.8096  760.145     32.3829  130.965    183.902     4.68885     3.90177     
1 1 1 17 2  64 o 10 83.0254 2.78939 127.073     10.6559  119.146     12.3569  35.6333    136.76      30.6905     316.76      
1 1 1 17 2  65 o 18 104.598 2.63069 200.238     12.7314  190.1       14.6734  77.6848    147.169     25.7754     147.169     
1 1 1 17 2  66 o 15 89.2763 2.70542 142.646     11.2287  142.083     12.8618  46.833     134.93      18.2026     314.93      
1 1 1 17 2  67 o 15 112.611 2.20024 206.635     11.0981  246.061     13.7304  72.2946    23.5844     2.70993     23.5844     
1 1 1 17 2  68 o 15 102.862 2.68505 184.932     14.0378  193.478     13.5765  70.356     192.49      12.2188     192.49      
1 1 1 17 2  69 o 16 90.3944 2.98702 149.492     13.318   143.805     13.6565  53.2607    129.428     5.78541     309.428     
1 1 1 17 2  70 o 9  102.354 2.95348 198.323     14.8681  178.053     15.3045  68.1643    137.477     9.12274     137.477     
1 1 1 17 2  71 o 16 77.4551 2.92053 110.233     11.8749  105.526     10.7058  59.0279    2.90622     24.496      2.90622     
1 1 1 17 2  72 o 6  30.0395 4.88918 24.8004     8.23035  10.5296     6.54997  10.3244    317.39      7.563       137.39      
1 1 1 17 2  73 o 9  35.0003 4.63978 26.3548     8.70372  20.0524     7.00757  12.5895    95.7805     12.8733     275.781     
1 1 1 17 2  74 o 9  37.0305 4.55982 30.5187     9.13989  21.4656     7.21496  13.2147    168.964     15.1196     348.964     
1 1 1 17 2  75 o 9  42.1932 4.93532 34.5805     11.5492  32.7673     8.41018  27.4854    350.443     9.05748     350.443     
1 1 1 17 2  76 o 16 40.5164 5.28941 28.2118     10.2392  35.0587     10.4202  19.3236    304.799     7.66118     124.799     
1 1 1 17 2  77 f 0  46.2642 4.93043 38.0117     10.8949  43.5697     11.2368  30.729     278.464     0           0           
1 1 1 17 2  78 o 2  59.1871 4.13605 65.2454     11.929   65.3249     12.2833  40.8388    234.549     12.0739     234.549     
1 1 1 17 2  79 o 19 76.989  3.70383 120.178     14.0181  99.1263     14.2501  48.0039    224.736     3.85988     224.736     
1 1 1 17 2  80 o 2  34.1121 6.27952 19.2666     11.202   28.3511     10.7735  14.8506    86.3822     7.01157     266.382     
1 1 1 17 2  81 o 14 23.776  6.10586 3.10217     9.73324  15.3692     10.0589  3.62002    199.897     0.175059    19.8971     
1 1 1 17 2  82 o 19 35.452  6.66036 27.6468     12.1746  24.9875     11.9054  11.061     33.2587     16.3046     213.259     
1 1 1 17 2  83 o 15 58.9178 4.89733 63.7933     14.3506  70.1267     13.9492  38.2723    211.244     9.27073     211.244     
1 1 1 17 2  84 o 4  18.4115 5.75895 4.2371      10.7672  -11.2943    11.3068  1.63579    251.535     19.3484     251.535     
1 1 1 17 2  85 o 17 22.3997 6.45119 11.9663     11.8094  -2.72808    12.2179  5.79502    147.867     7.1345      327.867     
1 1 1 17 2  86 o 5  18.5681 6.07859 -14.442     15.777   -2.27383    11.7087  1.62375    1.64134     10.0994     181.641     
1 1 1 17 2  87 o 9  23.2676 6.90761 -5.82703    16.7948  12.26       12.6865  6.01794    357.26      3.24423     177.26      
1 1 1 17 2  88 o 16 24.0878 7.51654 -0.997258   17.6626  9.60393     18.1176  5.25081    219.835     6.08774     39.8353     
1 1 1 17 2  89 o 19 23.7508 7.77183 -2.7254     17.0995  3.26073     25.8256  1.54761    264.996     1.31412     84.9962     
1 1 1 17 2  90 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 3  0  o 9  676.593 5.50207 8116.6      186.503  8116.6      186.503  486.385    4.54349e-06 10.9514     180         
1 1 1 17 3  1  o 18 697.461 5.94292 8663.31     207.724  8586.89     207.716  585.644    71.0996     172.371     71.0996     
1 1 1 17 3  2  o 19 409.986 3.72196 2992.39     75.0408  2965.69     77.8629  183.648    179.829     212.876     359.829     
1 1 1 17 3  3  o 1  821.62  6.57345 11986.7     270.658  11955.6     270.663  617.387    247.06      51.5585     247.06      
1 1 1 17 3  4  o 5  816.482 6.84224 11781.4     290.483  11864.3     268.956  626.411    332.152     77.7033     332.152     
1 1 1 17 3  5  o 16 335.211 3.22581 1998.28     53.1631  1984.4      55.1901  180.734    204.897     102.887     24.897      
1 1 1 17 3  6  o 2  741.584 6.06812 9702.5      229.62   9800.4      221.286  467.208    24.7249     132.113     204.725     
1 1 1 17 3  7  o 18 172.96  2.34916 536.809     19.9779  523.428     20.727   8.78419    54.5107     200.521     234.511     
1 1 1 17 3  8  o 9  144.622 2.26183 374.549     16.6904  366.718     16.0949  3.75942    75.953      173.896     75.953      
1 1 1 17 3  9  o 1  888.976 7.43451 14009       331.208  14028.8     331.211  509.709    234.903     261.75      54.903      
1 1 1 17 3  10 o 11 486.102 4.29643 4217.85     106.595  4159.05     102.72   393.269    196.427     104.826     196.427     
1 1 1 17 3  11 o 7  1256.97 10.1744 28032.1     628.912  28086.6     652.698  978.571    202.888     143.694     202.888     
1 1 1 17 3  12 o 11 44.9667 2.94057 41.4775     6.26272  31.1802     6.65294  72.9354    28.4845     159.387     28.4845     
1 1 1 17 3  13 o 6  233.104 2.79317 963.513     34.514   962.345     30.6312  55.8911    269.849     199.284     89.8493     
1 1 1 17 3  14 f 0  579.845 5.14679 6004.5      146.51   5917.7      152.496  507.501    133.769     0           0           
1 1 1 17 3  15 o 15 897.992 7.3568  14191.7     324.912  14423.4     337.2    643.405    338.86      1.4377      158.859     
1 1 1 17 3  16 o 18 413.626 3.6771  3040.4      76.2174  3024.41     76.2241  367.301    67.1649     166.492     67.1649     
1 1 1 17 3  17 o 17 276.425 2.84706 1361.04     40.1639  1347.29     38.7089  189.719    107.769     12.6589     107.769     
1 1 1 17 3  18 f 0  315.581 3.1749  1790.1      51.2162  1740.24     49.2071  213.85     157.624     0           0           
1 1 1 17 3  19 o 4  365.551 3.59891 2403.01     69.8271  2334.35     61.8972  338.737    111.461     183.277     111.461     
1 1 1 17 3  20 o 7  189.5   2.50968 641.623     24.7346  631.18      22.9113  103.671    22.0903     27.7945     202.09      
1 1 1 17 3  21 f 0  209.053 2.6181  778.73      27.9639  770.322     26.888   206.128    100.682     0           0           
1 1 1 17 3  22 o 17 536.021 4.8153  5069.34     131.877  5120.92     126.742  340.941    145.168     77.8833     325.168     
1 1 1 17 3  23 o 15 500.705 4.6614  4503.05     111.894  4388.95     121.691  336.373    144.977     34.7326     324.978     
1 1 1 17 3  24 o 5  458.845 4.38966 3785.66     98.6555  3681.4      103.095  267.247    82.6726     112.852     262.673     
1 1 1 17 3  25 o 3  594.102 5.31658 6235.2      151.536  6288.12     164.818  389.676    240.885     62.2744     60.8855     
1 1 1 17 3  26 o 19 479.764 4.5017  4148.28     103.525  4016.63     112.586  388.089    244.274     102.584     244.274     
1 1 1 17 3  27 o 2  142.055 2.41936 376.799     16.0024  339.24      18.203   73.2175    250.745     34.5812     250.745     
1 1 1 17 3  28 o 8  478.447 4.24093 4006.14     97.7064  4113.96     105.601  397.015    105.252     123.405     105.252     
1 1 1 17 3  29 o 4  347.145 3.43817 2128.65     57.234   2144.74     62.3035  317.231    143.359     157.744     143.359     
1 1 1 17 3  30 o 18 150.599 2.4495  417.177     17.5593  387.106     19.2895  59.3449    83.2813     74.9243     263.281     
1 1 1 17 3  31 o 12 465.671 4.1674  3852.34     97.218   3841.04     97.2886  375.516    15.3412     100.942     15.3413     
1 1 1 17 3  32 o 17 562.014 4.95801 5503.86     136.793  5709.92     142.501  340.046    181.186     108.679     1.1857      
1 1 1 17 3  33 o 11 167.712 2.37156 502.444     19.8395  494.724     20.0225  40.3604    83.6494     142.059     263.649     
1 1 1 17 3  34 o 18 158.68  2.24067 435.717     17.4262  457.03      18.2124  74.4094    298.75      55.0456     118.75      
1 1 1 17 3  35 o 13 145.255 2.3814  373.702     16.2584  374.327     18.35    81.8043    193.754     53.4796     193.754     
1 1 1 17 3  36 o 2  190.541 2.67093 658.706     24.3435  628.811     26.5548  160.304    343.356     80.0035     343.356     
1 1 1 17 3  37 f 0  175.634 2.70281 538.315     23.2785  555.606     24.3013  155.995    305.239     0           0           
1 1 1 17 3  38 o 19 119.617 2.68657 258.226     14.7905  249.706     17.2381  47.8928    92.027      55.329      272.027     
1 1 1 17 3  39 o 6  154.935 2.69036 410.972     20.3602  440.561     21.4226  104.838    73.2119     7.89426     73.2119     
1 1 1 17 3  40 o 7  40.0919 3.47076 27.0003     6.5368   30.9505     7.12236  10.2022    137.119     33.703      137.119     
1 1 1 17 3  41 o 15 169.644 2.77425 488.808     23.4869  532.362     23.6589  80.3608    3.43581     65.3753     183.436     
1 1 1 17 3  42 o 13 155.387 2.60048 415.043     19.6954  441.45      20.8095  126.061    46.7783     57.6493     46.7783     
1 1 1 17 3  43 o 5  103.887 2.49245 182.6       12.9316  200.798     12.9625  63.3293    357.276     18.8038     357.276     
1 1 1 17 3  44 o 10 84.0973 2.67663 118.923     11.4894  132.62      10.9511  32.2316    34.4675     4.19393     34.4675     
1 1 1 17 3  45 o 4  23.7521 4.49665 16.7631     6.08411  3.03672     6.08104  24.3996    106.825     54.8637     106.825     
1 1 1 17 3  46 o 11 79.6977 2.66881 117.049     10.6296  108.833     10.6176  24.8819    57.2803     1.68924     57.2802     
1 1 1 17 3  47 o 18 183.982 2.52608 586.834     23.2471  613.912     23.3272  117.271    321.726     6.61753     141.726     
1 1 1 17 3  48 o 11 239.024 2.90435 989.29      33.9883  1038.11     35.5962  194.188    28.4571     72.4516     28.4571     
1 1 1 17 3  49 o 12 119.274 2.48604 257.438     14.4591  247.66      15.1999  86.3884    77.3718     36.1106     77.3718     
1 1 1 17 3  50 o 11 34.5819 4.18413 19.9429     6.60707  23.8348     7.38286  2.87068    174.127     8.57228     174.127     
1 1 1 17 3  51 o 11 271.158 3.14323 1270.27     42.6287  1340.41     42.7777  146.537    174.532     69.07       354.532     
1 1 1 17 3  52 o 4  136.217 2.49739 346.166     16.5925  312.852     17.4013  86.1974    134.877     0.734681    314.877     
1 1 1 17 3  53 f 0  165.214 2.60356 484.209     21.96    484.516     21.1446  88.8573    269.553     0           0           
1 1 1 17 3  54 f 0  121.38  2.55996 264.444     15.4741  258.962     15.6313  80.0592    277.017     0           0           
1 1 1 17 3  55 o 12 176.201 2.5592  551.926     23.0819  550.273     22.1051  108.384    177.548     13.5938     357.548     
1 1 1 17 3  56 o 15 112.255 2.58227 220.103     15.1988  227.878     13.7498  65.0838    80.8638     11.3831     260.864     
1 1 1 17 3  57 o 10 103.253 2.69278 205.379     14.375   174.513     13.4355  49.7994    286.62      30.3334     106.62      
1 1 1 17 3  58 o 18 18.3692 4.89102 2.92349     6.46534  5.59301     5.9122   31.0326    271.501     72.4021     271.501     
1 1 1 17 3  59 o 9  94.9104 2.7008  171.525     13.0005  149.61      12.6166  65.7826    259.571     16.6361     259.571     
1 1 1 17 3  60 o 18 91.9083 2.69989 163.228     13.3896  138.238     11.4482  49.7638    187.855     14.1835     7.85548     
1 1 1 17 3  61 f 0  88.6363 2.84305 139.005     11.7662  141.251     13.3836  14.3871    22.5151     0           0           
1 1 1 17 3  62 o 17 56.4749 2.9979  65.2339     8.10888  49.5988     8.53463  23.7587    104.048     13.3363     284.048     
1 1 1 17 3  63 o 4  156.85  2.47252 461.226     19.3247  414.881     19.4947  96.8985    174.957     6.70618     354.957     
1 1 1 17 3  64 o 13 158.118 2.96944 459.286     22.1222  433.148     24.7396  111.075    0.415187    20.3382     0.415187    
1 1 1 17 3  65 o 15 96.6492 2.88144 177.538     13.929   156.692     13.8814  51.6106    291.264     18.5169     111.264     
1 1 1 17 3  66 o 15 52.9259 3.92096 59.5877     9.33696  42.8315     10.591   29.9645    325.705     2.06377     145.705     
1 1 1 17 3  67 o 15 21.6657 5.2011  11.3389     6.95966  3.67898     7.12109  4.01234    157.662     25.2725     157.662     
1 1 1 17 3  68 o 2  138.893 2.71447 350.905     18.4178  339.134     19.3035  88.3186    351.049     0.848144    351.049     
1 1 1 17 3  69 o 19 76.2479 3.05607 106.522     11.3468  102.633     11.8915  37.18      218.377     20.0048     38.3768     
1 1 1 17 3  70 o 9  39.8617 4.47026 23.8624     8.33685  35.8706     8.75441  11.4533    354.969     22.9776     174.969     
1 1 1 17 3  71 o 17 71.4775 3.19921 92.8211     10.859   91.6552     11.9079  42.5324    206.057     2.09905     26.0568     
1 1 1 17 3  72 o 7  59.0465 3.48189 66.7708     9.94758  59.9926     10.4103  29.6989    48.2093     11.6316     228.209     
1 1 1 17 3  73 o 16 58.2938 3.4835  60.8734     10.6931  62.7644     9.39355  22.7559    328.86      24.9039     148.86      
1 1 1 17 3  74 o 1  23.8188 5.48915 13.1443     8.46705  7.79083     6.64861  5.45424    338.978     7.96705     158.978     
1 1 1 17 3  75 o 3  101.087 2.9796  181.01      15.3552  188.032     14.7436  75.6224    140.329     27.4641     140.329     
1 1 1 17 3  76 o 11 41.1016 4.51488 39.5597     9.91467  25.0386     8.06503  20.6362    236.536     5.97444     56.5359     
1 1 1 17 3  77 o 3  59.8995 3.46305 73.2728     11.1847  58.7761     9.44913  39.0304    87.5915     6.8812      87.5914     
1 1 1 17 3  78 f 0  59.4678 3.9306  65.4885     11.7553  65.9528     11.3956  27.4273    56.4771     0           0           
1 1 1 17 3  79 o 10 23.4512 6.38647 6.86005     9.41214  10.5626     11.7512  1.11595    60.0475     21.6495     240.048     
1 1 1 17 3  80 o 2  29.8356 6.5127  25.2259     10.1415  6.74578     14.2286  13.8985    324.982     4.16848     324.982     
1 1 1 17 3  81 f 0  17.5675 5.59511 -3.01869    8.98625  -2.46909    11.6132  10.303     32.9052     0           0           
1 1 1 17 3  82 o 6  20.7181 6.263   3.68262     10.499   0.921607    12.6882  2.17949    285.876     8.84198     105.876     
1 1 1 17 3  83 o 19 56.3004 5.5488  60.9558     14.1559  64.1637     16.2535  27.7009    359.63      9.713       179.63      
1 1 1 17 3  84 o 6  30.1401 7.00876 28.5972     12.506   1.70258     16.4786  14.3865    163.435     0.704954    343.435     
1 1 1 17 3  85 o 16 22.9233 7.05211 -5.92288    15.1103  9.27874     15.8558  6.20788    288.217     1.35771     108.218     
1 1 1 17 3  86 o 5  21.3472 6.87528 -6.38664    16.4019  -0.549879   16.1019  4.43806    265         2.86771     84.9995     
1 1 1 17 3  87 o 16 19.1629 6.33494 3.38982     16.2262  -28.9352    15.2876  1.44348    358.166     5.04242     178.166     
1 1 1 17 3  88 o 10 27.9406 8.07646 21.1761     17.7662  9.01391     18.8933  8.2687     0.377696    6.69412     180.378     
1 1 1 17 3  89 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 4  0  o 6  365.406 3.50596 2367.37     64.1745  2367.37     64.1745  187.564    180         156.586     9.51982e-06 
1 1 1 17 4  1  o 9  631.737 5.46061 7101.16     172.876  7050.47     172.876  505.758    290.764     108.934     290.765     
1 1 1 17 4  2  o 10 1148.04 9.13442 23456.2     525.53   23334.8     525.526  873.334    12.7143     84.6766     12.7143     
1 1 1 17 4  3  o 10 763.459 6.33693 10325.5     237.926  10347.6     246.903  582.924    84.4862     68.048      84.4862     
1 1 1 17 4  4  o 18 511.563 4.36247 4647.57     111.835  4629.9      111.842  301.48     124.41      125.488     304.411     
1 1 1 17 4  5  o 12 919.916 7.5272  15090       353.409  14936.4     340.551  797.306    9.54514     269.591     9.54514     
1 1 1 17 4  6  o 2  796.304 6.52504 11222.1     255.527  11269.9     265.181  533.62     237.187     79.3901     57.1869     
1 1 1 17 4  7  o 18 970.291 7.93842 16729       393.097  16681.8     378.807  723.595    8.492       47.0499     8.49198     
1 1 1 17 4  8  o 9  486.985 4.28756 4203.19     106.553  4204.29     102.685  216.117    30.0295     261.414     210.03      
1 1 1 17 4  9  o 12 257.501 2.78461 1168.01     35.2584  1182.1      36.6039  157.47     329.869     21.2765     149.869     
1 1 1 17 4  10 o 8  572.704 4.89884 5792.4      143.165  5837.2      137.964  342.656    193.342     132.631     13.3421     
1 1 1 17 4  11 o 1  598.118 5.02042 6318.03     150.476  6367.21     150.488  531.652    270.526     215.058     270.526     
1 1 1 17 4  12 o 5  781.173 6.60689 10689.1     248.589  10960.5     268.535  528.265    316.634     65.8248     136.634     
1 1 1 17 4  13 o 11 189.728 2.57185 640.819     25.4453  634.997     23.4286  67.777     71.1194     103.891     251.119     
1 1 1 17 4  14 o 19 797.785 6.59478 11251.1     268.474  11330.1     258.722  526.83     13.5603     92.2168     193.56      
1 1 1 17 4  15 o 17 472.024 4.26101 3953.07     96.8411  3946.51     104.592  439.439    137.201     220.128     137.201     
1 1 1 17 4  16 o 11 574.516 4.82253 5853.4      138.839  5851.26     138.856  434.86     240.446     52.4936     240.446     
1 1 1 17 4  17 o 2  169.421 2.36737 505.767     20.4469  511.569     19.7423  4.86255    196.377     233.07      196.378     
1 1 1 17 4  18 o 1  141.08  2.15653 352.292     15.2213  353.128     15.2725  58.0682    240.632     19.4        60.6325     
1 1 1 17 4  19 o 14 338.182 3.22279 2041.54     54.6091  2012.76     54.6265  222.27     253.387     26.1394     73.3874     
1 1 1 17 4  20 o 9  82.1825 2.35073 119.825     9.97184  119.951     9.34025  33.1155    310.919     142.415     310.919     
1 1 1 17 4  21 o 1  230.987 2.65576 944.419     31.2987  946.811     30.1743  110.402    350.914     92.8682     170.914     
1 1 1 17 4  22 o 6  586.902 5.01012 6085.13     150.036  6134.09     144.606  473.21     329.421     113.461     329.421     
1 1 1 17 4  23 o 10 550.199 4.68437 5375.7      131.525  5362.12     126.759  463.806    262.631     149.206     262.631     
1 1 1 17 4  24 o 10 361.088 3.54104 2300.99     65.3374  2322.13     62.779   296.959    112.254     92.3391     112.254     
1 1 1 17 4  25 f 0  461.035 4.16861 3779.18     99.9477  3759.59     92.5551  288.525    53.3125     0           0           
1 1 1 17 4  26 o 9  429.704 4.02327 3261.56     84.8669  3287.35     88.3861  324.916    112.543     46.1828     112.543     
1 1 1 17 4  27 o 11 156.767 2.54532 482.888     18.9023  391.023     20.6761  81.3144    77.7074     37.8272     257.707     
1 1 1 17 4  28 o 4  421.542 3.92707 3053.18     79.4431  3251.37     86.4874  344.476    303.99      99.2048     303.99      
1 1 1 17 4  29 o 13 37.8269 3.41134 24.9913     5.89796  26.5854     6.73316  55.7992    217.002     131.762     217.002     
1 1 1 17 4  30 o 19 235.297 2.87119 1028.48     32.2796  935.672     35.177   171.029    161.321     25.7195     161.321     
1 1 1 17 4  31 o 1  466.874 4.30229 3858.25     94.3928  3876.63     106.586  337.456    322.926     21.198      322.925     
1 1 1 17 4  32 o 9  323.619 3.34923 1875.74     51.9312  1838.87     56.5549  153.53     21.5868     142.417     201.587     
1 1 1 17 4  33 o 10 75.3285 2.51219 107.676     9.22272  94.1822     9.62575  0.283246   33.8328     58.5148     33.833      
1 1 1 17 4  34 o 6  134.988 2.53698 325.221     17.8405  321.308     16.4323  28.22      284.272     118.423     104.272     
1 1 1 17 4  35 o 9  481.626 4.61282 4096.96     111.293  4138.82     111.377  450.679    166.003     232.848     166.003     
1 1 1 17 4  36 o 1  360.985 3.85855 2306.63     71.414   2317.55     68.1455  301.695    233.22      105.442     233.22      
1 1 1 17 4  37 o 13 347.375 3.68223 2143.42     61.1021  2138.4      66.96    301.612    4.72452     125.073     4.72452     
1 1 1 17 4  38 o 9  255.033 3.01624 1138.08     38.4646  1169.05     38.6321  105.755    62.3492     139.613     242.349     
1 1 1 17 4  39 o 13 126.889 2.35542 286.135     14.5271  285.154     15.3888  35.6228    188.258     95.2858     8.25793     
1 1 1 17 4  40 o 9  414.517 4.06211 3053.79     78.692   3046.49     89.6984  280.512    355.546     11.4545     175.545     
1 1 1 17 4  41 o 18 149.093 2.64852 376.543     18.3011  412.498     21.2512  66.4       178.989     63.7243     358.989     
1 1 1 17 4  42 o 10 308.238 3.25476 1687.41     48.1377  1683.86     52.3233  221.59     259.744     22.8113     259.744     
1 1 1 17 4  43 f 0  341.124 3.53459 2083.46     59.1087  2046.88     61.6858  300.571    170.724     0           0           
1 1 1 17 4  44 o 17 310.136 3.52368 1674.79     53.4746  1739.64     56.0606  213.65     161.373     5.87855     161.373     
1 1 1 17 4  45 o 16 335.441 3.5521  1969        60.9778  2025.59     58.3717  231.993    147.088     8.25471     147.088     
1 1 1 17 4  46 o 19 165.902 2.5526  494.004     20.7898  482.286     21.6343  106.352    48.4697     3.04807     228.47      
1 1 1 17 4  47 o 3  54.4068 3.00789 52.0026     7.81297  53.6804     8.45456  1.56059    21.7213     23.9981     201.721     
1 1 1 17 4  48 o 8  181.133 2.77574 584.434     22.7453  579.624     27.4102  79.0259    21.8884     81.9451     201.888     
1 1 1 17 4  49 o 18 143.083 2.72704 379.216     18.5204  347.808     20.4072  109.175    310.527     40.359      310.527     
1 1 1 17 4  50 o 19 79.9409 2.84727 117.962     11.129   109.483     11.5765  24.948     33.585      41.598      213.585     
1 1 1 17 4  51 o 7  161.13  2.66601 461.121     21.4636  460.237     21.5917  117.422    319.647     26.895      319.647     
1 1 1 17 4  52 o 3  115.279 2.58056 248.919     14.8062  223.52      14.9325  78.3591    223.555     13.8406     223.555     
1 1 1 17 4  53 o 11 402.225 4.16616 2866.77     81.9898  2890.91     85.9347  255.768    151.919     27.6394     331.919     
1 1 1 17 4  54 o 3  95.4894 2.57095 150.768     11.8271  173.819     12.7349  36.8657    332.235     46.5216     152.235     
1 1 1 17 4  55 o 14 274.111 3.02809 1316.43     39.868   1353.96     43.2957  180.143    359.196     3.26283     179.196     
1 1 1 17 4  56 o 18 168.912 2.51154 486.955     21.616   526.69      20.8415  132.319    11.139      45.9952     11.139      
1 1 1 17 4  57 o 16 160.337 2.54455 452.898     20.8075  460.412     20.0704  97.6962    352.597     13.0004     172.597     
1 1 1 17 4  58 o 19 63.7686 2.99532 72.8102     9.99368  72.4872     9.01729  33.7125    259.34      0.594704    79.3405     
1 1 1 17 4  59 f 0  119.196 2.58108 263.356     15.7699  242.457     15.0313  118.328    90.1186     0           0           
1 1 1 17 4  60 o 8  149.456 2.66195 403.864     21.8975  391.176     17.8023  102.853    242.695     13.8322     242.695     
1 1 1 17 4  61 o 13 156.919 2.61273 455.379     22.0897  421.265     18.9815  114.992    320.911     29.0089     320.911     
1 1 1 17 4  62 o 5  142.956 2.37718 387.145     17.6444  340.601     16.4203  71.6957    301.342     39.915      121.342     
1 1 1 17 4  63 o 8  85.9502 2.50921 143.263     11.3157  120.682     10.2588  37.12      347.557     33.0009     167.557     
1 1 1 17 4  64 o 4  44.7977 3.31775 37.9907     7.81893  34.5725     6.8578   21.5357    173.165     3.90809     353.165     
1 1 1 17 4  65 o 11 111.284 2.25906 225.172     12.9672  216.125     12.2038  72.0091    112.78      2.65974     112.78      
1 1 1 17 4  66 o 3  26.8553 5.17536 6.71286     8.2379   19.3116     7.1595   4.38126    322.201     12.0765     142.201     
1 1 1 17 4  67 o 3  33.5273 5.18719 20.2662     8.70148  22.28       8.24643  5.33733    88.7551     1.89354     88.7551     
1 1 1 17 4  68 o 15 172.337 2.83074 525.157     24.2882  537.966     24.6074  124.112    174.981     29.243      174.981     
1 1 1 17 4  69 o 6  35.606  5.48073 27.7829     8.22525  20.4706     10.7797  10.8613    17.6171     17.4917     197.617     
1 1 1 17 4  70 o 12 135.328 2.99046 319.158     18.6373  339.035     21.8269  87.4826    159.074     4.73257     159.074     
1 1 1 17 4  71 o 18 23.5875 5.96481 8.37713     7.54247  10.1001     10.3191  1.68131    340.973     26.1289     340.973     
1 1 1 17 4  72 o 10 38.92   5.36933 31.747      8.60025  26.0474     11.3631  6.71304    130.652     31.9393     310.652     
1 1 1 17 4  73 o 15 37.2424 5.12646 24.5127     8.55931  28.4904     9.8995   17.9757    25.2376     5.00455     205.238     
1 1 1 17 4  74 o 14 19.4062 5.44164 -0.247558   7.43211  8.0163      8.72842  0.26823    327.218     14.8559     147.218     
1 1 1 17 4  75 o 15 47.4261 4.17057 49.6005     9.47858  34.7591     9.58402  24.8593    216.835     6.21079     36.8346     
1 1 1 17 4  76 o 4  32.9818 5.18141 17.9551     8.44061  24.5645     8.29594  19.5097    100.064     6.23839     100.064     
1 1 1 17 4  77 o 7  70.7006 3.44347 88.4977     12.4077  94.9195     11.7977  48.6712    201.63      12.3741     201.63      
1 1 1 17 4  78 o 8  18.5901 5.31905 -4.69673    8.63937  8.0103      8.03303  2.11231    251.316     5.90928     71.3164     
1 1 1 17 4  79 o 8  76.4685 3.82192 100.968     14.2619  116.493     14.8161  44.4348    332.711     2.86918     152.711     
1 1 1 17 4  80 o 8  53.661  4.75005 59.0516     12.2052  51.5429     12.6676  31.2712    187.586     0.389395    187.586     
1 1 1 17 4  81 o 2  23.0793 6.40211 10.5506     10.7737  5.01619     11.0672  3.19127    184.364     13.6404     4.3639      
1 1 1 17 4  82 o 9  23.4122 6.18926 -2.66595    10.7067  16.9927     10.9969  6.03945    219.506     4.06126     39.5065     
1 1 1 17 4  83 o 13 60.3729 4.97631 70.5353     14.8177  70.4203     14.7301  29.0763    195.127     12.4269     15.1274     
1 1 1 17 4  84 o 2  57.438  5.73669 79.6011     14.7483  53.0154     16.2219  39.4375    36.7156     13.3225     36.7156     
1 1 1 17 4  85 o 12 20.622  6.59579 1.97835     16.449   -5.81441    12.3666  3.96472    59.9282     7.58721     239.928     
1 1 1 17 4  86 f 0  53.1523 7.148   65.7841     20.2023  58.0793     16.4482  30.1535    211.205     0           0           
1 1 1 17 4  87 o 12 27.1987 7.5242  6.27804     17.6066  20.3819     14.017   8.25732    86.5656     0.112633    266.566     
1 1 1 17 4  88 o 14 32.8656 7.97482 45.3965     18.5347  -0.359422   19.9737  13.9234    168.9       2.07355     168.9       
1 1 1 17 4  89 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 5  0  o 8  231.379 2.73184 949.439     31.6568  949.439     31.6568  195.808    180         101.023     180         
1 1 1 17 5  1  o 8  703.498 5.97496 8752.66     210.639  8800.67     210.656  513.914    159.52      15.6551     159.52      
1 1 1 17 5  2  o 12 444.51  3.91371 3501.58     87.1821  3502.91     87.1835  379.951    111.65      138.376     111.65      
1 1 1 17 5  3  o 10 354.907 3.34069 2223.81     59.4171  2240.96     59.4165  301.301    31.7142     120.639     31.7142     
1 1 1 17 5  4  o 18 724.944 5.94429 9323.13     215.953  9316.85     215.958  608.556    86.8627     175.729     86.8627     
1 1 1 17 5  5  o 9  531.109 4.49172 5027.68     119.551  4973.28     119.55   345.816    157.535     66.8559     337.535     
1 1 1 17 5  6  o 7  218.997 2.60326 863.297     29.0977  836.619     28.0448  141.182    118.709     15.407      118.709     
1 1 1 17 5  7  o 8  788.98  6.65924 10944.2     253.044  11140.8     273.33   600.696    213.594     64.6021     213.594     
1 1 1 17 5  8  o 8  636.697 5.48912 7218.67     181.786  7158.33     168.297  444.674    325.702     24.2885     145.702     
1 1 1 17 5  9  o 6  389.406 3.59758 2698.62     68.8863  2676.76     71.4898  257.951    325.084     30.7401     145.084     
1 1 1 17 5  10 f 0  26.2088 4.03755 14.4215     5.19734  10.9484     5.12588  60.5479    326.307     0           0           
1 1 1 17 5  11 o 6  366.8   3.46032 2393.86     64.7709  2375.48     62.4302  354.045    144.476     213.618     144.476     
1 1 1 17 5  12 o 6  163.087 2.32756 478.064     18.6375  464.65      19.3877  25.5276    162.902     156.193     342.902     
1 1 1 17 5  13 o 16 351.46  3.63127 2174.65     65.3409  2204.45     62.5227  223.455    211.476     44.5977     31.4759     
1 1 1 17 5  14 o 18 557.857 4.91077 5531.07     142.476  5505.65     131.92   438.647    144.529     81.9774     144.529     
1 1 1 17 5  15 o 10 813.429 6.84497 11784.2     268.028  11700.9     289.536  666.967    5.90889     165.169     5.90889     
1 1 1 17 5  16 o 1  533.932 4.61124 5041.39     121.08   5068.66     125.66   377.905    217.282     5.74051     37.2822     
1 1 1 17 5  17 o 1  289.283 2.89963 1500.33     42.0227  1466.18     42.0458  192.557    83.4501     14.0064     263.45      
1 1 1 17 5  18 o 9  716.602 5.85174 9101.26     210.133  9120.65     210.161  505.184    0.896793    16.9351     180.897     
1 1 1 17 5  19 o 6  306.214 3.13732 1664.15     48.1344  1659.95     48.1538  157.944    205.308     112.388     25.3079     
1 1 1 17 5  20 o 16 121.601 2.16142 264.822     13.1483  259.457     13.1825  38.2507    242.265     56.5418     62.2652     
1 1 1 17 5  21 o 19 461.993 4.10767 3746.47     96.8027  3823.07     93.3277  290.797    244.894     74.1699     64.894      
1 1 1 17 5  22 o 19 524.864 4.54956 4858.43     117.43   4913.62     121.886  420.363    224.796     96.0425     224.796     
1 1 1 17 5  23 o 8  357.121 3.46976 2230.51     64.3916  2291.9      59.6395  184.276    85.2232     134.77      265.223     
1 1 1 17 5  24 f 0  500.014 4.46384 4443.41     116.08   4425.91     107.479  372.115    331.482     0           0           
1 1 1 17 5  25 o 16 59.3818 2.51696 60.4003     7.55711  65.094      7.33563  56.9149    40.2607     171.421     40.2607     
1 1 1 17 5  26 o 11 433.002 3.94849 3319.35     85.668   3331.08     85.6925  405.478    326.262     204.863     326.262     
1 1 1 17 5  27 o 9  57.1592 2.52583 52.9588     7.28907  63.5632     7.03393  25.7725    17.6802     88.2565     17.6802     
1 1 1 17 5  28 o 8  118.469 2.25482 255.362     13.5871  242.604     13.1632  49.867     149.767     35.6388     329.767     
1 1 1 17 5  29 o 8  396.877 3.79141 2771.59     76.8797  2816.1      73.8785  291.215    211.223     27.1221     211.224     
1 1 1 17 5  30 o 16 374.542 3.84507 2492.38     68.7826  2484.48     75.3973  307.998    95.2478     95.5265     95.2478     
1 1 1 17 5  31 o 7  206.053 2.85845 763.317     28.7524  742.314     30.2373  116.296    155.982     44.1979     335.982     
1 1 1 17 5  32 o 2  239.773 3.1134  1017.61     35.4381  1021.35     39.2904  144.832    290.002     37.2477     110.002     
1 1 1 17 5  33 o 5  136.919 2.64841 337.745     17.1049  327.523     19.1146  46.9636    2.74032     83.1536     182.74      
1 1 1 17 5  34 o 7  96.0488 2.73506 176.287     12.5236  151.84      13.5922  40.9995    150.532     10.2067     330.532     
1 1 1 17 5  35 o 4  424.812 4.44346 3289.39     94.5131  3119        94.6278  303.358    10.5464     14.2284     10.5464     
1 1 1 17 5  36 o 1  104.445 2.56527 191.716     12.83    195.579     13.9691  64.8575    137.448     18.4355     137.448     
1 1 1 17 5  37 o 1  208.05  2.86006 792.007     28.992   743.571     30.5551  194.365    282.377     114.089     282.377     
1 1 1 17 5  38 f 0  354.459 3.55536 2191.67     64.4118  2267.19     61.8139  228.645    285.489     0           0           
1 1 1 17 5  39 o 1  90.7958 2.37056 149.657     10.64    143.1       10.8846  44.6136    345.797     7.15564     165.796     
1 1 1 17 5  40 o 10 528.735 4.69404 4915.87     121.864  5017.85     126.884  398.828    183.31      64.9428     183.31      
1 1 1 17 5  41 o 4  195.744 2.68631 659.467     25.5988  699.845     27.1101  127.791    78.9103     6.38647     258.91      
1 1 1 17 5  42 o 6  208.359 2.71249 766.322     26.9877  773.601     29.6096  131.181    116.472     17.6324     296.472     
1 1 1 17 5  43 f 0  277.558 3.19495 1349.31     42.2497  1384.57     46.5757  185.253    290.319     0           0           
1 1 1 17 5  44 o 10 204.661 2.9285  744.759     27.7424  741.341     32.156   137.958    9.64786     3.08836     9.64787     
1 1 1 17 5  45 o 7  141.37  2.7019  360.566     18.1387  348.963     20.0275  89.7804    345.664     0.5556      165.664     
1 1 1 17 5  46 f 0  159.434 2.90086 454.087     21.3313  448.187     24.839   95.7829    34.2662     0           0           
1 1 1 17 5  47 o 13 194.823 2.85447 663.466     27.2497  683.387     28.4889  124.07     225.153     10.0499     45.1534     
1 1 1 17 5  48 o 2  282.589 3.33763 1388.98     46.1568  1446.51     48.3804  211.406    211.13      43.2298     211.13      
1 1 1 17 5  49 o 11 37.5215 4.31252 22.2522     7.81362  29.3178     7.74337  9.60451    150.821     34.349      150.821     
1 1 1 17 5  50 o 5  287.335 3.0541  1451.96     43.0826  1479.39     44.8684  190.966    222.099     3.96151     42.0996     
1 1 1 17 5  51 o 2  109.03  2.50802 211.844     12.7379  210.451     14.5644  64.6087    134.794     7.13321     314.794     
1 1 1 17 5  52 f 0  151.313 2.38383 408.925     17.3456  403.57      18.7691  104.062    328.741     0           0           
1 1 1 17 5  53 o 1  225.777 2.62511 881.091     28.5494  929.092     30.8556  151.33     308.957     2.73471     308.957     
1 1 1 17 5  54 f 0  90.3815 2.5414  139.069     10.9338  151.584     12.0473  63.2799    125.297     0           0           
1 1 1 17 5  55 o 9  150.896 2.45048 405.316     17.3653  403.247     19.6208  115.159    188.7       35.5261     188.7       
1 1 1 17 5  56 o 7  83.376  2.60248 117.587     10.6717  130.034     11.0164  57.6683    194.071     19.2617     194.071     
1 1 1 17 5  57 o 12 86.1711 2.46169 122.82      10.2207  141.776     10.9969  32.332     167.176     43.2615     347.176     
1 1 1 17 5  58 o 18 68.942  2.8682  83.908      10.044   85.7873     9.67864  43.6143    357.088     12.4287     357.088     
1 1 1 17 5  59 o 10 88.7745 2.60151 145.018     11.9669  135.855     11.1334  29.964     296.717     51.9851     116.717     
1 1 1 17 5  60 o 13 224.988 3.10123 919.746     37.6951  884.978     32.1087  159.029    53.9988     24.6382     53.9988     
1 1 1 17 5  61 o 3  45.7633 3.74175 42.7521     8.92829  33.4291     7.91155  0.58364    323.828     49.6634     143.828     
1 1 1 17 5  62 o 18 34.091  4.95572 25.4067     8.86712  18.2747     7.54016  2.93508    67.2179     20.7534     247.218     
1 1 1 17 5  63 o 6  94.9829 2.63299 178.521     13.2518  144.382     11.773   75.6304    65.4402     33.7465     65.4402     
1 1 1 17 5  64 o 1  49.4918 3.57211 34.2069     8.65347  55.782      8.19987  12.9058    289.145     34.3358     109.145     
1 1 1 17 5  65 o 15 21.5732 5.29915 5.09715     8.34182  9.26184     6.12376  2.03715    291.989     18.5547     291.989     
1 1 1 17 5  66 o 11 30.5456 5.59625 18.5513     9.73625  16.9103     7.56006  9.31606    59.0007     8.17179     239.001     
1 1 1 17 5  67 o 7  131.62  2.7566  330.519     18.7637  290.348     17.5622  90.7833    281.133     14.387      281.133     
1 1 1 17 5  68 o 14 85.9503 3.27193 136.154     13.9456  130.202     14.1263  56.3882    285.012     5.7275      285.012     
1 1 1 17 5  69 o 8  55.9872 3.84922 56.2549     11.0279  58.1994     10.2635  40.2983    242.791     15.3521     242.791     
1 1 1 17 5  70 o 17 96.6949 2.98619 169.051     14.5282  167.414     14.3429  54.6504    329.738     11.5827     149.738     
1 1 1 17 5  71 o 12 28.133  5.55737 17.1305     7.90753  13.0623     8.50177  6.53572    349.68      15.0582     169.68      
1 1 1 17 5  72 o 11 57.5768 3.66466 55.111      10.1216  66.2128     10.7796  30.2602    214.587     8.94237     34.587      
1 1 1 17 5  73 o 14 66.7115 3.47417 86.2601     10.9871  75.9252     11.9457  42.5839    222.299     4.16427     222.299     
1 1 1 17 5  74 o 15 23.4853 5.53985 15.1166     7.97588  2.67407     8.70203  6.71522    316.864     7.03986     136.864     
1 1 1 17 5  75 o 9  76.5405 3.42328 95.6378     12.1387  118.983     14.0088  43.6194    15.1986     6.3771      195.199     
1 1 1 17 5  76 f 0  80.6249 3.16352 127.071     12.478   110.1       12.8946  35.9593    311.977     0           0           
1 1 1 17 5  77 o 8  20.0394 5.41761 9.54023     7.95622  0.804301    7.89013  3.38894    304.476     8.66298     124.476     
1 1 1 17 5  78 o 6  69.028  3.84702 78.6612     11.6281  99.1919     14.812   49.5786    179.158     16.9457     179.158     
1 1 1 17 5  79 o 15 42.9867 5.52568 33.3062     10.116   40.1454     12.8226  17.556     148.693     14.3642     328.693     
1 1 1 17 5  80 o 19 55.3473 4.99934 53.639      11.9927  65.3908     15.1235  28.5625    29.3589     7.47095     209.359     
1 1 1 17 5  81 o 10 46.5762 6.12517 38.0924     13.0667  50.512      14.4849  27.7126    10.4675     3.44266     10.4675     
1 1 1 17 5  82 f 0  34.8653 6.88078 33.677      12.1362  16.8259     14.3461  26.6893    91.7624     0           0           
1 1 1 17 5  83 o 11 33.9468 6.9061  12.528      12.1436  36.9955     14.2102  18.5764    281.522     2.10148     281.522     
1 1 1 17 5  84 o 1  33.8105 7.84652 28.0196     16.6841  23.2178     14.0317  16.5033    253.221     2.0928      73.2207     
1 1 1 17 5  85 o 19 55.7145 7.057   65.4619     20.5668  68.6595     17.1151  34.7788    73.8605     6.40483     73.8605     
1 1 1 17 5  86 o 18 68.8117 6.10488 101.807     22.1304  96.4182     18.9163  47.4163    51.0028     16.4003     51.0028     
1 1 1 17 5  87 o 9  18.3913 6.13516 -2.23865    16.2014  -14.4113    12.7067  0.246134   7.82634     9.1012      7.82636     
1 1 1 17 5  88 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 6  0  o 9  484.823 4.37269 4167.89     106.202  4167.89     106.202  215.705    5.23797e-06 275.386     180         
1 1 1 17 6  1  o 2  578.93  4.91894 5952.35     145.331  5932.87     140.05   468.357    41.2406     107.241     41.2406     
1 1 1 17 6  2  o 18 321.758 3.11812 1859.81     50.2801  1810.04     50.27    275.807    170.342     116.209     170.342     
1 1 1 17 6  3  f 0  264.179 2.89447 1239.13     38.319   1234.59     38.3214  202.502    0.805201    0           0           
1 1 1 17 6  4  o 8  618.426 5.34856 6832.73     159.216  6731.67     171.96   425.742    270.511     38.708      90.511      
1 1 1 17 6  5  o 9  160.571 2.33044 459.691     19.0961  454.121     18.4069  35.4084    307.974     130.141     127.974     
1 1 1 17 6  6  o 2  609.398 5.09397 6544.72     155.557  6625.76     155.573  463.075    332.735     50.5926     332.735     
1 1 1 17 6  7  o 2  129.33  2.46073 295.933     15.6067  297.322     16.2564  6.27245    0.888739    137.381     180.889     
1 1 1 17 6  8  o 2  571.657 4.90798 5765.7      143.163  5823.64     137.97   482.705    69.8681     147.562     69.8681     
1 1 1 17 6  9  o 19 560.14  4.89386 5493.54     137.357  5634.11     137.378  470.737    350.064     140.563     350.064     
1 1 1 17 6  10 o 13 328.117 3.16118 1893.45     51.9726  1922.98     51.9856  125.617    154.01      212.665     334.01      
1 1 1 17 6  11 o 12 371.314 3.39209 2412.76     63.1024  2475.14     63.1308  300.793    215.776     81.6556     215.776     
1 1 1 17 6  12 o 8  212.435 2.5651  807.826     27.2974  791.78      27.3164  86.229     120.778     115.282     300.778     
1 1 1 17 6  13 o 18 169.788 2.52714 508.546     21.5147  513.257     21.4906  106.149    80.0116     12.4647     80.0116     
1 1 1 17 6  14 o 5  168.537 2.35824 504.323     20.631   502.445     19.181   59.6443    321.901     100.369     141.901     
1 1 1 17 6  15 o 6  414.076 3.79706 2989.45     80.1935  3090.4      77.3018  280.391    161.039     27.2441     341.039     
1 1 1 17 6  16 o 10 274.701 2.98766 1340.49     40.3072  1334.57     41.9316  172.239    37.1395     35.9537     217.139     
1 1 1 17 6  17 o 19 342.635 3.19707 2080.21     54.8825  2081.85     54.9106  197.673    220.073     88.21       40.0733     
1 1 1 17 6  18 o 14 519.027 4.44233 4816.71     115.537  4738.36     115.553  387.783    119.526     34.9484     119.526     
1 1 1 17 6  19 o 16 253.34  2.77554 1147.61     34.5568  1127.63     35.8928  219.128    219.623     99.8643     219.623     
1 1 1 17 6  20 o 5  128.292 2.17952 291.681     13.9772  291.695     14.048   18.4721    79.3602     125.782     259.36      
1 1 1 17 6  21 o 5  273.671 2.90211 1320.93     39.0382  1334.32     40.5579  211.458    244.15      46.3626     244.15      
1 1 1 17 6  22 o 4  746.137 6.15517 9863.35     225.835  9907.59     234.412  549.717    80.1596     31.3557     80.1596     
1 1 1 17 6  23 o 2  245.185 2.72592 1063.4      32.8372  1067.83     34.1408  143.942    159.73      50.9209     339.73      
1 1 1 17 6  24 o 19 362.566 3.46226 2347.26     61.6995  2314.6      64.0754  171.168    63.8578     170.368     243.858     
1 1 1 17 6  25 o 11 248.088 2.71324 1088.82     33.0677  1093.27     34.3878  138.272    60.9235     66.3963     240.924     
1 1 1 17 6  26 o 8  431.495 4.01476 3302.66     85.0528  3302.76     88.5424  284.295    243.693     41.0918     63.6928     
1 1 1 17 6  27 o 11 422.456 4.24194 3102.18     89.7727  3231.35     89.8122  320.753    313.574     47.0206     313.573     
1 1 1 17 6  28 o 13 48.7939 2.90979 49.4231     7.2326   36.1282     6.78743  26.3543    318.661     75.8661     318.661     
1 1 1 17 6  29 o 12 259.747 3.02864 1196.03     40.2703  1196.61     38.5582  79.4946    27.5291     202.312     207.529     
1 1 1 17 6  30 o 1  172.879 2.51394 539.455     22.2404  520.298     21.3213  143.547    122.157     86.8694     122.157     
1 1 1 17 6  31 o 14 144.398 2.4791  376.373     18.6206  362.963     17.2531  71.1626    225.438     43.4909     45.4381     
1 1 1 17 6  32 f 0  139.384 2.38035 358.028     16.881   331.048     16.37    69.0481    320.783     0           0           
1 1 1 17 6  33 o 7  105.728 2.30526 189.555     12.144   207.344     12.241   57.7305    207.431     0.0145605   207.424     
1 1 1 17 6  34 o 19 237.361 2.7706  1002.54     33.5709  995.487     32.3349  131.995    266.479     63.5102     86.4793     
1 1 1 17 6  35 o 12 90.7288 2.56888 151.003     11.5223  141.447     11.7715  38.6203    224.512     28.2038     44.5125     
1 1 1 17 6  36 o 4  169.957 2.60198 532.756     21.5213  492.002     22.7122  69.2626    145.908     92.1188     325.908     
1 1 1 17 6  37 o 19 231.959 3.27062 1011.05     37.887   899.568     38.0445  181.165    193.83      46.8436     193.83      
1 1 1 17 6  38 o 11 182.754 2.74733 616.936     24.3492  568.17      25.857   102.486    152.805     41.5541     332.805     
1 1 1 17 6  39 o 18 167.611 2.706   510.415     21.9888  486.167     23.4035  101.432    96.6654     20.0979     276.665     
1 1 1 17 6  40 o 13 342.719 3.74363 2118.09     62.6144  2051.97     65.874   245.824    308.888     19.5724     308.888     
1 1 1 17 6  41 o 11 96.0093 3.01496 173.2       13.609   154.749     15.1624  7.11179    70.9207     107.256     250.921     
1 1 1 17 6  42 o 16 104.838 2.82787 192.141     13.848   198.364     15.7762  62.5337    63.7987     4.87882     63.7987     
1 1 1 17 6  43 o 12 221.454 2.9907  855.661     30.6822  884.583     35.5917  118.089    92.6683     63.4342     272.668     
1 1 1 17 6  44 o 13 322.051 3.43116 1826.92     54.1299  1854.95     56.6117  254.438    241.979     70.6945     241.979     
1 1 1 17 6  45 o 9  275.717 3.0723  1315.54     42.4163  1382.67     42.4669  239.758    234.69      108.683     234.69      
1 1 1 17 6  46 o 1  446.206 4.20427 3439.61     93.9677  3637.67     94.0033  367.527    41.4325     126.279     41.4325     
1 1 1 17 6  47 o 11 26.6774 4.91498 13.6307     6.5375   12.6212     6.74297  11.2249    223.013     27.3211     223.013     
1 1 1 17 6  48 o 18 232.034 3.01676 987.147     34.1791  924.542     35.8751  173.366    300.898     36.7175     300.898     
1 1 1 17 6  49 o 5  86.1681 2.68923 129.626     10.8002  134.419     12.3409  3.731      78.0134     101.312     258.013     
1 1 1 17 6  50 o 11 107.391 2.70588 206.42      13.5461  203.47      15.4535  58.9943    316.362     17.6346     136.362     
1 1 1 17 6  51 o 18 41.9891 3.80224 31.4954     7.10124  32.2237     8.47558  2.14587    68.8961     18.1448     248.896     
1 1 1 17 6  52 o 18 21.03   5.04349 8.21367     6.04365  6.21734     6.71426  18.3156    293.345     44.5041     293.345     
1 1 1 17 6  53 o 5  136.989 2.51563 323.328     16.5006  343.623     18.0112  90.12      169.226     2.50324     169.227     
1 1 1 17 6  54 o 18 130.126 2.52008 294.53      15.2228  307.369     17.5733  79.7172    174.178     8.98606     354.178     
1 1 1 17 6  55 o 8  128.655 2.57255 292.139     15.3908  296.413     17.6838  74.8613    65.1229     16.8391     245.123     
1 1 1 17 6  56 o 10 290.064 3.1802  1439.77     45.1327  1556.19     47.3308  203        129.87      20.9943     129.87      
1 1 1 17 6  57 o 12 80.0936 2.65042 111.911     10.3619  116.725     10.8568  49.0055    21.7442     1.50669     21.7441     
1 1 1 17 6  58 o 9  49.8768 3.15147 45.8051     7.39748  43.5472     8.14427  19.2577    139.358     8.5445      319.358     
1 1 1 17 6  59 o 13 177.334 2.61454 563.851     23.6408  555.32      22.8277  140.167    130.932     50.3687     130.932     
1 1 1 17 6  60 o 12 121.592 2.61506 267.445     15.5211  259.437     16.2873  68.407     155.208     18.7707     335.208     
1 1 1 17 6  61 o 3  68.0588 2.99938 88.5083     10.1901  77.5398     10.1358  34.3369    355.585     13.0289     175.585     
1 1 1 17 6  62 o 16 88.4406 2.63766 136.375     11.4933  142.9       11.8358  38.4347    219.632     35.3392     39.6319     
1 1 1 17 6  63 o 2  17.6923 4.97607 -1.55617    7.82461  5.48895     6.09119  6.18122    267.769     22.0408     267.769     
1 1 1 17 6  64 o 11 138.426 2.5733  365.577     18.8207  319.23      16.8683  102.688    26.9249     27.6108     26.925      
1 1 1 17 6  65 o 4  54.5608 2.91641 53.4132     7.91044  53.6683     7.91991  19.3683    132.444     28.2849     312.444     
1 1 1 17 6  66 o 13 91.8111 2.74394 165.466     13.5511  137.203     11.6651  53.7521    92.3567     8.48575     272.357     
1 1 1 17 6  67 o 18 72.4382 3.03157 102.293     11.6533  86.9111     10.273   41.0589    81.0286     7.91223     261.029     
1 1 1 17 6  68 f 0  61.2016 3.24307 75.0836     10.6431  60.761      9.12495  43.4041    150.196     0           0           
1 1 1 17 6  69 o 3  42.5811 4.28221 40.7638     9.47211  27.1703     8.20962  18.8324    102.322     11.8157     282.322     
1 1 1 17 6  70 o 10 22.8196 5.71689 2.11124     8.61123  13.5161     8.76039  2.42324    181.566     12.9337     1.56613     
1 1 1 17 6  71 o 17 73.6883 3.59607 94.8189     13.1863  102.772     13.1922  46.4129    99.3481     2.2571      99.3481     
1 1 1 17 6  72 o 11 192.37  3.19167 674.743     30.7671  661.083     30.7687  138.832    40.6785     35.7229     40.6785     
1 1 1 17 6  73 o 8  81.703  3.43862 127.194     13.3624  115.946     14.5533  65.8765    92.1699     31.828      92.1699     
1 1 1 17 6  74 o 7  48.425  4.60221 51.1131     10.0176  37.6671     11.2184  28.2465    206.388     0.842138    26.3875     
1 1 1 17 6  75 o 17 50.5222 4.22855 46.728      10.2026  48.9053     10.7957  36.6625    146.533     14.4073     146.533     
1 1 1 17 6  76 o 17 23.2117 5.65001 14.5083     8.14995  3.00031     9.02617  4.91423    157.17      0.500503    157.17      
1 1 1 17 6  77 o 18 49.0014 4.50372 43.95       10.4302  47.4811     11.17    24.9371    38.3176     7.94921     218.318     
1 1 1 17 6  78 o 18 37.8947 5.73717 31.5688     9.72261  26.1227     11.3992  18.5337    307.873     5.26253     127.873     
1 1 1 17 6  79 o 4  18.2456 5.4715  6.80788     8.97552  -9.27367    10.0117  0.779718   171.663     8.06209     351.663     
1 1 1 17 6  80 o 16 80.0838 4.32382 118.068     17.7297  124.461     16.6427  55.0785    195.596     14.9575     195.596     
1 1 1 17 6  81 o 1  34.865  6.49427 19.984      10.8597  31.2435     12.3666  11.5699    257.122     15.3813     77.1216     
1 1 1 17 6  82 o 5  27.4294 7.143   15.9712     13.203   12.7548     12.6824  7.59143    22.6252     13.3849     202.625     
1 1 1 17 6  83 o 10 27.8586 6.56714 27.0391     12.4634  0.106028    12.4242  10.6669    14.5246     6.71098     194.525     
1 1 1 17 6  84 o 4  38.6759 7.54089 25.9161     17.4648  40.9463     14.1072  23.1871    255.975     5.5382      255.975     
1 1 1 17 6  85 f 0  64.438  6.44872 86.5074     21.5696  89.3285     18.5999  28.8736    270.686     0           0           
1 1 1 17 6  86 o 6  22.7055 7.04025 5.59317     17.1714  3.44671     13.4215  3.72289    243.356     8.51053     63.3561     
1 1 1 17 6  87 o 15 22.406  7.12944 2.24728     17.322   1.53431     16.2569  2.44875    101.17      6.12972     281.17      
1 1 1 17 6  88 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 7  0  o 2  504.046 4.33006 4504.99     109.34   4504.99     109.34   489.826    7.39298e-06 244.073     7.39298e-06 
1 1 1 17 7  1  o 6  181.324 2.45573 582.114     21.8886  583.213     22.7339  39.5338    359.794     163.932     179.794     
1 1 1 17 7  2  o 4  360.923 3.47563 2307.34     65.2288  2310.75     60.4047  262.825    265.847     16.225      265.847     
1 1 1 17 7  3  o 8  297.188 2.94592 1578.87     43.878   1551.91     43.8686  198.308    319.494     17.3331     139.494     
1 1 1 17 7  4  o 18 218.047 2.59928 840.625     28.9261  844.585     27.8675  79.8517    151.372     139.111     331.372     
1 1 1 17 7  5  o 9  174.055 2.31857 540.609     20.2124  533.157     20.2347  102.612    308.985     8.55878     128.985     
1 1 1 17 7  6  o 5  227.477 2.59104 925.576     29.529   908.591     29.5437  150.711    124.122     3.63828     304.122     
1 1 1 17 7  7  o 8  105.326 2.25717 194.4       12.1147  199.164     11.6751  14.2512    71.3503     149.149     71.3503     
1 1 1 17 7  8  o 13 240.914 2.81308 1053.52     33.2458  1004.11     34.6185  163.719    118.919     0.435223    118.919     
1 1 1 17 7  9  o 17 412.09  3.8623  3028.05     76.6071  2993.27     82.7609  309.913    10.2009     33.3467     10.2009     
1 1 1 17 7  10 o 3  303.511 3.05265 1624.17     45.5465  1641.43     47.3079  161.818    207.019     104.189     27.0187     
1 1 1 17 7  11 o 10 471.671 4.19584 3986.4      97.2942  3903.28     100.982  454.737    244.972     240.242     244.972     
1 1 1 17 7  12 o 4  363.007 3.43458 2329.2      61.301   2342.77     63.6458  239.159    240.975     36.5885     60.9747     
1 1 1 17 7  13 o 12 236.762 2.83414 1011.02     33.6215  976.267     33.6257  104.141    9.23471     120.213     189.235     
1 1 1 17 7  14 o 5  429.857 4.08051 3233.79     87.8652  3319.36     87.9284  287.843    110.872     38.0806     290.872     
1 1 1 17 7  15 o 9  618.838 5.53522 6770.57     171.638  6820.27     171.683  415.279    359.525     60.2202     179.525     
1 1 1 17 7  16 o 14 335.445 3.32867 2001.55     53.7369  1988.08     58.077   296.751    248.777     125.686     248.777     
1 1 1 17 7  17 o 9  396.001 3.73031 2771.79     71.1293  2789.26     76.8356  349.654    194.671     140.258     194.671     
1 1 1 17 7  18 o 19 482.24  4.25244 4159.23     100.815  4089.98     104.649  407.253    17.2204     127.185     17.2204     
1 1 1 17 7  19 o 13 829.645 6.83276 12297.9     278.72   12159.1     289.285  605.178    33.1501     16.2428     33.15       
1 1 1 17 7  20 o 1  249.029 2.75043 1091.95     33.6595  1106.66     34.9854  122.786    229.269     102.224     49.2687     
1 1 1 17 7  21 f 0  51.9873 2.69391 46.0275     6.77639  50.3518     7.16442  38.6479    8.96922     0           0           
1 1 1 17 7  22 o 12 481.129 4.37849 4102.38     103.436  4111.1      107.669  380.081    266.749     75.7388     266.749     
1 1 1 17 7  23 o 19 235.165 2.85307 964.588     32.8763  996.373     34.3721  185.108    118.595     51.3423     118.595     
1 1 1 17 7  24 o 2  371.064 3.7319  2420.8      67.862   2463.49     70.9209  334.753    180.204     150.198     180.204     
1 1 1 17 7  25 o 3  548.499 5.20969 5315.85     143.181  5367.7      143.22   412.454    359.983     44.9118     359.983     
1 1 1 17 7  26 o 18 164.249 2.51761 483.65      20.2359  472.854     21.1863  89.56      145.116     35.7241     325.116     
1 1 1 17 7  27 o 5  456.023 4.49256 3662.49     102.647  3719.39     102.687  357.919    192.068     72.1199     192.068     
1 1 1 17 7  28 o 12 224.909 2.79509 884.466     30.7438  909.349     32.2622  201.147    310.012     105.879     310.012     
1 1 1 17 7  29 o 5  232.506 2.78771 970.531     31.7719  946.525     33.1559  190.693    161.747     67.1871     161.747     
1 1 1 17 7  30 o 2  299.005 3.26735 1579        49.9761  1592.31     47.9112  193.664    119.985     29.7323     299.986     
1 1 1 17 7  31 o 7  152.607 2.51119 416.112     18.6998  409.671     19.6887  108.312    43.5543     20.1855     43.5544     
1 1 1 17 7  32 o 19 134.393 2.41185 322.704     16.1637  318.122     16.2957  70.9913    144.289     33.5586     324.289     
1 1 1 17 7  33 o 11 253.172 2.98953 1133.94     38.7073  1139.54     37.1318  218.017    256.276     87.8946     256.276     
1 1 1 17 7  34 o 3  478.897 4.72188 4114.98     118.385  4032.4      108.122  382.874    358.408     93.4882     358.408     
1 1 1 17 7  35 o 17 251.743 3.03116 1122.57     35.5859  1125.55     40.7284  180.723    216.816     14.4225     216.816     
1 1 1 17 7  36 o 16 210.472 2.78112 794.372     27.8892  776.894     30.6789  108.663    308.381     71.4961     128.381     
1 1 1 17 7  37 o 13 317.359 3.33097 1802.47     51.7308  1771.57     54.1693  209.959    350.974     20.1498     170.974     
1 1 1 17 7  38 o 5  179.232 2.74213 570.71      22.6908  568.757     26.4209  120.603    345.983     1.39464     345.984     
1 1 1 17 7  39 f 0  241.697 3.0829  1037.58     34.4959  1035.15     39.978   151.446    17.1299     0           0           
1 1 1 17 7  40 o 3  292.361 3.38288 1523.35     48.3205  1510.38     50.7658  239.056    109.945     78.1336     109.945     
1 1 1 17 7  41 o 13 148.013 2.84131 389.97      20.8545  387.835     21.2544  59.7187    261.065     77.0806     81.0649     
1 1 1 17 7  42 o 6  255.276 3.07835 1141.54     38.3541  1171.03     40.4028  196.446    266.81      46.7064     266.81      
1 1 1 17 7  43 o 9  154.194 2.62962 430.292     21.0452  413.213     19.5917  76.5338    219.524     50.8702     39.524      
1 1 1 17 7  44 o 3  226.292 2.75883 925.506     31.7709  891.482     30.8042  125.467    29.4065     55.5285     209.407     
1 1 1 17 7  45 o 15 317.828 3.35092 1787.03     50.9936  1799.35     55.6638  207.587    266.157     18.3894     86.1569     
1 1 1 17 7  46 o 7  516.971 4.72242 4655.28     117.101  4854.76     127.546  389.373    177.451     70.5522     177.451     
1 1 1 17 7  47 o 16 301.939 3.34096 1581.96     48.0369  1656.2      53.0403  238.839    46.399      68.8757     46.3991     
1 1 1 17 7  48 o 16 231.992 2.99305 918.95      33.7087  992.671     35.8973  172.017    127.549     32.5766     127.549     
1 1 1 17 7  49 o 3  64.4031 3.15819 65.0019     9.3175   83.6183     10.9616  16.3327    15.3641     112.395     15.3641     
1 1 1 17 7  50 o 13 222.376 2.96816 824.609     31.9391  933.48      34.2232  177.656    350.476     58.0633     350.476     
1 1 1 17 7  51 o 16 160.747 2.70033 452.111     20.6934  465.563     22.7892  130.792    79.8472     51.3981     79.8472     
1 1 1 17 7  52 o 14 138.022 2.53349 333.635     16.6139  343.124     18.3926  100.606    161.779     22.1233     161.779     
1 1 1 17 7  53 o 12 92.8177 2.77079 159.685     11.6318  147.116     13.8737  42.7427    5.80676     31.9535     185.807     
1 1 1 17 7  54 o 5  245.271 2.86631 1051.72     32.9922  1087.26     37.3975  175.801    306.756     24.9313     306.756     
1 1 1 17 7  55 o 12 114.121 2.77096 232.438     15.3025  231.206     16.3251  45.2994    271.408     57.7003     91.4082     
1 1 1 17 7  56 o 1  67.0105 3.04494 75.4727     9.09335  85.1944     11.2358  37.7282    332.688     1.35747     152.688     
1 1 1 17 7  57 o 17 82.1987 2.62203 115.084     10.076   125.885     11.4711  41.8605    168.228     18.3136     348.228     
1 1 1 17 7  58 f 0  42.1149 3.75404 27.2764     7.22467  37.5247     8.23818  3.98591    35.5239     0           0           
1 1 1 17 7  59 f 0  127.481 2.30702 279.86      14.3018  298.684     15.1549  92.0322    264.801     0           0           
1 1 1 17 7  60 o 2  112.19  2.54666 225.842     15.002   222.815     13.5694  90.0492    319.693     38.9224     319.693     
1 1 1 17 7  61 o 12 148.729 2.46107 386.288     19.1157  401.558     17.4979  91.65      93.3973     9.84431     273.397     
1 1 1 17 7  62 o 12 66.7856 3.01963 72.6843     10.5239  87.6538     9.35598  36.1253    300.761     11.2151     120.761     
1 1 1 17 7  63 o 16 123.909 2.42774 276.709     15.5251  271.03      14.5901  89.3113    339.33      19.1994     339.33      
1 1 1 17 7  64 o 16 61.5059 2.98023 68.881      9.22812  67.1287     9.03317  35.7667    190.725     4.10492     10.7249     
1 1 1 17 7  65 o 17 143.253 2.49947 386.798     19.3108  346.812     16.564   88.5021    276.759     7.28416     96.7587     
1 1 1 17 7  66 o 14 54.4003 3.31551 59.6658     9.99302  47.8482     7.93474  27.6246    70.9339     10.8986     250.934     
1 1 1 17 7  67 o 14 47.3607 3.80318 51.0936     9.58821  32.1211     8.04423  29.1579    219.165     3.50048     219.165     
1 1 1 17 7  68 f 0  49.5437 3.74618 53.4348     10.1208  37.1104     8.20705  32.2455    263.552     0           0           
1 1 1 17 7  69 o 15 24.494  5.48749 16.96       9.04315  5.46206     6.59732  4.87082    240.256     4.10084     60.256      
1 1 1 17 7  70 o 5  35.7852 5.05998 27.153      10.1623  21.8358     7.36065  20.021     327.01      4.01475     327.01      
1 1 1 17 7  71 o 7  119.662 2.65688 273.679     17.4445  241.273     14.3763  66.681     268.885     17.2269     88.885      
1 1 1 17 7  72 o 17 27.6984 5.57542 19.5165     9.66127  10.7793     6.67558  12.2664    249.911     1.07497     249.911     
1 1 1 17 7  73 f 0  22.2408 5.89453 10.86       9.53987  4.24195     8.44145  13.2095    17.655      0           0           
1 1 1 17 7  74 o 17 15.4418 4.9752  -1.99888    8.8061   -7.09774    8.25417  0.0767933  17.4769     4.97313     17.4769     
1 1 1 17 7  75 o 8  13.4125 4.46631 -6.92238    7.12326  -7.83591    8.32015  4.1642     111.859     17.0378     111.859     
1 1 1 17 7  76 o 12 63.0786 3.90011 74.4306     11.9676  73.8393     12.4336  34.9664    76.1644     6.37762     256.164     
1 1 1 17 7  77 o 11 60.1493 3.98628 62.3974     11.5931  73.3044     12.1313  39.3406    179.341     7.02795     179.341     
1 1 1 17 7  78 o 1  25.5528 6.26648 15.5146     9.227    8.31476     11.0693  8.1133     319.846     0.0142812   319.849     
1 1 1 17 7  79 o 10 72.099  4.666   106.735     17.3338  92.3695     16.0135  45.9989    191.855     6.1459      191.855     
1 1 1 17 7  80 f 0  25.037  6.7453  12.5065     11.555   8.98475     12.0262  1.26386    344.752     0           0           
1 1 1 17 7  81 o 8  40.5147 6.80067 33.3594     14.0019  35.8889     13.2197  24.0257    98.3588     3.37213     98.3588     
1 1 1 17 7  82 o 12 28.0255 6.61617 3.89573     12.107   25.3486     12.0925  13.2087    304.618     4.44656     304.618     
1 1 1 17 7  83 f 0  24.746  7.23793 0.793336    16.5906  13.2805     13.843   8.80918    17.2203     0           0           
1 1 1 17 7  84 o 15 32.3484 7.7101  24.1087     14.5016  23.8508     15.1198  16.9841    128.114     5.04698     128.114     
1 1 1 17 7  85 o 17 21.4676 6.75582 -5.94297    12.8504  9.0356      16.4232  3.09031    261.789     4.80891     81.7895     
1 1 1 17 7  86 o 10 28.1047 7.6816  6.09049     14.1961  28.6803     17.5926  7.83261    240.051     0.0632101   60.0507     
1 1 1 17 7  87 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 8  0  o 18 336.901 3.19351 2012.57     53.8959  2012.57     53.8959  189.237    180         113.725     8.67362e-06 
1 1 1 17 8  1  o 4  438.564 3.95975 3386.16     83.6257  3434.28     90.3455  399.573    72.0309     174.279     72.0309     
1 1 1 17 8  2  o 15 215.579 2.65346 840.272     28.6573  807.266     28.6675  178.349    33.3646     80.4819     33.3646     
1 1 1 17 8  3  o 12 385.341 3.74446 2638.02     67.8279  2627.02     76.5109  344.036    198.968     142.898     198.968     
1 1 1 17 8  4  o 15 240.309 2.76844 1024.99     32.0352  1022.08     34.5922  160.384    115.071     9.03175     295.071     
1 1 1 17 8  5  o 17 311.899 3.17807 1736.54     47.7261  1712.31     51.5226  247.671    195.062     58.5239     195.062     
1 1 1 17 8  6  o 19 437.87  4.02917 3405.38     84.9466  3393.79     91.7387  351.16     346.733     75.6936     346.733     
1 1 1 17 8  7  o 19 463.079 4.20592 3791.49     93.7921  3813.74     101.296  308.242    72.1891     49.7206     252.189     
1 1 1 17 8  8  o 7  430.566 4.13396 3323.74     89.2064  3251.13     89.1863  318.947    290.387     21.126      290.387     
1 1 1 17 8  9  o 1  332.766 3.48228 1940.38     53.0704  1985.99     62.7727  206.381    27.8202     60.0283     207.82      
1 1 1 17 8  10 o 1  453.303 4.13372 3636.32     90.2259  3651.35     97.4594  248.097    39.9585     156.368     219.959     
1 1 1 17 8  11 o 14 287.081 3.04195 1446.58     42.062   1475.34     45.4309  135.917    177.191     134.618     357.191     
1 1 1 17 8  12 o 12 326.418 3.26977 1872.04     51.4132  1905.81     55.5165  314.778    39.2985     176.884     39.2985     
1 1 1 17 8  13 o 18 505.821 4.6632  4550.9      113.174  4526.23     123.006  437.578    234.078     149.829     234.078     
1 1 1 17 8  14 o 3  79.6807 2.42899 117.482     9.80537  108.092     9.54403  75.8403    82.7295     249.492     82.7295     
1 1 1 17 8  15 o 4  254.4   2.92155 1172.3      36.4424  1122.5      37.9886  197.686    90.2109     44.1546     90.2109     
1 1 1 17 8  16 f 0  164.734 2.63287 469.905     23.0482  492.262     20.2598  126.694    103.806     0           0           
1 1 1 17 8  17 o 8  343.3   3.5855  2120.56     60.3115  2059.35     62.9818  197.714    304.351     93.2287     124.351     
1 1 1 17 8  18 o 18 353.586 3.56408 2240.31     63.1213  2193.83     63.1814  284.476    146.724     68.948      146.724     
1 1 1 17 8  19 o 1  403.045 3.98312 2877.28     78.6791  2885.37     82.1913  295.431    196.068     17.0407     196.068     
1 1 1 17 8  20 o 9  603.582 5.50633 6424.63     162.898  6513.14     170.177  493.668    10.7342     122.027     10.7342     
1 1 1 17 8  21 o 11 353.011 3.80134 2158.66     65.6206  2262.64     68.8865  286.523    83.6973     75.5019     83.6973     
1 1 1 17 8  22 o 18 118.677 2.6194  246.696     14.8409  253.164     16.2619  61.6462    220.511     2.03327     220.511     
1 1 1 17 8  23 f 0  148.066 2.55861 384.944     18.5124  392.365     19.4543  122.246    116.961     0           0           
1 1 1 17 8  24 o 5  191.277 2.64865 658.04      24.7356  639.289     26.0044  154.76     188.917     62.2566     188.917     
1 1 1 17 8  25 o 9  283.415 3.10008 1420.71     43.9958  1428.03     44.0656  161.111    223.254     74.6222     43.2539     
1 1 1 17 8  26 o 11 146.863 2.38829 380.05      17.16    384.655     17.9898  13.9785    151.055     228.033     151.055     
1 1 1 17 8  27 o 18 180.475 2.53223 570.012     22.8223  584.912     22.9813  132.064    357.761     25.5645     357.761     
1 1 1 17 8  28 o 16 93.3663 2.43418 157.035     11.0647  152.481     11.6565  12.9754    38.2641     87.0202     218.264     
1 1 1 17 8  29 o 11 176.688 2.51208 550.182     21.7244  556.779     22.7559  165.52     244.27      121.157     244.27      
1 1 1 17 8  30 o 2  403.164 3.69354 2888.09     73.1942  2879.81     76.0246  315.374    15.3541     62.1625     15.3541     
1 1 1 17 8  31 o 15 172.384 2.53099 533.339     20.3941  520.452     23.2079  139.19     355.395     48.2447     355.395     
1 1 1 17 8  32 o 18 323.489 3.3769  1831.43     52.3806  1881.71     57.0635  269.428    234.939     86.8019     234.939     
1 1 1 17 8  33 o 13 388.084 3.86342 2615.5      76.6444  2731.37     73.5032  342.074    203.187     140.67      203.187     
1 1 1 17 8  34 o 19 78.1572 2.71718 104.547     10.2722  112.707     10.9512  22.6277    114.655     40.7242     294.655     
1 1 1 17 8  35 o 16 159.019 2.67853 447.05      21.3417  449.835     21.3492  81.367     359.565     51.5197     179.565     
1 1 1 17 8  36 o 2  306.511 3.52119 1671.9      51.2972  1662.65     56.7251  221.248    87.6539     17.0932     87.6539     
1 1 1 17 8  37 o 18 496.276 4.90026 4352.17     124.703  4403.64     118.934  377.308    99.5878     60.7324     99.5878     
1 1 1 17 8  38 o 16 135.65  2.51668 323.516     16.6977  329.576     17.4864  101.414    163.855     32.808      163.855     
1 1 1 17 8  39 o 15 178.131 2.5631  567.476     21.2758  558.016     24.3541  137.346    203.3       38.6999     203.3       
1 1 1 17 8  40 o 17 238.763 2.87828 974.158     33.5303  1049.15     35.3572  174.349    158.803     23.5796     158.803     
1 1 1 17 8  41 o 3  146.75  2.95337 378.573     17.9664  385.997     24.9328  115.363    34.2426     44.7514     34.2426     
1 1 1 17 8  42 o 4  87.5847 2.77559 129.469     10.5794  143.417     13.6595  35.9202    116.877     29.3846     296.877     
1 1 1 17 8  43 o 16 102.237 2.71048 183.277     12.3141  188.101     15.2851  61.523     232.97      2.85216     232.97      
1 1 1 17 8  44 o 11 301.992 3.34687 1595.54     48.1357  1642.74     53.1095  234.474    30.3161     56.999      30.3161     
1 1 1 17 8  45 o 3  224.566 2.89596 886.078     30.7748  903.844     34.342   161.171    76.3806     19.4766     76.3806     
1 1 1 17 8  46 o 9  68.246  2.98183 73.1277     9.00604  93.4713     11.3283  1.80434    5.51306     77.755      185.513     
1 1 1 17 8  47 o 18 166.652 2.75162 479.592     20.912   506.458     24.9667  111.739    174.597     2.01072     174.597     
1 1 1 17 8  48 o 9  102.611 2.65642 186.324     12.9389  187.934     14.3056  47.6707    310.597     36.6004     130.597     
1 1 1 17 8  49 o 3  87.0198 2.65092 133.944     11.2337  135.406     11.8281  39.3957    241.89      30.3407     61.8904     
1 1 1 17 8  50 o 1  132.746 2.62683 309.479     17.617   316.794     17.2912  85.2609    260.948     3.26968     80.9483     
1 1 1 17 8  51 o 11 366.788 3.59639 2342.89     67.221   2445.93     64.897   238.942    279.702     18.4881     99.702      
1 1 1 17 8  52 o 17 160.124 2.5429  442.113     20.5597  468.845     20.2267  92.7149    41.2482     26.9176     221.248     
1 1 1 17 8  53 o 7  197.035 2.65534 692.392     26.5338  687.378     25.9033  164.255    136.212     67.6394     136.212     
1 1 1 17 8  54 o 4  78.0039 2.69978 105.358     9.99473  111.545     11.0455  53.4049    281.851     15.8216     281.851     
1 1 1 17 8  55 o 7  67.4357 2.90952 76.7267     9.49351  85.8539     10.079   36.3753    352.135     6.47161     172.135     
1 1 1 17 8  56 o 15 81.9201 2.66013 120.837     10.3766  118.455     11.3717  30.5381    295.441     42.4568     115.441     
1 1 1 17 8  57 o 19 47.9178 3.27471 40.6338     7.58212  42.0501     7.94979  16.5988    268.771     14.0586     88.7705     
1 1 1 17 8  58 o 3  26.9705 4.85844 16.3962     6.51934  10.7514     6.81629  19.6527    297.228     63.3759     297.228     
1 1 1 17 8  59 o 8  95.7994 2.41744 162.556     11.3502  164.527     11.822   61.3383    198.811     1.44254     198.811     
1 1 1 17 8  60 o 19 34.4606 4.3405  13.7411     6.84937  31.7996     7.32847  9.1795     342.411     5.776       162.411     
1 1 1 17 8  61 o 10 43.1215 4.04696 31.2196     8.46342  36.8924     8.54634  24.3617    123.387     1.36153     123.387     
1 1 1 17 8  62 o 18 32.7389 5.08224 19.6691     8.80527  20.7043     7.41024  12.3106    153.732     0.711027    333.732     
1 1 1 17 8  63 o 12 35.7572 4.48311 22.8442     7.66115  24.8009     7.81575  14.972     107.503     7.95092     287.503     
1 1 1 17 8  64 o 3  40.9004 4.05775 27.5126     8.49045  34.2477     7.40835  9.28201    320.399     30.3157     140.398     
1 1 1 17 8  65 o 4  27.1864 5.58915 14.7419     9.25011  13.1693     6.92747  5.17691    280.753     40.4983     280.753     
1 1 1 17 8  66 o 14 17.8238 5.18279 0.252777    8.6331   3.53862     6.45376  3.66276    332.111     18.2731     332.111     
1 1 1 17 8  67 o 5  25.3486 5.64616 10.9468     9.28729  12.4896     6.92685  6.44017    274.99      40.7559     274.99      
1 1 1 17 8  68 o 8  29.6924 5.57099 18.6171     9.65674  15.4184     7.21711  7.79938    312.422     15.6555     132.422     
1 1 1 17 8  69 o 15 16.3226 4.97208 4.61535     8.86217  -5.71961    6.13587  1.98982    69.2937     10.8068     69.2937     
1 1 1 17 8  70 o 16 17.8637 5.14379 8.53152     8.9707   -5.34474    6.40693  0.04363    120.546     8.9531      120.545     
1 1 1 17 8  71 o 15 42.9374 4.6512  49.9023     11.0168  22.3032     8.17805  19.8272    116.188     11.4725     296.188     
1 1 1 17 8  72 f 0  22.5542 5.75534 11.2331     9.83881  6.30541     6.8093   5.8664     216.477     0           0           
1 1 1 17 8  73 o 13 77.0469 3.26919 117.286     14.3123  99.7487     10.7786  44.049     9.93727     7.33416     189.937     
1 1 1 17 8  74 o 19 22.2892 5.81434 10.2426     10.3846  6.70203     6.72782  3.23158    346.701     15.9165     166.701     
1 1 1 17 8  75 o 3  37.7836 6.23091 42.6796     13.3156  17.4619     10.5707  24.4316    301.22      8.11732     301.22      
1 1 1 17 8  76 o 2  67.6043 4.51425 78.7425     15.4642  94.9385     14.4843  39.1332    225.885     3.76356     45.8853     
1 1 1 17 8  77 o 15 18.6211 5.56966 -3.9128     9.06908  6.1246      9.44552  1.01758    12.7479     10.6466     192.748     
1 1 1 17 8  78 o 10 68.28   4.90511 94.4744     15.6663  85.4322     17.2231  49.5447    169.457     18.2174     169.457     
1 1 1 17 8  79 o 11 43.095  6.61256 32.881      13.1392  45.1336     14.676   19.7307    346.017     9.80024     166.017     
1 1 1 17 8  80 o 2  37.8969 6.65643 21.1699     11.1711  40.5523     14.3934  22.62      268.05      16.0564     268.05      
1 1 1 17 8  81 o 9  26.7662 6.85    16.5043     10.4733  9.54898     14.1036  10.346     190.568     5.70109     10.5676     
1 1 1 17 8  82 o 16 24.754  6.97981 15.3005     13.1669  2.30657     13.9222  5.65572    17.0311     1.65697     17.0311     
1 1 1 17 8  83 o 15 32.411  7.83112 23.6623     17.3632  24.2276     13.5284  16.892     54.2939     2.37712     54.2939     
1 1 1 17 8  84 o 2  19.781  6.31052 -11.2492    12.3806  6.52342     14.5782  2.03905    271.78      6.58737     91.7802     
1 1 1 17 8  85 o 7  21.3796 6.57051 -5.94907    13.2724  10.7438     13.8926  2.36802    129.423     5.46437     309.423     
1 1 1 17 8  86 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 9  0  o 3  147.432 2.44247 385.818     18.0237  385.818     18.0237  99.2224    180         8.01331     8.70869e-06 
1 1 1 17 9  1  o 7  593.309 5.34474 6259.65     158.918  6233.02     158.914  450.923    216.628     41.4916     216.628     
1 1 1 17 9  2  o 15 149.489 2.49293 403.249     18.2408  388.959     19.0816  84.6172    184.771     16.5602     4.77107     
1 1 1 17 9  3  o 6  73.3747 2.56017 94.2385     9.56598  97.0846     9.19269  11.2312    120.278     76.5077     120.278     
1 1 1 17 9  4  o 13 427.945 4.10734 3258.63     88.0873  3236.86     88.0847  362.858    271.675     112.013     271.675     
1 1 1 17 9  5  o 7  329.139 3.41629 1896.69     56.341   1944.74     56.3525  294.227    248.574     125.062     248.574     
1 1 1 17 9  6  o 14 216.151 2.7324  838.879     29.5882  817.486     29.6039  58.0022    269.67      187.823     89.6704     
1 1 1 17 9  7  f 0  121.485 2.32904 271.997     13.8555  251.725     14.4326  80.1779    8.87122     0           0           
1 1 1 17 9  8  o 3  330.479 3.49719 1968.64     56.6259  1904.52     59.1324  271.4      80.8027     74.7269     80.8027     
1 1 1 17 9  9  o 15 221.973 2.76906 890.114     30.7932  856.82      30.8042  147.698    92.4767     10.7615     272.477     
1 1 1 17 9  10 f 0  313.299 3.4174  1765.62     49.9787  1715.24     56.9922  287.233    208.144     0           0           
1 1 1 17 9  11 o 4  186.199 2.48748 613.326     22.3096  615.705     24.0822  73.0195    322.237     110.868     142.237     
1 1 1 17 9  12 o 4  270.322 2.93754 1292.41     38.2396  1298.44     41.2977  197.91     194.871     16.4228     194.871     
1 1 1 17 9  13 o 9  394.264 3.91894 2788.11     75.7187  2725.88     79.0626  326.583    359.895     90.1007     359.895     
1 1 1 17 9  14 o 13 141.614 2.66387 360.382     17.4735  350.934     20.1772  65.2761    304.355     52.3359     124.355     
1 1 1 17 9  15 o 8  228.11  3.07512 926.053     35.161   919.042     35.1453  128.786    184.513     60.3559     4.51339     
1 1 1 17 9  16 o 5  241.515 3.12569 1042.94     37.8453  1025.5      37.8153  156.436    116.526     23.6457     296.526     
1 1 1 17 9  17 o 5  403.299 4.47824 2913.68     82.9927  2858.69     97.3132  289.913    236.214     3.41952     236.214     
1 1 1 17 9  18 o 13 317.131 3.55981 1795.54     55.198   1771.84     57.9001  228.519    27.5312     8.74196     27.5312     
1 1 1 17 9  19 o 7  96.4254 2.5658  161.424     12.089   168.734     12.6656  10.3147    107.31      139.201     107.31      
1 1 1 17 9  20 o 18 289.336 3.21505 1491.05     43.4634  1478.04     49.5455  216.569    217.629     27.7227     217.629     
1 1 1 17 9  21 o 15 349.791 3.56517 2141.57     59.863   2199.04     65.0801  367.345    221.798     250.437     221.798     
1 1 1 17 9  22 o 12 297.648 3.21147 1577.87     45.8561  1564.41     49.8494  198.615    276.463     21.4447     96.4627     
1 1 1 17 9  23 o 7  295.096 3.23514 1534.25     46.7871  1554.51     48.8876  204.774    166.009     5.07814     346.009     
1 1 1 17 9  24 o 1  314.922 3.41649 1717.7      50.3278  1800.99     57.4218  239.48     76.5489     35.9281     76.5489     
1 1 1 17 9  25 o 4  179.48  2.54656 568.219     21.4703  573.992     24.2676  127.502    57.9096     14.6459     57.9096     
1 1 1 17 9  26 o 6  87.5825 2.36439 131.362     9.71746  141.088     10.9958  23.3282    116.065     51.8915     296.065     
1 1 1 17 9  27 f 0  279.765 3.00702 1374.98     39.4988  1401.15     44.7042  84.2517    313.652     0           0           
1 1 1 17 9  28 o 15 347.748 3.58121 2160.84     59.6769  2130.25     64.9894  315.961    84.4839     142.52      84.4839     
1 1 1 17 9  29 o 8  288.385 3.27346 1462.93     45.0706  1487.67     49.4782  254.946    236.265     106.867     236.265     
1 1 1 17 9  30 o 1  96.1777 2.55841 175.488     11.5868  153.383     12.8669  11.7941    160.767     101.212     340.767     
1 1 1 17 9  31 o 5  94.747  2.51604 155.543     11.2943  163.298     12.5484  15.0485    104.222     91.5975     284.223     
1 1 1 17 9  32 o 6  139.723 2.64415 347.874     17.9183  345.016     19.0551  83.8003    218.799     17.3262     38.7987     
1 1 1 17 9  33 o 4  116.027 2.64387 240.387     14.8395  237.587     15.8435  54.9037    283.321     39.9947     103.321     
1 1 1 17 9  34 o 11 76.7716 2.7138  108.787     10.0958  100.866     10.6769  27.9144    277.333     11.4242     97.3329     
1 1 1 17 9  35 o 2  124.979 2.46785 268.072     15.0248  286.468     15.8619  72.1886    191.547     16.5722     11.547      
1 1 1 17 9  36 o 15 52.629  3.16872 49.7836     7.70073  49.2156     8.8062   0.542238   5.67435     27.221      5.67436     
1 1 1 17 9  37 o 10 188.791 2.64877 623.476     24.3656  640.878     25.7514  126.66     2.33753     2.27527     182.338     
1 1 1 17 9  38 o 14 206.545 2.66379 751.467     27.4542  761.887     27.691   132.868    244.939     15.7694     64.9387     
1 1 1 17 9  39 o 2  218.211 2.73766 839.003     29.8109  850.279     30.0645  194.521    18.0605     96.1623     18.0605     
1 1 1 17 9  40 o 1  345.336 3.61446 2039.36     62.3955  2196.8      62.6541  218.062    311.708     42.4308     131.708     
1 1 1 17 9  41 o 15 175.451 2.69812 530.24      23.4371  562.133     24.0078  155.661    187.152     83.0796     187.152     
1 1 1 17 9  42 o 19 115.222 2.4453  238.387     12.9991  232.989     15.1027  52.9811    22.1955     42.2683     202.196     
1 1 1 17 9  43 o 9  143.445 2.46776 362.477     16.4747  367.743     18.9195  71.5227    42.3163     47.0498     222.316     
1 1 1 17 9  44 o 13 300.482 3.15866 1591.63     44.4667  1614.31     50.5096  216.621    213.573     21.6654     213.573     
1 1 1 17 9  45 o 4  225.847 2.84431 891.239     31.2484  919.574     33.1321  155.235    354.493     3.92654     354.493     
1 1 1 17 9  46 o 13 103.979 2.71804 184.807     13.0971  199.66      15.1684  79.4576    312.535     33.5889     312.535     
1 1 1 17 9  47 o 7  188.335 2.48762 603.202     23.2321  656.299     23.7118  112.615    151.429     29.148      331.429     
1 1 1 17 9  48 o 8  155.478 2.5153  416.957     18.9027  441.403     20.2969  88.2306    288.126     31.4909     108.126     
1 1 1 17 9  49 o 13 158.422 2.45297 437.322     18.8983  453.84      20.05    94.9215    57.6998     21.6835     237.7       
1 1 1 17 9  50 o 2  215.198 2.6686  797.706     27.4091  847.875     30.1479  157.99     105.399     26.7002     105.399     
1 1 1 17 9  51 o 1  161.525 2.60523 444.17      21.0178  483.235     21.1359  89.5401    70.7337     36.3849     250.734     
1 1 1 17 9  52 o 10 30.4951 5.16265 17.1249     7.84854  17.5309     7.72239  20.0206    15.6671     68.3114     15.6671     
1 1 1 17 9  53 o 19 113.07  2.67021 220.916     15.5283  234.296     14.6401  84.9659    91.2933     25.1108     91.2933     
1 1 1 17 9  54 o 16 215.53  2.89009 823.254     32.946   830.319     29.3661  139.877    97.7841     8.03966     277.784     
1 1 1 17 9  55 o 17 36.7609 4.56202 28.1253     8.23045  21.9132     7.93288  1.01998    16.8266     30.0137     196.827     
1 1 1 17 9  56 o 4  78.9039 2.88671 104.476     11.4158  118.165     11.2934  41.126     146.872     15.7433     326.872     
1 1 1 17 9  57 o 17 68.5692 3.01641 89.2698     10.3175  79.2229     10.2827  41.0608    88.1355     1.60432     88.1355     
1 1 1 17 9  58 o 9  103.26  2.62389 191.108     13.6429  189.261     13.4692  65.489     210.913     1.6189      30.913      
1 1 1 17 9  59 o 19 105.851 2.58426 191.704     13.5419  208.251     13.8264  67.2213    147.885     2.48331     327.885     
1 1 1 17 9  60 o 16 76.3761 3.01856 101.314     12.2425  107.848     10.6511  54.4306    168.17      12.37       168.17      
1 1 1 17 9  61 o 8  78.3944 2.79927 107.174     10.6336  112.977     11.2917  28.8403    326.902     43.2263     146.902     
1 1 1 17 9  62 o 5  27.8921 5.33172 14.6246     8.37875  14.736      6.91594  4.68409    121.293     17.5297     301.293     
1 1 1 17 9  63 o 4  33.3902 4.78823 19.298      7.92998  22.7548     7.53329  5.4236     350.657     27.2216     170.657     
1 1 1 17 9  64 o 18 69.7895 2.99242 81.8066     10.9464  93.7394     9.71641  54.8494    64.822      23.7415     64.822      
1 1 1 17 9  65 o 16 17.1627 4.81151 0.960951    5.82142  5.03583     6.61708  2.67227    345.305     13.4781     345.305     
1 1 1 17 9  66 o 3  23.1876 5.06498 -3.45829    9.19773  16.7474     7.0052   3.60531    89.5929     8.36537     269.593     
1 1 1 17 9  67 o 17 43.2287 4.60319 32.858      10.5741  37.0137     8.42849  20.8697    291.081     9.25325     111.081     
1 1 1 17 9  68 f 0  55.8208 3.83971 52.8235     11.4865  61.5159     9.32269  26.8353    286.099     0           0           
1 1 1 17 9  69 o 13 54.3622 3.81271 61.4047     11.3326  47.5401     9.20419  43.228     245.284     22.6269     245.284     
1 1 1 17 9  70 o 18 42.6846 4.58806 46.8739     10.6252  23.6825     8.24072  23.4466    14.1489     3.61383     194.149     
1 1 1 17 9  71 o 17 69.0927 3.53784 78.4019     13.0206  96.7528     10.8093  45.7822    39.5473     6.0094      39.5473     
1 1 1 17 9  72 o 3  28.0363 6.12923 18.9346     11.2511  12.381      7.74091  1.64698    316.281     0.89877     316.281     
1 1 1 17 9  73 o 5  39.0362 5.4917  32.7012     12.221   27.4641     8.46669  26.7202    55.5425     10.1616     55.5425     
1 1 1 17 9  74 o 17 45.6585 5.79103 42.5962     13.1871  40.353      12.3416  31.1245    349.477     9.42929     349.477     
1 1 1 17 9  75 f 0  77.2663 4.10423 108.637     16.4537  115.097     14.9891  44.2073    256.035     0           0           
1 1 1 17 9  76 o 15 21.2853 6.18224 5.95779     10.2759  3.85816     10.9232  2.15344    115.893     14.9353     295.893     
1 1 1 17 9  77 o 16 56.2041 5.18517 74.9952     14.5647  49.6575     13.5637  33.0355    117.568     0.468146    297.568     
1 1 1 17 9  78 o 15 31.5004 7.38675 19.3879     13.3067  22.8082     13.9145  15.5538    26.5705     4.88573     26.5705     
1 1 1 17 9  79 f 0  29.9046 6.64573 22.2349     10.6526  14.2182     12.1783  18.1012    61.5314     0           0           
1 1 1 17 9  80 o 1  18.046  5.5672  4.93601     9.15448  -11.1009    11.4386  2.34655    104.844     3.86948     284.844     
1 1 1 17 9  81 o 13 48.9947 5.84268 50.5199     13.0803  47.3277     14.4855  30.1665    292.885     3.80067     292.885     
1 1 1 17 9  82 o 8  74.4854 5.09478 99.2666     18.2534  120.878     19.2294  51.7708    219.547     15.386      219.547     
1 1 1 17 9  83 o 15 29.2323 7.2057  27.8294     13.7252  8.09408     14.2809  12.8197    3.69231     0.502074    3.69231     
1 1 1 17 9  84 o 18 27.5627 7.45551 17.0398     14.3161  16.2771     14.43    5.22692    95.3907     1.02707     95.3907     
1 1 1 17 9  85 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 10 0  o 17 302.889 3.38346 1627.3      51.3289  1627.3      51.3289  154.197    1.50348e-06 135.181     180         
1 1 1 17 10 1  o 9  162.43  2.4822  466.239     20.1997  469.058     20.2106  124.921    175.503     50.2411     175.503     
1 1 1 17 10 2  o 13 292.089 3.31056 1500.77     48.4554  1524.66     48.4609  262.046    145.761     114.112     145.761     
1 1 1 17 10 3  o 12 366.429 3.74362 2385.03     70.227   2377.27     67.2354  238.236    96.3867     51.0797     276.387     
1 1 1 17 10 4  o 11 297.38  3.19809 1591.59     47.6645  1544.45     47.6496  181.189    117.732     62.2891     297.732     
1 1 1 17 10 5  o 10 137.747 2.40804 334.379     16.6163  338.253     16.6292  16.6185    322.419     152.585     142.419     
1 1 1 17 10 6  o 14 260.042 3.19408 1209.91     40.6185  1188.02     42.5869  250.96     4.06075     146.889     4.06075     
1 1 1 17 10 7  o 12 221.569 3.04311 875.332     33.7764  865.424     33.8025  97.7421    18.8434     116.456     198.843     
1 1 1 17 10 8  o 6  81.212  2.80156 127.9       10.9523  106.968     11.6381  4.76913    34.662      7.93089     214.662     
1 1 1 17 10 9  o 1  202.687 3.15664 734.757     32.9816  722.074     31.133   121.77     146.852     36.1405     326.852     
1 1 1 17 10 10 o 9  113.923 2.70116 229.047     14.9295  231.622     15.8602  31.2479    246.035     78.536      66.0353     
1 1 1 17 10 11 f 0  174.172 2.94797 541.311     24.1818  534.708     27.1512  174.395    253.847     0           0           
1 1 1 17 10 12 o 13 404.418 4.49255 2864.97     91.0234  2939.73     91.0674  235.827    226.722     111.001     46.7222     
1 1 1 17 10 13 o 18 261.722 3.46614 1216.78     42.8497  1212.78     47.9234  137.965    340.007     94.7411     160.007     
1 1 1 17 10 14 o 3  522.957 5.55241 4836.75     145.499  4878.07     145.529  361.344    25.5529     32.7147     205.553     
1 1 1 17 10 15 o 12 330.395 3.5946  1939.38     58.0687  1932.91     60.9269  250.914    295.634     32.3446     295.634     
1 1 1 17 10 16 o 12 456.314 4.6068  3680.45     102.803  3711.22     107.851  345.38     87.9804     35.1371     87.9804     
1 1 1 17 10 17 o 6  84.3441 2.65256 136.076     10.8811  117.024     11.3918  3.6426     39.5094     80.8237     219.509     
1 1 1 17 10 18 o 8  299.908 3.26087 1595.12     44.746   1595.15     52.93    247.951    190.226     74.7394     190.226     
1 1 1 17 10 19 o 15 281.562 3.03977 1414.99     40.2271  1396.65     45.3671  219.187    16.1584     43.4074     16.1584     
1 1 1 17 10 20 o 1  413.5   3.94866 3044.2      76.7452  3023.43     86.5732  304.415    76.9841     17.555      76.9841     
1 1 1 17 10 21 o 8  189.588 2.56892 635.798     22.8952  638.687     25.8371  144.721    114.724     34.3859     114.724     
1 1 1 17 10 22 o 7  97.7507 2.39098 172.686     10.9592  166.532     12.3594  44.7621    239.541     7.92035     59.541      
1 1 1 17 10 23 o 10 84.1351 2.48886 129.509     9.76721  121.982     11.084   39.7484    283.355     188.27      283.355     
1 1 1 17 10 24 f 0  247.156 3.03902 1073.26     35.9029  1093.47     39.3308  166.523    304.866     0           0           
1 1 1 17 10 25 o 11 377.342 3.99898 2495.82     70.0884  2558.52     80.8912  253.226    102.417     31.4837     282.417     
1 1 1 17 10 26 o 5  71.2734 2.71901 98.3299     9.26736  82.6923     9.95265  17.8852    329.664     38.3327     149.664     
1 1 1 17 10 27 o 3  165.005 2.58018 493.193     20.3721  472.451     22.2125  91.33      267.151     44.117      87.1514     
1 1 1 17 10 28 o 8  341.393 3.71954 2056.42     62.1353  2080.35     65.1173  304.945    278.639     128.27      278.639     
1 1 1 17 10 29 f 0  277.891 3.13937 1368.36     42.7921  1371.39     44.6301  245.975    240.313     0           0           
1 1 1 17 10 30 o 19 141.825 2.50942 362.931     17.0543  350.697     18.5383  86.4292    280.161     16.2175     100.161     
1 1 1 17 10 31 o 17 66.9778 2.67147 77.7033     8.72076  81.9438     9.14179  5.67444    236.071     59.8985     56.0714     
1 1 1 17 10 32 o 16 70.3598 2.8164  83.2667     9.50738  93.041      10.2777  1.37779    303.321     84.6588     303.321     
1 1 1 17 10 33 o 14 274.738 3.21942 1330.55     42.2644  1348.05     46.3191  194.837    172.76      6.37505     172.76      
1 1 1 17 10 34 o 2  253.958 2.92845 1123.81     36.4383  1164.59     38.104   167.272    275.305     18.5302     95.305      
1 1 1 17 10 35 o 3  56.8703 2.97061 56.8832     7.5515   58.5011     9.19707  19.3085    120.508     100.254     120.508     
1 1 1 17 10 36 o 7  85.9978 2.56828 133.298     10.9172  129.514     11.1632  12.104     77.9532     82.695      257.953     
1 1 1 17 10 37 o 6  332.241 3.39817 1954.86     55.372   1963.71     57.7666  238.951    77.8777     15.1176     77.8777     
1 1 1 17 10 38 o 7  283.622 3.05666 1409.73     42.4938  1445.14     44.3955  179.3      78.8657     34.7463     258.866     
1 1 1 17 10 39 o 8  228.23  2.74344 929.342     31.9102  918.792     30.8426  208.187    262.01      107.873     262.01      
1 1 1 17 10 40 o 1  85.2729 2.74818 129.451     11.1816  129.092     12.2194  36.6934    321.019     15.7495     321.019     
1 1 1 17 10 41 o 11 120.213 2.51885 250.127     15.2179  263.096     15.0867  44.3232    297.578     69.5813     117.578     
1 1 1 17 10 42 o 8  94.7857 2.65425 158.327     13.0073  160.989     12.1352  54.0642    292.547     32.8586     292.547     
1 1 1 17 10 43 o 19 132.172 2.50672 306.164     17.1245  314.187     16.0175  112.192    208.714     58.2252     208.714     
1 1 1 17 10 44 o 6  33.3789 4.69898 19.5965     7.73887  21.4877     7.42135  45.547     294.572     125.259     294.572     
1 1 1 17 10 45 o 16 153.008 2.54325 408.482     19.4205  422.553     19.5804  111.298    200.446     18.466      200.446     
1 1 1 17 10 46 o 16 103.553 2.43527 190.08      12.6727  190.956     12.5671  88.4826    236.144     60.283      236.144     
1 1 1 17 10 47 o 6  177.307 2.60097 539.599     22.8529  577.087     23.364   149.193    50.6233     61.3452     50.6233     
1 1 1 17 10 48 o 12 181.458 2.68927 574.567     24.6968  595.217     24.1964  138.293    122.84      32.9817     122.84      
1 1 1 17 10 49 o 12 331.838 3.4399  1930.93     59.3306  1988.67     54.9175  242.174    239.075     32.3037     239.075     
1 1 1 17 10 50 o 9  77.8    3.06659 102.542     12.0668  113.584     11.7038  52.7783    280.039     14.6492     280.039     
1 1 1 17 10 51 o 13 152.771 2.53218 403.33      19.4902  426.301     19.2642  100.971    187.233     1.33715     7.23328     
1 1 1 17 10 52 f 0  119.024 2.56329 237.572     15.2882  267.019     15.2105  84.7728    314.37      0           0           
1 1 1 17 10 53 o 13 99.3252 2.66383 174.426     13.3266  177.084     13.1416  73.2112    160.788     20.5701     160.788     
1 1 1 17 10 54 o 17 124.3   2.55935 279.623     16.0609  270.652     15.7905  78.1831    287.524     6.36053     107.524     
1 1 1 17 10 55 o 4  101.744 2.78613 179.915     13.5553  189.496     14.8003  35.0283    267.16      62.5772     87.1599     
1 1 1 17 10 56 o 3  20.108  5.13031 11.7848     7.40658  -6.88018    8.5227   7.18698    225.904     20.2746     225.904     
1 1 1 17 10 57 o 13 50.2041 3.61253 45.3424     8.57091  45.8181     9.33823  21.3898    253.949     14.9733     73.9493     
1 1 1 17 10 58 o 8  55.0881 3.24512 48.9754     8.56348  60.608      9.16513  37.003     58.8614     10.0717     58.8614     
1 1 1 17 10 59 o 11 28.885  4.61379 3.68794     7.07021  28.2112     7.60125  15.9187    44.8925     66.1354     44.8925     
1 1 1 17 10 60 o 4  99.8726 2.82011 167.008     14.3726  190.422     13.6979  72.2393    244.016     15.268      244.016     
1 1 1 17 10 61 o 15 19.502  5.09385 7.62469     6.51069  2.85481     6.9601   0.809422   109.552     8.32832     109.552     
1 1 1 17 10 62 o 16 26.0507 5.29257 16.7491     7.00959  7.86946     8.28713  5.21234    278.922     10.8332     98.9217     
1 1 1 17 10 63 o 12 33.0079 4.92684 19.1681     7.56969  22.2092     8.22598  13.1761    61.6824     8.28832     241.682     
1 1 1 17 10 64 o 4  76.0784 2.87041 103.603     11.1108  104.607     10.6906  54.2893    101.062     12.6851     101.062     
1 1 1 17 10 65 o 18 73.7216 3.25249 93.3621     12.7241  103.302     10.9968  52.7003    148.442     12.9497     148.442     
1 1 1 17 10 66 o 7  72.174  3.07851 101.03      12.0122  87.3555     10.1662  60.5042    193.667     32.1507     193.667     
1 1 1 17 10 67 o 10 57.2811 3.67571 55.4804     10.9696  64.5997     9.68117  28.931     102.438     13.1325     282.438     
1 1 1 17 10 68 o 4  53.4295 4.25394 56.0103     11.7064  49.8367     10.6863  31.4677    155.294     2.39838     335.294     
1 1 1 17 10 69 o 4  70.1589 3.60046 100.629     13.8389  79.933      11.3451  47.8718    313.647     8.23839     313.647     
1 1 1 17 10 70 o 9  54.2767 4.29229 64.676      11.9973  46.0297     10.8363  28.8036    29.3404     9.26975     209.34      
1 1 1 17 10 71 o 15 25.6762 6.12368 13.5157     10.5421  11.3681     8.15233  5.95288    166.017     15.7955     346.017     
1 1 1 17 10 72 o 3  56.4011 4.25767 69.0285     12.6696  51.1188     11.0059  44.1085    202.892     20.4429     202.892     
1 1 1 17 10 73 o 2  15.6674 4.97565 -4.59523    9.10238  -1.09046    7.27527  5.36323    6.22733     24.8792     6.22733     
1 1 1 17 10 74 o 18 105.793 3.29752 209.086     17.7783  201.856     17.1019  84.7045    128.316     38.137      128.316     
1 1 1 17 10 75 o 13 17.5558 5.46683 2.83666     9.68033  -6.07298    9.40602  0.390332   288.502     10.2261     108.502     
1 1 1 17 10 76 o 16 55.7945 5.17023 43.9409     13.8893  79.7407     12.513   32.7911    308.226     0.849773    128.226     
1 1 1 17 10 77 o 13 20.0755 6.06309 0.686542    11.2928  3.74779     10.3913  2.31689    167.914     3.68263     347.914     
1 1 1 17 10 78 o 1  21.5911 6.41092 8.13032     11.7261  -1.18602    12.2777  4.26061    135.755     10.4631     315.755     
1 1 1 17 10 79 o 8  21.9809 6.53716 0.359906    11.5668  8.49007     13.0595  2.56175    223.738     16.937      43.738      
1 1 1 17 10 80 o 10 24.4686 6.93519 7.9583      12.9006  10.8923     13.0089  4.93185    11.3499     15.2746     191.35      
1 1 1 17 10 81 o 8  18.7712 6.14819 -11.4692    12.4451  -0.881847   14.8556  0.39897    17.8494     0.368951    197.849     
1 1 1 17 10 82 o 19 17.5091 5.79715 -4.89098    12.861   -10.7134    12.6761  0.281924   253.973     1.3749      73.973      
1 1 1 17 10 83 o 13 26.7142 6.73026 -6.8013     14.3417  28.4558     13.4861  3.75059    216.501     0.810077    216.501     
1 1 1 17 10 84 o 9  33.3159 7.70409 30.004      15.3949  24.8594     14.2513  15.1141    43.6213     1.35559     43.6213     
1 1 1 17 10 85 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 11 0  o 9  196.26  3.05511 683.7       30.0154  683.7       30.0154  128.836    6.82428e-06 30.0656     180         
1 1 1 17 11 1  o 8  195.851 3.11391 674.934     29.6606  685.34      31.4511  146.187    28.6364     26.9769     28.6364     
1 1 1 17 11 2  o 4  228.485 3.34983 928.052     39.4623  923.496     37.2234  130.685    232.769     60.3381     52.7687     
1 1 1 17 11 3  o 12 234.496 3.38907 995.925     38.6044  954.588     40.9514  164.004    172.368     0.267198    352.369     
1 1 1 17 11 4  o 2  186.118 3.19216 628.529     29.7455  600.111     29.7889  164.579    339.748     96.5568     339.748     
1 1 1 17 11 5  o 1  276.167 3.80072 1358.19     52.5856  1347.54     52.6168  119.949    176.229     155.691     356.229     
1 1 1 17 11 6  o 17 226.303 3.40678 907.506     38.6199  908.961     38.6527  143.28     146.826     30.3845     326.826     
1 1 1 17 11 7  o 12 70.9123 3.17086 93.3809     11.2089  85.7483     11.1965  5.91398    49.473      69.0615     49.473      
1 1 1 17 11 8  o 1  215.825 3.35949 849.268     36.3291  803.195     36.3216  172.371    279.998     49.5804     279.998     
1 1 1 17 11 9  o 11 276.226 3.45467 1353.44     49.06    1353.04     46.5522  257.986    241.021     131.756     241.021     
1 1 1 17 11 10 o 19 111.256 2.77817 228.187     15.4648  211.428     15.4493  52.9791    84.8942     4.5489      84.8942     
1 1 1 17 11 11 o 18 270.6   3.16415 1314.05     42.9139  1283.05     42.8993  175.524    174.428     32.5718     354.428     
1 1 1 17 11 12 o 8  215.391 2.76678 830.531     30.5114  814.595     29.215   147.07     26.1586     3.9902      206.159     
1 1 1 17 11 13 o 5  377.309 3.91327 2520.9      77.2749  2530.7      70.5463  264.474    86.2155     13.002      266.215     
1 1 1 17 11 14 o 15 125.17  2.56057 279.193     16.4224  276.797     15.6616  55.8813    52.7045     45.7374     232.704     
1 1 1 17 11 15 o 18 245.483 2.90264 1063.85     35.7085  1073.25     35.7086  155.891    7.45041     33.9604     187.45      
1 1 1 17 11 16 o 4  350.759 3.64759 2222.13     65.5076  2143.4      62.7313  238.652    201.42      25.2334     21.42       
1 1 1 17 11 17 o 2  384.34  3.88819 2616.77     73.2352  2625.27     76.5136  304.637    208.812     58.5157     208.812     
1 1 1 17 11 18 o 7  308.176 3.49406 1710.22     55.2416  1659.41     52.6817  257.322    318.524     77.6345     318.524     
1 1 1 17 11 19 o 17 373.618 3.96252 2494.02     75.9437  2460.28     72.4205  293.351    222.654     51.8414     222.654     
1 1 1 17 11 20 f 0  366.743 4.02358 2360.28     73.9512  2413.86     73.9406  257.334    280.504     0           0           
1 1 1 17 11 21 o 6  210.863 3.02547 780.388     32.7907  796.765     31.1088  118.256    59.7076     60.0348     239.708     
1 1 1 17 11 22 o 2  146.682 2.73836 386.874     20.6574  376.732     19.5628  117.624    233.629     43.4775     233.629     
1 1 1 17 11 23 o 12 180.326 2.97375 587.244     25.418   566.277     28.1992  126.564    239.831     3.59886     239.831     
1 1 1 17 11 24 o 3  87.4959 2.83962 143.423     12.2407  128.877     12.5485  45.6527    69.1521     7.58372     69.1521     
1 1 1 17 11 25 o 7  192.095 2.78973 646.832     26.2821  662.021     27.4278  149.423    272.99      33.7767     272.99      
1 1 1 17 11 26 o 4  237.292 2.91812 1001.14     33.9374  996.233     35.4449  173.632    316.746     14.2313     316.746     
1 1 1 17 11 27 o 15 229.416 2.83703 930.57      31.9248  936.367     33.2994  178.497    50.745      36.881      50.7451     
1 1 1 17 11 28 o 17 72.3491 2.59656 90.7097     9.23599  95.4452     9.53184  27.7447    291.318     147.274     291.318     
1 1 1 17 11 29 o 16 78.8365 2.60099 118.522     9.79432  102.683     10.5858  32.1033    132.318     8.40769     312.318     
1 1 1 17 11 30 f 0  196.923 2.65519 688.476     25.6439  687.011     26.7493  154.094    143.515     0           0           
1 1 1 17 11 31 o 1  128.355 2.68749 290.36      17.2624  294.56      17.273   62.125     46.031      46.3689     226.031     
1 1 1 17 11 32 o 3  148.866 2.60962 391.65      17.9669  394.702     20.8529  81.7577    328.032     37.3778     148.032     
1 1 1 17 11 33 o 3  125.761 2.49519 287.214     16.1345  274.268     15.2877  87.6036    335.662     15.4005     335.662     
1 1 1 17 11 34 o 12 247.371 2.89385 1086.01     35.8769  1085.18     35.8719  179.121    103.166     14.8056     103.166     
1 1 1 17 11 35 o 9  176.124 2.58722 564.505     22.3345  536.045     23.2904  149.764    60.0177     65.3218     60.0177     
1 1 1 17 11 36 o 7  171.434 2.56302 524.66      22.4903  517.91      21.5443  155.277    229.142     86.5344     229.142     
1 1 1 17 11 37 o 6  75.7919 2.79822 103.094     10.8194  101.288     10.3619  31.1595    292.508     4.38276     112.508     
1 1 1 17 11 38 o 16 175.163 2.59459 547.257     23.264   541.284     22.2816  137.77     73.3396     40.7133     73.3396     
1 1 1 17 11 39 o 12 251.451 2.93765 1119.49     36.8933  1124.62     37.1427  186.661    244.386     26.6518     244.386     
1 1 1 17 11 40 o 15 141.149 2.45327 352.709     17.5726  354.13      17.1305  79.3365    247.914     29.8037     67.9138     
1 1 1 17 11 41 o 9  231.054 3.05056 942.996     36.6495  952.58      33.9286  173.288    121.891     29.6385     121.891     
1 1 1 17 11 42 o 13 159.857 2.50413 448.286     20.3294  458.613     19.7802  134.033    104.01      55.638      104.01      
1 1 1 17 11 43 o 6  124.048 2.57684 271.059     15.0965  275.616     16.8709  81.0433    47.1941     1.65785     227.194     
1 1 1 17 11 44 o 3  234.923 2.6558  968.149     32.3044  991.357     30.1632  216.378    92.2567     112.678     92.2567     
1 1 1 17 11 45 o 3  112.142 2.46846 234.951     14.0698  212.229     13.6331  83.8013    27.3877     22.9691     27.3877     
1 1 1 17 11 46 o 19 243.458 2.85968 1037.25     36.8008  1068.99     32.7965  202.919    259.656     73.8608     259.656     
1 1 1 17 11 47 o 16 151.541 2.59878 405.082     19.9991  410.715     19.465   110.361    92.3732     18.0457     92.3732     
1 1 1 17 11 48 o 19 169.614 2.51429 497.612     21.5993  524.602     21.1172  117.061    91.6616     5.72193     91.6616     
1 1 1 17 11 49 o 9  137.942 2.57056 330.511     16.404   346.091     19.0692  96.9537    340.268     10.6825     340.268     
1 1 1 17 11 50 o 18 69.5386 2.94212 80.663      9.54954  92.2227     10.8739  46.4677    195.942     15.3326     195.942     
1 1 1 17 11 51 o 19 191.363 2.65084 642.465     26.1893  660.221     24.6033  136.792    339.243     16.1861     339.243     
1 1 1 17 11 52 o 7  103.777 2.50799 179.176     12.7164  204.781     13.3213  63.425     312.46      8.0826      132.46      
1 1 1 17 11 53 o 19 54.7011 3.30988 50.4301     8.58418  57.249      9.39423  3.08454    22.9674     60.9238     202.967     
1 1 1 17 11 54 o 9  182.238 2.54865 562.887     22.9866  620.197     23.548   123.986    126.715     4.98032     126.716     
1 1 1 17 11 55 o 5  106.063 2.61737 197.48      13.437   203.787     14.3411  59.3899    72.9395     19.6781     252.939     
1 1 1 17 11 56 o 11 67.987  3.02296 80.8538     10.075   84.8686     10.4209  28.2535    310.345     29.8484     130.345     
1 1 1 17 11 57 o 14 78.8488 2.98652 106.871     11.214   115.97      12.3064  47.3663    133.435     6.98713     313.435     
1 1 1 17 11 58 o 19 17.9525 4.98179 0.552006    6.13686  6.14982     7.17094  10.5709    197.343     35.8347     197.343     
1 1 1 17 11 59 o 8  26.3514 5.18506 15.6052     6.7752   10.1779     7.70598  8.38473    185.773     46.4504     185.773     
1 1 1 17 11 60 o 12 59.0883 3.33551 62.3983     9.73231  63.7865     9.85782  37.7575    206.824     2.02706     206.824     
1 1 1 17 11 61 o 14 83.8888 2.72791 120.279     11.0451  132.26      11.8344  55.5387    25.4671     3.21097     25.4672     
1 1 1 17 11 62 o 3  19.4955 5.32315 4.0885      6.36665  5.78958     8.35387  3.00351    125.632     20.6832     125.632     
1 1 1 17 11 63 o 5  81.1798 2.8845  125.079     11.8645  112.187     11.5196  50.2859    190.48      3.36033     10.4802     
1 1 1 17 11 64 f 0  73.6475 2.97661 95.5074     11.4492  100.09      10.3694  63.2236    340.936     0           0           
1 1 1 17 11 65 o 9  56.8892 3.76936 72.8189     12.2643  46.9933     9.05465  40.3908    78.6046     11.3613     78.6046     
1 1 1 17 11 66 o 13 85.017  3.12823 153.151     14.7982  109.939     11.8191  53.2801    69.881      1.68481     249.881     
1 1 1 17 11 67 o 14 41.0689 5.46612 37.0276     11.3546  28.1648     10.3281  23.4962    6.93198     1.06017     186.932     
1 1 1 17 11 68 o 18 35.1752 6.02643 28.8099     10.8576  20.2909     10.2885  15.3239    279.175     10.2379     99.1754     
1 1 1 17 11 69 o 9  84.5765 3.35377 137.738     13.8946  123.294     14.3526  63.799     166.528     21.0313     166.528     
1 1 1 17 11 70 o 9  113.497 3.04646 235.167     17.196   232.838     17.3943  88.6049    250.035     33.4374     250.035     
1 1 1 17 11 71 o 12 70.0529 3.5406  87.0381     13.2299  93.8209     11.2682  48.4466    349.836     9.76066     349.836     
1 1 1 17 11 72 o 10 30.2537 6.07401 15.1104     10.867   21.5708     8.89349  12.2266    93.5207     9.05762     273.521     
1 1 1 17 11 73 o 11 20.5565 5.59711 12.6054     9.5126   -2.66396    8.07818  4.34882    230.359     7.22437     50.3588     
1 1 1 17 11 74 o 17 32.5273 6.42769 21.1219     10.8472  22.9513     10.9269  17.5694    32.0896     8.79411     32.0896     
1 1 1 17 11 75 o 10 18.4358 5.60158 6.67114     9.71371  -10.2774    10.4957  0.017293   121.524     13.4288     301.526     
1 1 1 17 11 76 o 4  16.0779 5.41851 -8.51636    13.0455  -15.1185    10.7329  4.66767    41.6977     22.3254     41.6977     
1 1 1 17 11 77 o 9  21.987  6.48462 7.50917     12.0707  2.06267     11.8394  2.3898     274.944     16.8697     94.9441     
1 1 1 17 11 78 o 10 45.1457 6.74285 50.1995     14.3675  36.169      15.2186  32.8608    2.14069     14.9101     2.14069     
1 1 1 17 11 79 o 10 18.3131 5.90186 -0.854426   12.1492  -7.80361    11.9192  2.33387    324.754     3.04086     144.754     
1 1 1 17 11 80 o 19 22.15   6.5627  2.77383     11.9767  8.42331     12.6398  6.51855    135.802     3.10491     315.802     
1 1 1 17 11 81 o 18 26.1723 6.95835 2.06986     13.2484  22.7292     13.5489  4.16457    47.3562     18.7939     227.356     
1 1 1 17 11 82 f 0  22.6867 6.69534 -1.02448    13.0531  13.6464     13.2706  11.3002    140.229     0           0           
1 1 1 17 11 83 o 15 29.0085 7.03566 31.8041     14.0476  3.74718     14.0466  10.4541    150.847     2.91554     330.848     
1 1 1 17 11 84 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 12 0  o 11 389.533 4.69491 2693.45     91.5899  2693.45     91.5899  259.31     5.70243e-06 53.3782     180         
1 1 1 17 12 1  o 4  278.075 3.58812 1373.17     52.7112  1370.1      47.1438  263.819    344.466     139.18      344.466     
1 1 1 17 12 2  o 9  115.258 2.69457 240.042     15.9568  231.562     15.1284  59.0933    34.6348     9.73631     214.635     
1 1 1 17 12 3  o 6  191.36  2.85071 646.128     27.3675  652.452     27.3075  95.4252    238.705     75.6193     58.7054     
1 1 1 17 12 4  o 18 164.451 2.88655 474.051     23.7752  485.337     23.781   68.9915    245.155     87.5608     65.155      
1 1 1 17 12 5  o 18 134.285 2.7267  328.543     17.8341  311.528     18.7794  91.005     197.127     34.4623     197.127     
1 1 1 17 12 6  o 9  125.581 2.53679 280.751     15.908   278.877     15.9887  50.1804    47.371      61.3619     227.371     
1 1 1 17 12 7  o 2  300.4   3.53417 1633.56     55.8357  1568.19     50.5322  154.803    105.875     122.583     285.875     
1 1 1 17 12 8  o 11 225.667 2.97787 896.259     32.8662  909.855     34.4793  189.291    189.924     66.6016     189.924     
1 1 1 17 12 9  o 3  78.7938 2.6142  106.035     10.2258  114.678     10.3544  1.46456    74.5226     80.6659     254.523     
1 1 1 17 12 10 o 11 180.368 2.66754 593.127     24.0982  560.705     24.1109  79.8635    335.949     91.7048     155.949     
1 1 1 17 12 11 o 13 358.56  3.87908 2305.72     71.3506  2256.82     68.0452  267.989    10.7546     19.5838     10.7546     
1 1 1 17 12 12 o 8  252.587 3.17475 1157.11     37.1276  1106.21     42.8923  185.597    208.022     13.4942     208.022     
1 1 1 17 12 13 o 15 170.322 2.61337 522.547     21.7846  506.199     22.7967  146.426    168.093     70.8139     168.093     
1 1 1 17 12 14 o 15 64.621  2.99111 73.148      9.32897  75.6039     9.93584  2.47288    218.564     42.0108     38.5637     
1 1 1 17 12 15 o 5  122.16  2.84248 276.466     16.799   253.605     17.8683  81.7679    23.0636     48.2957     23.0636     
1 1 1 17 12 16 o 6  51.5596 3.39673 48.5331     8.13471  46.6086     9.15509  31.925     239.945     115.131     239.945     
1 1 1 17 12 17 o 14 98.419  2.91316 167.482     13.0307  176.734     15.5872  31.8593    228.773     61.9656     48.773      
1 1 1 17 12 18 o 14 478.607 5.31825 4070.39     123.757  4071.82     131.249  351.107    124.606     9.91628     124.606     
1 1 1 17 12 19 o 3  95.5653 2.85409 157.907     13.2326  166.652     14.0457  7.13818    84.459      113.06      264.459     
1 1 1 17 12 20 o 18 109.202 2.70285 219.56      14.3505  204.033     15.132   46.1391    240.442     52.0336     60.4424     
1 1 1 17 12 21 o 17 248.263 3.12017 1098.63     37.8466  1087.99     39.7589  240.998    182.082     134.632     182.082     
1 1 1 17 12 22 o 11 185.691 2.7016  615.036     23.9133  607.923     26.2962  109.43     170.305     41.1726     350.305     
1 1 1 17 12 23 o 10 309.785 3.44149 1714.77     50.9106  1690.92     55.7961  276.286    129.321     112.533     129.321     
1 1 1 17 12 24 o 3  332.745 3.56555 1939.53     56.6894  1990.42     62.1605  197.159    65.3993     81.7417     245.399     
1 1 1 17 12 25 o 15 212.41  2.85074 797.796     28.8892  802.712     31.7426  140.847    87.3815     16.2107     267.381     
1 1 1 17 12 26 o 16 162.85  2.57743 478.582     20.5131  462.102     21.5216  106.606    219.612     9.63438     39.6119     
1 1 1 17 12 27 o 11 123.12  2.43867 281.318     14.363   256.974     15.5953  74.4889    249.808     11.8791     69.8084     
1 1 1 17 12 28 o 6  81.757  2.56979 122.869     10.0464  114.751     10.9012  37.153     260.81      4.16425     80.8103     
1 1 1 17 12 29 o 14 115.547 2.47375 243.397     13.6545  230.653     14.8923  86.5065    154.681     38.0413     154.681     
1 1 1 17 12 30 o 12 275.573 3.10498 1369.28     41.8924  1325.78     43.8069  202.083    318.7       16.5408     318.7       
1 1 1 17 12 31 o 2  108.504 2.77785 229.068     14.1996  190.077     15.6817  43.6595    219.66      53.9114     39.6603     
1 1 1 17 12 32 o 13 74.5483 2.70079 104.174     10.118   93.6417     9.97936  15.7912    124.699     53.7858     304.699     
1 1 1 17 12 33 o 18 89.0916 2.46509 136.659     10.597   145.379     11.3749  0.100042   336.41      115.374     156.41      
1 1 1 17 12 34 o 4  327.249 3.30301 1904.95     52.0471  1896.76     56.2008  204.755    208.267     51.1681     28.267      
1 1 1 17 12 35 o 19 153.947 2.53881 431.1       18.7918  409.783     20.3044  131.531    16.9204     62.1197     16.9204     
1 1 1 17 12 36 o 5  77.187  2.65033 115.218     9.79109  97.0571     10.5152  25.5677    308.114     38.2062     128.114     
1 1 1 17 12 37 o 7  118.047 2.48938 244.24      14.0714  250.602     15.3363  81.8432    211.902     13.6364     211.902     
1 1 1 17 12 38 o 6  130.534 2.56373 308.71      16.3019  296.418     17.1728  107.489    41.9283     49.1577     41.9283     
1 1 1 17 12 39 o 13 179.237 2.48531 572.326     21.4317  567.619     23.1741  151.201    109.936     60.403      109.936     
1 1 1 17 12 40 o 15 266.665 2.9429  1273.91     37.756   1251.16     40.8101  190.463    331.437     10.9488     331.437     
1 1 1 17 12 41 o 13 185.527 2.68083 605.091     23.7798  616.873     26.0388  173.56     292.423     96.8866     292.423     
1 1 1 17 12 42 o 11 103.168 2.5131  194.851     12.4724  183.503     13.4195  69.1008    9.928       4.70863     9.92799     
1 1 1 17 12 43 o 8  44.2876 3.5924  33.8931     7.73481  36.8173     7.91803  6.72048    139.736     17.9822     319.736     
1 1 1 17 12 44 o 16 198.669 2.65457 711.877     25.106   690.123     27.6464  142.422    244.344     13.1034     244.344     
1 1 1 17 12 45 o 15 165.129 2.3322  484.327     19.1498  483.834     19.4483  122.486    86.5463     21.5771     86.5463     
1 1 1 17 12 46 o 6  280.703 2.90734 1366.69     40.7538  1435.22     41.0305  190.417    304.998     5.07415     124.998     
1 1 1 17 12 47 f 0  186.675 2.53787 606.763     24.022   631.673     23.4391  106.428    210.19      0           0           
1 1 1 17 12 48 o 12 52.952  3.24173 53.6504     8.56788  47.0546     8.44433  16.2825    344.305     27.7689     164.305     
1 1 1 17 12 49 o 15 87.7852 2.56623 137.175     11.4124  137.32      11.1158  65.4901    145.983     21.3089     145.983     
1 1 1 17 12 50 o 5  36.9967 4.44294 35.5668     7.6064   16.3979     7.74293  4.90156    166.031     12.9205     346.031     
1 1 1 17 12 51 o 16 148.465 2.45468 395.198     17.0942  388.943     19.343   114.84     159.526     32.1046     159.526     
1 1 1 17 12 52 o 17 120.077 2.51846 257.58      14.2181  256.097     15.999   86.3668    151.932     15.1793     151.932     
1 1 1 17 12 53 o 9  47.083  3.75517 41.4454     8.11333  38.9386     9.20377  18.8452    83.6899     2.1293      83.6899     
1 1 1 17 12 54 f 0  94.668  2.67124 156.936     12.7246  163.029     12.5631  54.8421    46.373      0           0           
1 1 1 17 12 55 o 13 113.543 2.4973  220.86      13.698   239.147     14.6926  92.2889    136.574     35.7307     136.574     
1 1 1 17 12 56 o 4  24.366  5.38128 10.2183     6.72625  11.3478     7.85632  0.848026   295.066     18.6327     115.066     
1 1 1 17 12 57 o 2  154.397 2.59243 412.305     19.311   438.751     20.8107  82.5074    308.271     40.7524     128.271     
1 1 1 17 12 58 f 0  82.4108 2.93734 118.909     11.9474  124.84      12.2364  66.3851    102.706     0           0           
1 1 1 17 12 59 f 0  58.0717 3.3645  59.9575     9.66696  62.0703     9.74308  40.9797    250.951     0           0           
1 1 1 17 12 60 o 8  65.1079 3.22409 73.6847     10.3212  79.4916     10.5817  36.4263    123.645     10.1962     303.645     
1 1 1 17 12 61 o 2  94.4868 2.67562 154.546     12.479   165.809     12.806   75.6957    216.657     29.5053     216.657     
1 1 1 17 12 62 o 13 54.604  3.69054 41.5827     9.29163  68.9677     10.3651  32.6495    266.657     2.52425     86.6571     
1 1 1 17 12 63 o 7  63.8655 3.30065 70.3002     9.99747  77.6798     10.9909  45.7556    43.0176     11.6283     43.0176     
1 1 1 17 12 64 o 5  19.0438 5.43147 0.879676    6.9271   6.31125     9.0896   3.9062     30.9933     24.5645     30.9933     
1 1 1 17 12 65 o 12 93.7598 3.00349 160.598     13.9463  156.716     14.1991  56.6129    238.982     7.37615     58.9825     
1 1 1 17 12 66 o 11 79.2489 3.12649 115.048     12.387   112.462     12.3473  56.9679    189.7       13.2705     189.7       
1 1 1 17 12 67 o 12 28.6456 6.09529 15.5762     9.74148  16.433      9.20134  12.6902    39.5222     4.89054     219.522     
1 1 1 17 12 68 o 4  52.8313 4.14563 49.415      11.4844  54.6787     9.87593  30.7496    339.021     4.02804     159.021     
1 1 1 17 12 69 o 7  65.7087 3.66936 75.9174     12.8763  83.4484     10.847   46.8445    305.402     11.6287     305.402     
1 1 1 17 12 70 o 16 28.1081 6.1211  16.8567     10.691   14.7153     8.28096  6.02459    31.3698     20.0761     211.37      
1 1 1 17 12 71 o 17 17.5907 5.37484 -3.62172    9.79764  2.93618     7.98597  1.50233    173.9       3.87528     353.9       
1 1 1 17 12 72 o 5  29.1215 6.43707 13.7869     10.7988  20.6418     10.3914  15.0398    144.241     3.17953     144.241     
1 1 1 17 12 73 o 18 23.9929 6.51864 10.1976     10.9482  8.89684     11.1051  6.41732    181.058     0.380555    1.05789     
1 1 1 17 12 74 o 7  22.6555 6.21556 13.9355     10.6555  -1.10233    11.0006  4.29104    178.783     1.75094     358.783     
1 1 1 17 12 75 o 12 17.0247 5.53833 -5.52048    11.3271  -5.36906    10.383   0.436069   257.179     11.5567     257.179     
1 1 1 17 12 76 o 3  32.4107 6.91928 25.695      12.1552  18.9766     12.4488  17.6425    342.406     1.38628     342.406     
1 1 1 17 12 77 o 16 28.2487 6.96338 20.2736     12.0606  11.5936     12.7078  6.72135    31.528      17.911      211.528     
1 1 1 17 12 78 o 16 23.2923 6.61854 12.2648     12.0002  2.87696     12.1661  8.13542    202.985     3.76315     22.9853     
1 1 1 17 12 79 o 16 18.7641 6.00123 -2.16352    11.7581  -2.69491    12.398   2.26267    169.069     10.4622     349.069     
1 1 1 17 12 80 o 12 46.8843 7.28792 40.9643     17.9728  59.5849     15.58    31.541     221.027     10.6068     221.027     
1 1 1 17 12 81 o 16 24.6391 7.18117 9.48855     15.7002  11.5777     13.1454  6.28525    283.259     2.38995     103.259     
1 1 1 17 12 82 o 12 21.3743 7.01541 13.7999     21.5048  -13.2983    12.3274  0.611095   44.7996     1.10496     224.8       
1 1 1 17 12 83 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 13 0  o 7  87.9695 2.73058 137.955     11.9849  137.955     11.9849  20.6963    180         79.7405     8.65213e-06 
1 1 1 17 13 1  o 10 182.575 2.69202 582.425     24.619   599.711     24.6391  127.903    122.819     3.04418     122.82      
1 1 1 17 13 2  o 18 74.7576 2.66784 103.091     9.9432   95.6651     9.96988  14.7828    300.101     31.374      120.101     
1 1 1 17 13 3  o 14 154.651 2.63642 436.855     20.9326  411.452     19.9369  79.0403    221.012     54.7669     41.0118     
1 1 1 17 13 4  o 1  165.546 2.84928 486.296     23.0047  485.641     24.2542  100.403    184.342     27.5372     4.34237     
1 1 1 17 13 5  o 6  310.582 3.70902 1715.68     56.1953  1707.3      59.2157  163.31     323.27      123.359     143.27      
1 1 1 17 13 6  o 11 525.243 5.31613 4943.71     139.947  4860.79     139.91   420.093    228.069     73.7871     228.069     
1 1 1 17 13 7  o 16 171.386 2.85207 506.825     25.1054  535.102     23.8213  68.7818    356.908     103.745     176.908     
1 1 1 17 13 8  o 19 197.455 3.06095 687.453     30.3089  695.498     30.268   118.198    39.4596     42.635      219.46      
1 1 1 17 13 9  o 5  309.526 3.9013  1671.4      58.7416  1729.27     62.2848  154.813    232.881     138.848     52.8813     
1 1 1 17 13 10 o 6  192.572 3.31654 659.051     30.9763  657.016     32.9747  181.526    295.427     101.414     295.427     
1 1 1 17 13 11 o 3  235.786 3.48055 1007.79     41.1428  965.092     41.0976  156.921    213.358     23.108      33.3578     
1 1 1 17 13 12 o 4  95.3721 2.94057 154.633     14.0351  168.76      13.9831  48.8506    356.178     16.8085     176.178     
1 1 1 17 13 13 o 9  221.428 3.45371 875.693     37.0408  864.084     39.5493  194.891    311.844     77.7565     311.844     
1 1 1 17 13 14 o 9  258.641 3.65977 1215.24     50.3612  1159.23     44.4463  204.067    189.044     37.9576     189.044     
1 1 1 17 13 15 o 19 152.271 2.92294 422.23      22.8908  400.964     21.6811  55.6947    319.338     102.558     139.338     
1 1 1 17 13 16 o 19 179.75  2.76638 588.912     25.5309  557.292     24.3129  168.368    273.874     92.521      273.874     
1 1 1 17 13 17 o 8  45.7485 3.38479 37.0903     7.76642  37.989      7.51729  22.2529    346.262     85.6259     346.262     
1 1 1 17 13 18 o 2  283.618 3.34333 1435.46     48.6244  1418.93     46.4005  244.202    26.1917     83.4537     26.1917     
1 1 1 17 13 19 o 19 200.908 3.23913 720.219     35.4153  712.009     29.5796  127.591    302.8       28.6309     122.8       
1 1 1 17 13 20 o 5  242.901 2.9303  1057.55     36.4114  1035.57     34.9257  237.477    267.049     135.008     267.049     
1 1 1 17 13 21 o 10 464.287 4.28586 3794.97     97.7081  3862.32     101.722  370.164    294.033     70.3465     294.033     
1 1 1 17 13 22 o 6  303.131 3.17037 1656.45     47.1685  1604.35     49.0954  166.037    336.371     102.746     156.371     
1 1 1 17 13 23 o 19 300.312 3.22636 1603.72     48.5376  1596.74     48.5749  232.04     326.679     35.7735     326.679     
1 1 1 17 13 24 o 12 269.934 2.99982 1311.05     39.7309  1274.38     41.3829  206.489    26.9685     29.9332     26.9685     
1 1 1 17 13 25 o 7  38.9041 3.6192  26.027      6.68582  28.661      7.08567  15.7194    232.594     51.2219     232.594     
1 1 1 17 13 26 f 0  129.459 2.41445 305.702     15.2834  289.226     15.9812  74.3334    183.059     0           0           
1 1 1 17 13 27 f 0  284.626 3.14575 1427.77     42.949   1447.28     46.7356  122.886    222.166     0           0           
1 1 1 17 13 28 o 6  54.6452 2.96575 55.9519     7.8668   50.6948     8.21325  3.71619    343.406     56.0405     343.406     
1 1 1 17 13 29 o 2  319.039 3.35933 1797.31     53.6925  1816.03     53.7271  245.962    22.4033     39.8035     22.4033     
1 1 1 17 13 30 o 15 185.006 2.857   617.546     24.3688  597.015     28.3815  151.354    290.441     50.0938     290.441     
1 1 1 17 13 31 o 9  206.067 2.7085  756.658     26.8232  749.905     29.0618  119.111    7.34741     49.5209     187.347     
1 1 1 17 13 32 o 3  118.755 2.55586 250.614     14.2848  250.148     16.0475  56.999     181.373     43.4844     1.37341     
1 1 1 17 13 33 o 13 163.257 2.55522 483.534     19.5926  462.15      22.0797  112.236    151.893     2.19461     151.893     
1 1 1 17 13 34 o 10 104.607 2.58813 196.429     12.3832  192.298     14.5931  29.9902    17.1462     78.3704     197.146     
1 1 1 17 13 35 o 4  114.432 2.59871 235.55      14.233   229.578     15.4884  80.0113    256.956     14.809      256.956     
1 1 1 17 13 36 o 13 267.214 3.08382 1240.53     39.5582  1295.03     43.0213  176.075    179.033     21.9615     359.033     
1 1 1 17 13 37 o 16 284.481 3.29322 1417.32     41.5369  1457.62     51.9208  193.483    24.8339     11.4123     204.834     
1 1 1 17 13 38 o 9  116.408 2.51731 236.321     13.7596  245.094     15.5501  96.1609    141.173     44.6375     141.173     
1 1 1 17 13 39 o 8  144.8   2.59307 375.024     17.4929  369.542     20.0149  98.284     35.4767     0.056076    215.47      
1 1 1 17 13 40 o 13 196.792 2.64062 684.536     25.0536  690.47      27.0016  158.325    309.423     45.7516     309.423     
1 1 1 17 13 41 o 10 127.697 2.43956 295.051     15.2578  284.312     15.9138  92.8525    236.218     14.852      236.218     
1 1 1 17 13 42 o 5  214.765 2.69019 815.447     28.3866  823.001     29.5149  172.582    121.253     49.4041     121.253     
1 1 1 17 13 43 o 7  266.024 3.07934 1250.99     38.5729  1265.46     43.4142  209.334    18.7974     50.6956     18.7974     
1 1 1 17 13 44 f 0  134.386 2.51208 312.82      16.6217  329.29      17.186   97.222     131.046     0           0           
1 1 1 17 13 45 o 9  128.619 2.52771 295.952     15.2395  292.341     17.2386  71.9876    275.185     29.5692     95.1855     
1 1 1 17 13 46 o 7  127.612 2.45348 300.214     15.4388  279.123     15.8775  104.082    173.807     39.009      173.807     
1 1 1 17 13 47 o 17 69.5894 2.84275 80.4151     9.50068  92.7038     10.2436  45.5874    319.407     8.94492     319.407     
1 1 1 17 13 48 o 6  250.481 2.71258 1106.86     33.2281  1125.93     34.8643  177.536    120.53      12.1608     120.53      
1 1 1 17 13 49 o 4  52.9279 3.31574 50.528      8.41521  50.2041     8.97975  22.4981    150.948     14.2779     330.948     
1 1 1 17 13 50 o 18 50.578  3.57349 59.0099     8.54776  34.9169     8.71611  22.7839    43.8724     6.28391     223.872     
1 1 1 17 13 51 o 19 125.992 2.50828 263.693     15.2139  302.586     16.4332  89.7135    2.3729      12.5027     2.3729      
1 1 1 17 13 52 o 7  73.0498 2.9471  88.7386     10.6651  102.532     10.787   46.9908    328.763     2.60292     328.763     
1 1 1 17 13 53 o 4  71.3602 2.8964  84.5358     9.9653   98.069      10.6602  37.219     248.951     17.3265     68.951      
1 1 1 17 13 54 o 2  68.8829 3.25587 88.104      9.82446  82.4936     12.2772  44.3115    222.847     0.152988    222.847     
1 1 1 17 13 55 o 11 22.6642 5.51494 7.09268     6.72614  10.3625     8.44597  0.344486   102.172     14.9797     282.172     
1 1 1 17 13 56 o 3  49.3603 3.9537  38.8391     9.19276  50.4774     9.9693   21.1761    43.9742     19.5589     223.974     
1 1 1 17 13 57 o 4  104.245 2.84274 195.198     14.5785  194.32      15.0621  68.5026    68.6573     0.629245    248.657     
1 1 1 17 13 58 o 5  83.1682 3.71086 119.658     11.8552  131.111     18.421   45.3761    275.184     18.0446     95.1837     
1 1 1 17 13 59 o 2  106.653 3.01883 206.751     14.8412  202.354     17.2389  77.5301    108.798     15.1301     108.798     
1 1 1 17 13 60 o 11 75.9597 3.70207 117.139     13.7796  93.2414     14.0434  33.7319    217.42      31.3242     37.4201     
1 1 1 17 13 61 o 10 35.0297 5.34104 25.5754     7.82491  21.3464     10.3419  17.8724    60.4175     8.39613     60.4175     
1 1 1 17 13 62 o 7  34.8652 5.15363 24.0004     7.87285  22.4627     9.5276   18.9812    49.2135     0.90256     49.2135     
1 1 1 17 13 63 o 9  67.2639 3.40671 78.2243     10.1193  86.3274     12.649   55.2037    137.582     26.4107     137.582     
1 1 1 17 13 64 o 14 93.89   3.33783 163.243     15.6547  156.529     15.6495  51.3743    17.167      18.8549     197.167     
1 1 1 17 13 65 o 10 70.3571 3.59249 100.628     12.4641  80.7972     12.5561  51.347     42.6223     13.4692     42.6223     
1 1 1 17 13 66 o 2  23.0204 5.77438 15.0997     9.02755  -0.148663   9.4225   2.79876    252.494     19.0781     72.4937     
1 1 1 17 13 67 o 9  23.4894 6.20175 4.87453     9.78434  12.4671     10.2017  7.98907    318.397     0.906091    138.397     
1 1 1 17 13 68 o 14 45.0981 5.41822 35.2812     11.4216  44.4287     12.1659  32.0262    131.139     10.1522     131.139     
1 1 1 17 13 69 o 13 29.945  6.66486 16.3176     10.518   20.26       11.8189  16.1991    162.764     1.64288     162.764     
1 1 1 17 13 70 o 17 20.9516 6.04424 9.22607     10.0139  -2.07732    10.9996  5.1593     195.669     4.01312     15.6691     
1 1 1 17 13 71 o 2  19.9114 5.8336  9.62887     9.96901  -9.14807    11.1566  3.73446    99.5793     6.53752     279.579     
1 1 1 17 13 72 f 0  37.0956 5.85014 25.5641     10.9314  30.6186     10.2945  18.7651    314.846     0           0           
1 1 1 17 13 73 o 17 21.5212 6.09318 -1.66845    10.3546  11.7007     10.6493  3.01029    318.339     12.5956     138.339     
1 1 1 17 13 74 o 14 23.9238 6.51166 3.8668      11.0731  14.3059     11.5586  2.25075    204.683     20.4965     24.6827     
1 1 1 17 13 75 o 17 39.045  6.50283 32.7301     12.3693  31.3454     12.6615  24.2581    246.42      4.35838     246.42      
1 1 1 17 13 76 o 10 30.9436 6.853   8.09112     13.9579  29.9604     12.3747  9.3359     64.3646     6.24565     64.3646     
1 1 1 17 13 77 o 11 56.1978 5.98893 80.0243     16.922   51.0317     15.3835  37.1907    211.328     7.09557     211.328     
1 1 1 17 13 78 o 10 19.4794 6.16804 -8.72904    13.2607  3.82956     12.283   3.73967    38.4307     5.57065     218.431     
1 1 1 17 13 79 o 5  25.2881 7.06601 1.34204     15.346   18.6895     13.1825  8.8423     355.229     1.75589     175.229     
1 1 1 17 13 80 o 18 19.9836 6.42354 0.538629    14.906   -2.8179     13.1166  1.70031    205.633     9.65313     25.6332     
1 1 1 17 13 81 f 0  27.4033 7.47833 13.4611     15.7961  19.7745     13.8338  1.86607    219.821     0           0           
1 1 1 17 13 82 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 14 0  o 6  47.2564 3.89453 41.185      8.89633  41.185      8.89633  1.12113    180         11.023      180         
1 1 1 17 14 1  o 15 151.325 2.9426  413.094     21.6422  399.834     22.9027  109.212    298.903     9.66329     298.903     
1 1 1 17 14 2  o 3  190.499 3.04497 645.604     29.0783  641.734     29.0604  90.9636    36.6614     91.1007     216.661     
1 1 1 17 14 3  o 19 192.421 3.0365  652.388     29.3005  661.071     29.2604  127.775    10.7283     18.5107     190.728     
1 1 1 17 14 4  o 19 150.05  2.86488 399.523     21.5274  399.656     21.5188  141.042    114.511     88.598      114.511     
1 1 1 17 14 5  o 14 189.364 3.58524 630.225     32.6293  643.3       35.327   153.618    210.82      40.605      210.82      
1 1 1 17 14 6  o 11 304.915 4.29727 1674.29     65.6596  1627.6      65.6598  249.345    88.3433     57.0705     88.3433     
1 1 1 17 14 7  o 2  323.635 4.30373 1859.75     72.0907  1859.93     67.4326  228.441    99.3156     13.5578     279.316     
1 1 1 17 14 8  o 3  166.15  3.1272  500.084     24.3209  479.799     27.5475  147.348    104.861     67.8777     104.861     
1 1 1 17 14 9  o 6  271.144 3.53443 1315.78     48.0199  1293.42     48.0301  123.37     82.1866     146.727     262.187     
1 1 1 17 14 10 o 15 187.518 3.0287  631.117     28.4548  616.351     28.4652  124.995    300.524     15.7665     120.524     
1 1 1 17 14 11 o 17 200.318 2.76371 707.87      27.734   715.431     27.754   140.881    156.208     2.83691     336.208     
1 1 1 17 14 12 o 15 322.198 3.62391 1840.67     59.8776  1844.03     57.1153  225.305    123.737     16.4624     303.737     
1 1 1 17 14 13 o 6  228.316 3.10315 928.63      33.7124  920.836     37.1981  157.657    104.157     11.3691     284.157     
1 1 1 17 14 14 o 7  130.095 2.61947 287.671     15.8876  313.363     18.2297  39.6357    58.231      101.566     238.231     
1 1 1 17 14 15 o 5  197.934 2.92952 700.246     27.5716  689.628     30.4509  115.091    142.745     51.3613     322.745     
1 1 1 17 14 16 o 18 189.85  2.82109 634.119     26.2627  644.474     27.4135  91.6322    352.429     86.7531     172.429     
1 1 1 17 14 17 o 1  341.28  3.75519 2108.44     62.663   2027.16     65.6732  281.477    168.973     70.7459     168.973     
1 1 1 17 14 18 o 12 108.017 2.63265 208.974     13.942   205.372     14.5058  57.4002    72.2462     25.5895     252.246     
1 1 1 17 14 19 o 7  104.934 2.76717 195.463     14.179   195.687     14.8654  19.6994    169.239     102.121     349.239     
1 1 1 17 14 20 o 7  154.755 2.82637 442.685     21.3253  407.614     22.4042  93.7226    279.017     26.5724     99.017      
1 1 1 17 14 21 o 3  448.1   4.57941 3563.29     100.376  3573.78     105.245  378.379    97.8111     109.783     97.8111     
1 1 1 17 14 22 o 12 345.471 3.79211 2145.08     64.078   2093.38     67.1462  214.566    190.998     68.2178     10.9982     
1 1 1 17 14 23 o 17 54.1142 3.09577 51.6146     8.08825  52.9855     8.55748  13.7137    20.5121     83.357      20.5121     
1 1 1 17 14 24 o 2  151.457 2.5603  419.235     18.9699  394.9       19.8308  72.7635    281.212     64.3266     101.212     
1 1 1 17 14 25 o 10 208.255 2.81698 777.726     28.732   761.104     30.0357  179.26     43.8363     68.986      43.8363     
1 1 1 17 14 26 o 3  64.7671 2.89085 78.8976     9.06433  70.6536     9.54792  14.3083    244.392     29.6102     64.3925     
1 1 1 17 14 27 o 11 40.5274 3.94463 23.3844     7.54248  36.8332     7.75623  8.21495    68.9678     32.0018     68.9678     
1 1 1 17 14 28 o 10 188.386 2.74255 653.956     25.2702  605.69      26.4276  139.186    54.079      17.0811     54.079      
1 1 1 17 14 29 o 15 134.037 2.62151 328.654     17.5782  309.37      17.5935  109.548    210.222     46.167      210.222     
1 1 1 17 14 30 o 8  136.183 2.72559 336.762     17.1429  321.906     19.8527  92.0469    57.4908     1.71888     57.4909     
1 1 1 17 14 31 o 2  118.305 2.58812 246.644     14.2686  250.415     16.3278  77.5735    227.444     0.832543    227.444     
1 1 1 17 14 32 o 10 131.121 2.48792 312.189     15.5933  298.299     17.0036  99.797     271.359     27.5805     271.359     
1 1 1 17 14 33 o 8  72.8376 2.81883 96.7068     9.75612  92.187      10.6933  10.1085    215.594     70.0278     35.5937     
1 1 1 17 14 34 o 11 77.1178 2.79171 99.741      10.0247  112.092     11.4898  30.8732    245.235     14.6004     245.235     
1 1 1 17 14 35 o 19 328.468 3.58752 1918.68     56.347   1916.16     61.6373  262.567    191.9       61.8089     191.9       
1 1 1 17 14 36 o 11 217.911 2.81292 842.816     28.1139  843.228     33.1182  132.517    14.851      40.0432     194.851     
1 1 1 17 14 37 o 17 161.799 2.54194 469.467     19.4579  459.843     21.6792  109.648    230.954     3.90952     50.9542     
1 1 1 17 14 38 o 6  144.049 2.40938 376.82      16.8372  359.813     17.9009  96.0641    276.014     5.11061     96.0145     
1 1 1 17 14 39 o 1  103.447 2.60653 193.04      13.4201  187.489     13.5575  64.1304    191.772     8.82726     11.7718     
1 1 1 17 14 40 o 14 77.4947 2.72649 97.3757     10.2994  116.953     10.7819  35.9861    40.4778     26.9797     220.478     
1 1 1 17 14 41 o 8  105.353 2.60333 203.144     13.2245  191.72      14.1692  57.2003    234.456     26.5378     54.4562     
1 1 1 17 14 42 o 3  150.605 2.46664 401.92      18.0032  403.806     19.2132  134.545    311.515     66.1888     311.515     
1 1 1 17 14 43 o 4  152.839 2.5185  425.343     19.03    404.867     19.5259  127.25     242.711     47.3545     242.711     
1 1 1 17 14 44 o 1  136.473 2.50428 334.017     16.237   328.221     17.94    122.318    269.706     62.6944     269.706     
1 1 1 17 14 45 o 5  158.92  2.48821 453.073     18.7261  444.827     20.8294  123.688    10.6205     31.1925     10.6205     
1 1 1 17 14 46 o 6  53.9057 3.30409 55.2427     8.94814  49.228      8.71517  13.467     231.468     38.6299     51.4677     
1 1 1 17 14 47 o 9  38.1355 4.17903 25.0853     7.55699  28.2546     7.89595  5.96049    300.695     6.6337      120.695     
1 1 1 17 14 48 o 13 99.0306 2.47827 183.858     11.9215  165.813     12.5697  68.2827    326.09      6.90054     326.09      
1 1 1 17 14 49 o 19 49.3889 3.43634 45.1324     8.22318  42.9029     8.54853  12.9729    105.973     31.6276     285.973     
1 1 1 17 14 50 o 7  148.548 2.4691  396.918     17.8855  388.859     18.8517  94.6558    202.667     11.3587     22.6669     
1 1 1 17 14 51 f 0  102.874 2.54091 190.706     12.4118  186.861     13.6994  75.7286    206.373     0           0           
1 1 1 17 14 52 o 17 57.1529 3.15969 55.1947     8.96931  62.4387     8.95665  31.478     76.1428     9.08255     256.143     
1 1 1 17 14 53 o 12 148.422 2.61347 407.597     19.9104  378.936     18.9561  118.365    5.36382     36.7906     5.36382     
1 1 1 17 14 54 o 14 115.867 2.64803 244.101     15.0575  235.881     15.6348  88.2848    48.5812     21.8906     48.5812     
1 1 1 17 14 55 o 18 26.2608 5.45511 16.3153     7.87668  9.32311     7.7387   1.33956    257.148     24.5277     77.1483     
1 1 1 17 14 56 o 16 91.9148 2.93262 147.132     12.3978  156.324     14.5175  51.0378    153.135     19.6707     333.135     
1 1 1 17 14 57 o 19 123.779 2.70815 268.23      15.1542  281.022     18.3152  82.2244    251.388     0.257034    71.3878     
1 1 1 17 14 58 o 8  119.757 2.66258 253.748     15.0521  260.507     16.8368  90.7018    345.723     22.9326     345.723     
1 1 1 17 14 59 o 16 50.2573 4.04025 52.0022     9.13731  41.2148     10.4616  29.1743    283.423     4.29364     103.423     
1 1 1 17 14 60 o 12 35.6431 5.35245 24.9438     9.07919  23.8445     9.44974  18.0101    122.342     4.1304      302.342     
1 1 1 17 14 61 o 19 18.3668 5.37152 5.28941     8.24585  -2.10224    8.30914  0.84437    161.55      13.0651     161.55      
1 1 1 17 14 62 o 8  18.1959 5.28537 3.28159     6.92126  1.63528     8.60068  4.22179    325.134     24.6581     325.134     
1 1 1 17 14 63 o 19 26.9732 5.52896 4.9404      7.61141  23.0115     9.56239  11.2531    326.496     2.1027      146.496     
1 1 1 17 14 64 o 17 75.6121 3.62271 115.961     13.6593  93.8055     13.5185  54.4953    130.799     11.9558     130.799     
1 1 1 17 14 65 o 18 16.9319 5.30733 -2.6303     8.89256  -1.22271    9.00778  0.892461   58.4353     3.72536     238.435     
1 1 1 17 14 66 o 10 23.0404 6.10808 -0.489989   9.36349  15.4748     10.9838  6.20607    285.209     0.446351    285.209     
1 1 1 17 14 67 o 17 35.6952 5.94623 32.3357     10.5549  19.3602     10.6751  4.49054    198.745     34.9813     18.7452     
1 1 1 17 14 68 o 18 19.9504 5.82084 -0.313735   9.57997  6.91228     9.63985  3.12858    45.0156     1.55877     225.016     
1 1 1 17 14 69 o 3  20.4777 5.88413 8.16661     9.71519  0.504609    9.597    2.17867    315.579     0.677889    135.579     
1 1 1 17 14 70 o 1  40.1527 6.12954 37.258      11.1286  28.9787     12.8332  20.8251    108.296     6.03501     288.296     
1 1 1 17 14 71 o 9  46.1743 5.36203 38.3895     11.6111  46.4582     12.3239  24.1291    54.7781     7.50715     234.778     
1 1 1 17 14 72 o 1  49.9808 5.92956 37.2552     14.4611  65.4937     13.1381  26.3365    70.3088     7.70757     250.309     
1 1 1 17 14 73 o 9  23.8068 6.74796 11.0838     13.1056  5.9633      11.407   4.30945    192.622     0.391937    192.622     
1 1 1 17 14 74 o 4  26.6587 7.03373 14.3375     13.4498  12.6831     11.7662  11.4113    340.605     3.67595     160.605     
1 1 1 17 14 75 o 6  35.6626 7.46788 29.9112     14.8501  26.7814     13.7367  14.7933    157.886     11.729      337.886     
1 1 1 17 14 76 o 3  27.2972 7.32805 2.71749     13.9918  24.3355     15.3656  9.34284    133.685     10.4909     313.685     
1 1 1 17 14 77 o 9  52.6533 6.83942 57.0635     16.4753  63.8884     18.2982  29.2049    43.3276     4.60939     223.328     
1 1 1 17 14 78 o 1  18.0145 6.01944 -11.8623    13.1193  -6.25558    15.2541  1.13385    14.845      7.61357     194.845     
1 1 1 17 14 79 o 1  22.8414 7.03399 3.28552     14.5425  8.41739     15.6528  3.97318    57.6626     10.8723     237.663     
1 1 1 17 14 80 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 14 81 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 15 0  o 15 361.98  4.24692 2326.2      76.9928  2326.2      76.9928  300.25     360         66.5417     360         
1 1 1 17 15 1  o 16 262.319 3.39238 1220.64     43.4063  1221.38     45.7551  246.788    71.199      117.107     71.199      
1 1 1 17 15 2  o 13 345.045 3.98242 2095.24     70.6414  2132.35     66.9991  283.214    237.075     63.6536     237.075     
1 1 1 17 15 3  o 15 195.582 2.89389 670.805     28.3383  686.226     28.388   184.648    214.572     96.4808     214.572     
1 1 1 17 15 4  f 0  89.7021 2.73354 140.363     12.2535  145.601     12.2623  53.1469    227.919     0           0           
1 1 1 17 15 5  o 1  411.758 4.51573 3011.93     90.6902  3012.06     95.6078  333.43     162.784     64.9216     162.784     
1 1 1 17 15 6  o 14 268.423 3.26043 1282.09     44.8781  1274.69     42.8207  179.553    279.785     30.007      99.7853     
1 1 1 17 15 7  o 8  179.873 2.83158 577.496     25.5331  570.237     25.5148  156.83     21.1171     63.4662     21.1171     
1 1 1 17 15 8  o 16 195.201 2.77891 668.53      27.1787  683.148     27.1875  173.124    12.3726     72.4597     12.3726     
1 1 1 17 15 9  o 2  259.804 3.06495 1205.79     39.0209  1189.14     40.7568  194.266    239.223     13.6506     239.223     
1 1 1 17 15 10 o 11 80.8244 2.83887 115.697     11.4268  116.618     11.4986  27.0529    217.202     8.10164     217.202     
1 1 1 17 15 11 o 6  195.65  2.98766 674.932     30.0174  683.213     28.541   139.715    220.855     1.68965     220.855     
1 1 1 17 15 12 o 12 114.119 2.69826 225.343     15.3956  237.205     15.4163  67.2207    252.046     16.1135     72.0459     
1 1 1 17 15 13 o 13 262.726 3.30934 1205.39     45.6182  1244.51     41.343   208.763    277.404     39.8325     277.404     
1 1 1 17 15 14 o 9  100.101 2.80021 174.313     13.6437  181.754     14.3961  8.41614    244.214     119.09      64.2144     
1 1 1 17 15 15 o 11 433.85  4.7033  3306.07     104.85   3385.61     99.5241  342.993    50.558      54.6395     50.5581     
1 1 1 17 15 16 o 18 295.545 3.37216 1544.06     49.9392  1556.37     49.9503  212.74     193.667     1.1559      13.6668     
1 1 1 17 15 17 o 12 112.934 2.53944 227.4       14.6326  225.449     14.072   72.7384    31.4174     49.9561     31.4174     
1 1 1 17 15 18 o 16 94.7107 2.56323 156.339     12.3627  162.337     11.9078  41.535     204.328     37.3423     24.3277     
1 1 1 17 15 19 o 17 147.534 2.57297 383.082     19.4083  389.274     18.6061  91.2343    261.653     21.0389     81.6531     
1 1 1 17 15 20 f 0  134.576 2.6891  318.314     19.3462  324.715     16.7683  90.369     359.314     0           0           
1 1 1 17 15 21 o 6  185.553 2.83338 614.609     25.6437  607.035     27.0233  118.012    285.602     25.2217     105.602     
1 1 1 17 15 22 o 2  543.301 5.24451 5216.34     142.778  5290.36     142.802  436.698    90.3425     86.3076     90.3425     
1 1 1 17 15 23 o 16 112.946 2.56829 233.326     14.518   219.787     14.5087  83.3695    117.661     53.1401     117.661     
1 1 1 17 15 24 o 6  124.661 2.63814 278.823     16.113   273.021     16.7965  100.061    30.6815     71.792      30.6815     
1 1 1 17 15 25 o 19 63.7094 3.07257 77.2219     9.51194  67.6678     9.92211  4.8253     133.898     61.2986     313.898     
1 1 1 17 15 26 o 7  134.052 2.69125 331.409     17.5552  306.934     18.498   91.9344    87.8962     3.65356     87.8961     
1 1 1 17 15 27 o 14 127.774 2.66338 295.999     16.5483  283.848     17.4844  93.0864    90.6404     17.3354     90.6404     
1 1 1 17 15 28 o 8  309.275 3.64982 1714.34     56.5556  1683.73     56.5784  217.331    176.919     6.76115     356.919     
1 1 1 17 15 29 o 17 32.7502 5.41225 26.3461     7.94526  13.0152     9.97623  12.1913    292.609     36.2621     292.609     
1 1 1 17 15 30 o 12 147.856 2.74092 394.039     19.7697  382.422     20.7823  92.9295    327.531     17.3927     147.531     
1 1 1 17 15 31 f 0  271.704 3.32764 1320.44     44.1685  1301.95     46.4059  152.717    315.64      0           0           
1 1 1 17 15 32 o 15 261.176 3.27018 1213.03     41.7109  1210.26     43.8636  178.3      202.772     13.282      22.7725     
1 1 1 17 15 33 o 11 164.406 2.7287  489.556     22.373   470.145     22.5793  138.016    49.0276     50.0594     49.0276     
1 1 1 17 15 34 o 2  153.735 2.74367 429.527     21.5029  410.301     20.7417  117.096    36.9767     22.3995     36.9767     
1 1 1 17 15 35 o 12 93.33   2.77123 157.793     13.5092  152.112     12.3475  54.6157    295.339     13.6184     115.339     
1 1 1 17 15 36 o 12 202.952 2.71081 725.662     28.6098  737.239     26.4722  155.885    147.357     28.0329     147.357     
1 1 1 17 15 37 o 12 130.765 2.54604 302.465     17.0601  305.245     16.2637  92.2515    85.1247     6.17689     85.1247     
1 1 1 17 15 38 o 4  89.8759 2.70637 138.107     12.632   149.519     11.6127  63.2108    131.698     11.2906     131.698     
1 1 1 17 15 39 o 16 150.233 2.49881 401.912     18.8186  399.806     18.8074  109.922    38.9744     13.4349     38.9744     
1 1 1 17 15 40 o 10 143.129 2.55436 350.604     18.1857  377.812     18.431   88.2265    310.461     20.3991     130.461     
1 1 1 17 15 41 o 13 231.003 2.85162 929.843     32.3538  968.294     33.6731  172.312    97.1259     22.8658     97.1259     
1 1 1 17 15 42 o 3  24.709  5.421   9.75936     7.60122  12.0245     7.27983  18.2863    209.331     54.9928     209.331     
1 1 1 17 15 43 o 19 108.744 2.50781 211.505     13.672   209.403     13.6245  83.2351    113.654     21.8505     113.654     
1 1 1 17 15 44 o 19 129.526 2.50298 292.99      15.9456  304.217     16.5196  79.1125    147.802     18.2404     327.802     
1 1 1 17 15 45 o 7  111.961 2.51724 227.374     13.8609  219.137     14.3342  99.8073    241.317     53.1581     241.317     
1 1 1 17 15 46 o 16 106.555 2.5343  201.015     13.4949  203.602     13.5322  61.0236    317.143     20.8625     137.143     
1 1 1 17 15 47 o 16 44.333  3.76545 40.5716     8.18952  31.1149     8.08292  7.19628    111.087     36.0174     291.087     
1 1 1 17 15 48 o 2  62.1002 3.03228 69.6371     9.26326  68.671      9.49071  43.8786    175.219     20.6555     175.219     
1 1 1 17 15 49 o 3  71.004  2.98345 93.0176     10.7014  87.6691     10.434   33.8918    97.3499     24.7463     277.35      
1 1 1 17 15 50 o 2  101.151 2.72523 173.116     13.5333  192.742     14.0373  67.5996    40.3021     0.371244    220.302     
1 1 1 17 15 51 o 4  58.3941 3.29908 54.6691     9.55352  68.6329     9.4785   22.0751    187.502     32.4023     7.50179     
1 1 1 17 15 52 o 5  55.7598 3.54481 51.7019     9.78467  61.0579     9.75089  34.6156    292.017     1.79935     112.017     
1 1 1 17 15 53 o 2  100.953 2.68522 182.585     13.743   182.208     13.3764  74.1475    147.225     13.4316     147.225     
1 1 1 17 15 54 f 0  23.5029 5.31708 11.6569     7.09481  8.2146      7.17598  20.6008    281.923     0           0           
1 1 1 17 15 55 o 13 76.6495 2.82738 110.692     11.0912  100.536     10.5552  70.997     21.1184     44.2409     21.1184     
1 1 1 17 15 56 o 1  23.3354 5.29494 4.24044     7.69668  14.2643     7.2727   1.36345    283.236     19.2416     103.236     
1 1 1 17 15 57 o 1  62.5297 3.3261  74.0846     10.685   67.7458     10.0113  45.1012    103.945     10.262      103.945     
1 1 1 17 15 58 o 14 39.4376 4.80072 31.5506     8.44518  27.1673     9.701    18.1896    262.815     11.3331     82.8153     
1 1 1 17 15 59 o 14 31.552  5.5763  13.1304     8.85998  25.6661     9.18037  4.72769    27.0634     28.0855     207.063     
1 1 1 17 15 60 o 14 22.9293 5.83371 5.89363     7.97435  11.4835     9.26397  0.3204     244.039     24.4999     244.039     
1 1 1 17 15 61 o 13 54.8515 4.00057 51.6935     10.1661  59.4139     11.5251  29.8905    148.738     10.1269     328.738     
1 1 1 17 15 62 o 3  49.3115 4.60938 42.4082     11.0537  48.9956     11.1163  25.9373    320.693     10.3921     140.693     
1 1 1 17 15 63 o 10 47.0339 4.77705 39.1548     11.0321  44.7869     10.7691  33.3081    286.191     8.64916     286.191     
1 1 1 17 15 64 o 7  94.4122 3.24744 155.089     15.2149  169.968     15.4053  64.3427    252.682     5.88465     252.682     
1 1 1 17 15 65 o 2  25.9605 6.31212 11.8869     10.0933  13.5098     9.79837  5.05531    301.063     2.31018     301.063     
1 1 1 17 15 66 o 14 29.4205 6.15647 18.5959     9.81574  16.435      9.63419  14.9493    116.132     2.36286     296.132     
1 1 1 17 15 67 o 4  42.965  5.41032 32.4505     11.3298  40.7926     11.0137  27.2891    342.257     2.56239     342.257     
1 1 1 17 15 68 o 17 23.2975 6.3904  12.0085     11.6984  5.36425     9.71501  2.86046    43.5274     19.4765     223.527     
1 1 1 17 15 69 o 15 23.4465 6.395   13.7001     11.6515  3.9049      9.98405  6.91468    231.11      8.01846     51.1105     
1 1 1 17 15 70 o 16 37.8598 6.72893 31.5813     13.0303  29.4965     12.4738  16.8294    287.9       10.8158     107.9       
1 1 1 17 15 71 o 18 28.0829 7.15525 10.0506     13.4451  20.7403     13.0219  8.08426    188.729     14.0134     8.72939     
1 1 1 17 15 72 o 9  32.1082 7.72196 26.4256     16.3457  18.9269     13.3738  13.4469    253.578     8.94931     73.5782     
1 1 1 17 15 73 o 17 27.942  7.01838 23.8423     13.0603  4.72722     13.6621  14.4973    21.2786     2.17341     21.2786     
1 1 1 17 15 74 o 1  22.0868 6.63037 -3.16815    12.7321  10.2602     13.503   2.19714    196.354     0.377062    196.354     
1 1 1 17 15 75 o 4  40.6274 7.46672 33.6194     15.3707  41.399      15.4349  22.6886    243.971     2.0031      63.9712     
1 1 1 17 15 76 o 4  24.7285 6.86401 16.6255     13.1914  5.14841     12.1964  8.92807    131.612     0.856441    131.612     
1 1 1 17 15 77 o 18 37.1993 7.78737 36.3391     15.7606  31.381      15.3797  22.7507    139.714     6.72438     139.714     
1 1 1 17 15 78 o 19 22.3091 6.74402 11.4784     13.2245  -1.14545    14.4764  3.46652    215.658     11.2159     35.6579     
1 1 1 17 15 79 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 16 0  o 2  206.927 2.99422 760.11      31.0207  760.11      31.0207  168.064    4.4708e-06  30.3836     4.4708e-06  
1 1 1 17 16 1  o 8  311.663 3.47648 1728.56     54.2986  1719.52     54.2976  196.941    312.66      61.3823     132.66      
1 1 1 17 16 2  o 19 206.853 2.85543 771.627     29.5943  746.515     29.5998  199.148    62.0088     107.716     62.0088     
1 1 1 17 16 3  o 9  83.0348 2.69226 118.436     11.1621  126.729     11.1749  30.3754    32.2844     11.0221     32.2844     
1 1 1 17 16 4  o 12 119.581 2.53086 255.406     15.1501  252.247     15.1486  95.9924    2.8667      43.9805     2.8667      
1 1 1 17 16 5  o 15 139.282 2.61169 347.872     18.2309  340.763     18.195   95.0328    278.402     1.1913      98.4022     
1 1 1 17 16 6  o 2  154.37  2.70587 421.051     20.3965  424.587     21.4426  73.3195    79.7884     71.857      259.788     
1 1 1 17 16 7  o 11 249.021 3.13769 1103.04     40.0804  1097.62     38.2149  136.413    287.328     88.6606     107.328     
1 1 1 17 16 8  o 17 203.943 2.75234 732.815     28.7226  742.766     27.5157  177.118    195.932     65.5648     195.932     
1 1 1 17 16 9  o 7  188.502 2.73892 630.135     25.8524  630.446     25.8947  132.044    46.9125     3.90785     226.912     
1 1 1 17 16 10 f 0  164.928 2.70797 476.934     22.9105  488.077     21.8255  91.8964    261.4       0           0           
1 1 1 17 16 11 o 8  217.912 2.89236 847.838     31.5869  837.05      31.5842  174.825    239.612     38.5424     239.612     
1 1 1 17 16 12 o 9  342.48  3.7656  2062.9      66.1409  2102.7      63.0464  271.043    51.54       43.8763     51.5401     
1 1 1 17 16 13 o 17 256.656 3.12065 1178.4      40.1345  1159.46     40.1399  186.111    107.056     1.91862     107.057     
1 1 1 17 16 14 o 9  78.5628 2.88228 106.074     11.3032  113.581     11.3046  7.56652    36.0106     85.0774     216.011     
1 1 1 17 16 15 o 11 264.443 3.49344 1247.25     46.2847  1235.67     46.3072  181.813    298.273     18.1504     118.273     
1 1 1 17 16 16 o 19 454.47  4.72465 3686.86     107.606  3658.81     107.604  357.609    15.7834     52.7083     15.7834     
1 1 1 17 16 17 o 14 317.449 3.68939 1777.02     58.6771  1802.05     58.7078  237.522    277.536     15.5438     277.536     
1 1 1 17 16 18 o 11 217.212 2.9629  826.744     31.4735  847.678     33.028   152.211    355.422     5.48962     175.422     
1 1 1 17 16 19 o 4  232.628 3.05379 949.056     34.7273  971.685     36.4701  102.678    93.2425     129.527     273.243     
1 1 1 17 16 20 o 9  147.223 2.75425 385.092     20.2803  384.509     20.3255  76.5802    150.347     52.2345     330.347     
1 1 1 17 16 21 o 11 209.239 2.87221 765.553     30.11    788.185     30.1205  149.088    20.3749     0.986625    20.375      
1 1 1 17 16 22 o 19 310.141 3.31395 1694.25     51.5174  1720.98     51.4938  220.252    204.661     6.43023     24.6609     
1 1 1 17 16 23 o 17 120.408 2.54253 266.135     15.6183  248.831     15.0323  88.3387    206.639     18.9025     206.639     
1 1 1 17 16 24 o 5  227.953 2.83278 925.211     32.3519  918.947     32.3695  137.751    300.151     49.9556     120.151     
1 1 1 17 16 25 o 15 172.679 2.53851 525.833     21.9463  532.143     21.9881  100.587    281.329     41.7963     101.329     
1 1 1 17 16 26 o 16 38.0247 4.29243 28.6771     7.87871  24.1158     7.88841  6.51328    99.9812     27.4936     99.9812     
1 1 1 17 16 27 o 17 331.916 3.53956 1974.42     60.1569  1940.09     57.586   257.016    331.846     37.9766     331.846     
1 1 1 17 16 28 o 7  70.4776 3.193   91.6069     10.7487  85.5845     11.6268  19.2016    291.152     48.1927     111.152     
1 1 1 17 16 29 o 2  104.966 2.49059 194.617     12.7928  196.84      13.3691  64.3955    115.837     10.6592     295.838     
1 1 1 17 16 30 o 3  157.821 2.53389 450.339     19.5864  433.805     20.4636  102.703    75.1945     15.1609     255.194     
1 1 1 17 16 31 o 12 77.741  2.79704 115.351     10.5166  100.087     11.1105  29.7809    193.303     41.4194     13.3033     
1 1 1 17 16 32 o 8  375.882 3.66589 2493.85     67.6494  2532.09     70.4492  325.321    345.042     113.956     345.042     
1 1 1 17 16 33 o 19 135.126 2.50204 317.289     16.6172  331.497     17.2418  80.2512    109.187     27.0707     289.188     
1 1 1 17 16 34 o 19 35.4092 4.62092 20.2522     8.03754  26.0264     7.69339  1.52919    151.791     22.648      151.791     
1 1 1 17 16 35 o 4  197.73  2.76179 671.974     27.3443  717.627     27.3677  149.881    73.4868     22.1459     73.4868     
1 1 1 17 16 36 o 12 64.6981 3.16896 74.5739     10.5527  75.0282     9.85425  28.5698    279.143     22.4952     99.1434     
1 1 1 17 16 37 f 0  126.711 2.54686 293.387     16.2082  277.637     16.0978  66.4913    291.316     0           0           
1 1 1 17 16 38 o 11 56.391  3.29664 61.9352     9.21053  52.2577     9.19947  13.6648    55.0785     42.2105     235.079     
1 1 1 17 16 39 o 10 137.873 2.56769 319.393     17.6856  357.099     17.7393  120.246    351.767     52.9296     351.767     
1 1 1 17 16 40 o 4  126.771 2.58259 286.707     16.2287  285.222     16.549   107.179    48.903      42.8613     48.903      
1 1 1 17 16 41 o 7  72.4725 3.07897 93.4523     10.8482  94.3257     11.4087  19.559     210.359     56.9044     30.3586     
1 1 1 17 16 42 o 7  155.721 2.56141 422.129     19.7267  440.721     20.2518  84.919     124.311     45.874      304.311     
1 1 1 17 16 43 o 4  123.411 2.52499 273.345     15.4369  269.121     15.7576  58.7423    305.564     51.7839     125.564     
1 1 1 17 16 44 o 15 62.4818 3.18468 66.7336     10.2711  73.4071     9.45923  21.3269    205.277     37.1178     25.2773     
1 1 1 17 16 45 o 6  83.5507 2.85121 120.373     12.0751  129.195     11.7022  47.5369    7.56438     14.6738     187.564     
1 1 1 17 16 46 o 15 53.4431 3.55924 44.4069     9.405    59.264      9.22748  30.408     110.021     13.8749     110.021     
1 1 1 17 16 47 o 19 61.7421 3.22797 74.6316     9.8685   62.6714     9.89932  46.3652    291.83      19.946      291.83      
1 1 1 17 16 48 o 10 59.5864 3.29255 66.1317     9.69666  61.7609     9.79729  43.8846    176.694     14.1028     176.694     
1 1 1 17 16 49 o 2  44.567  3.95988 33.9097     8.55544  38.739      8.71774  16.1559    285.598     24.2605     105.598     
1 1 1 17 16 50 o 10 70.8861 2.9733  97.0218     10.4692  83.6481     10.5103  34.697     190.146     25.2166     10.1462     
1 1 1 17 16 51 o 5  18.3614 5.01292 -0.556149   6.81454  7.33556     6.8903   0.822839   60.0444     6.15326     60.0444     
1 1 1 17 16 52 o 5  55.5868 3.39184 57.544      9.08567  54.4037     9.59537  33.7495    41.2908     4.00817     221.291     
1 1 1 17 16 53 o 15 30.9667 5.16268 17.3644     7.86228  19.2439     7.90614  10.2757    216.307     13.5102     36.3073     
1 1 1 17 16 54 o 7  14.9032 4.62896 -3.86209    6.80647  0.435843    6.67369  5.9111     294.064     20.0121     294.064     
1 1 1 17 16 55 o 17 22.9095 5.40418 7.13872     7.37243  11.3221     7.34743  2.08223    186.135     28.1828     186.135     
1 1 1 17 16 56 o 15 22.8757 5.48424 11.1097     7.52638  7.10754     7.61635  2.98775    281.08      2.89288     101.08      
1 1 1 17 16 57 o 6  74.9247 2.98866 104.542     11.1769  98.1603     11.1669  55.6853    336.602     13.4775     336.602     
1 1 1 17 16 58 o 12 89.1764 2.99976 150.983     14.1206  136.252     12.6224  69.1521    57.4352     21.0003     57.4352     
1 1 1 17 16 59 o 8  41.1458 5.22017 23.8945     10.253   41.8658     10.1772  23.4983    336.529     3.00023     156.529     
1 1 1 17 16 60 o 7  54.3133 3.92806 50.9831     10.0971  57.9644     10.9909  30.8577    296.152     7.93826     116.152     
1 1 1 17 16 61 o 12 26.9369 5.60886 18.0535     7.90511  9.37424     8.92372  11.2066    61.1078     6.41342     241.108     
1 1 1 17 16 62 o 7  53.4645 3.85118 55.4492     9.67387  50.503      10.5725  36.9242    195.77      5.9317      195.77      
1 1 1 17 16 63 o 10 25.6848 6.16467 12.7455     9.46928  12.1734     9.46382  11.1307    172.749     3.86769     352.749     
1 1 1 17 16 64 o 7  56.9055 4.79221 69.545      13.8027  54.6126     12.9115  33.1795    21.4531     6.40288     201.453     
1 1 1 17 16 65 o 17 14.8586 5.0021  -6.99384    10.2109  -17.3279    10.5536  1.87335    29.5671     14.6942     29.5671     
1 1 1 17 16 66 o 18 20.2699 6.15415 7.18951     12.0737  -5.02064    10.9406  3.08774    274.354     13.0163     94.3535     
1 1 1 17 16 67 o 2  39.6059 6.6892  34.0996     13.6451  32.1188     12.5451  22.6415    92.2766     1.96486     272.277     
1 1 1 17 16 68 o 7  27.3699 7.15314 12.5077     13.0803  16.3839     12.9818  11.3913    222.087     4.51591     42.0868     
1 1 1 17 16 69 o 4  27.0251 6.73358 20.9228     11.5009  5.48604     12.9388  11.2182    269.873     2.06906     89.8734     
1 1 1 17 16 70 o 13 15.597  5.18999 -7.7422     10.6303  -9.56649    10.2187  0.0190547  73.7323     2.00879     73.7324     
1 1 1 17 16 71 o 2  21.1372 6.37254 2.5562      12.2964  4.03947     11.5058  5.3408     255.354     2.52575     75.354      
1 1 1 17 16 72 o 8  24.2707 6.73205 2.48141     12.4029  15.1878     12.4001  7.43317    43.767      2.45651     43.7671     
1 1 1 17 16 73 o 13 35.9163 6.93938 32.4664     12.4636  24.1746     13.5883  18.3109    54.3904     13.7734     54.3904     
1 1 1 17 16 74 o 17 19.0527 6.02691 0.831972    11.4419  -3.18165    12.2924  3.92954    25.9402     4.23156     205.94      
1 1 1 17 16 75 o 2  22.0996 6.52132 11.151      11.8972  -0.656027   13.1034  4.72999    323.867     0.672502    143.867     
1 1 1 17 16 76 o 18 18.4582 5.85995 -13.2826    11.7054  6.42268     12.0584  1.21721    259.457     9.16668     79.4573     
1 1 1 17 16 77 o 16 23.1548 6.89708 10.1489     13.632   6.70291     13.7218  2.44589    43.945      0.971799    223.945     
1 1 1 17 16 78 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 17 17 0  o 15 585.464 7.54221 6093.15     221.123  6093.15     221.123  490.292    180         114.046     180         
1 1 1 17 17 1  o 16 84.1306 2.64255 126.218     11.0912  126.218     11.0912  22.2769    30          10.673      30          
1 1 1 17 17 2  o 18 364.865 3.71548 2362.84     67.9055  2362.84     67.9055  275.354    240         10.7352     240         
1 1 1 17 17 3  o 15 56.2669 3.127   57.1705     8.68857  57.1705     8.68857  6.56187    90          38.5603     270         
1 1 1 17 17 4  o 10 244.755 2.95279 1063.08     36.1942  1063.08     36.1942  171.524    300         19.0502     120         
1 1 1 17 17 5  o 19 21.5771 6.52881 11.7633     7.20637  11.7633     7.20637  10.2241    330         22.9345     330         
1 1 1 17 17 6  o 7  212.519 3.00186 801.774     31.9417  801.774     31.9417  90.2877    360         133.659     180         
1 1 1 17 17 7  o 17 293.477 3.72341 1529.25     54.7218  1529.25     54.7218  217.936    30          2.08796     29.9999     
1 1 1 17 17 8  o 1  104.038 2.59896 192.602     13.512   192.602     13.512   0.566553   240.012     0.409617    240.012     
1 1 1 17 17 9  o 17 101.445 2.60944 183.163     13.226   183.163     13.226   84.8921    90          38.3607     90          
1 1 1 17 17 10 o 18 212.743 2.87908 803.352     30.6699  803.352     30.6699  140.054    120         33.9024     300         
1 1 1 17 17 11 o 16 20.4908 6.53345 10.8066     7.19691  10.8066     7.19691  37.0293    330         81.8904     330         
1 1 1 17 17 12 o 1  251.696 2.94653 1124.2      37.1432  1124.2      37.1432  218.428    180         65.8035     180         
1 1 1 17 17 13 o 13 488.355 4.57709 4235.42     111.973  4235.42     111.973  451.439    30          183.438     30          
1 1 1 17 17 14 o 9  194.173 2.67682 669.203     26.0253  669.203     26.0253  109.107    240         67.6264     60          
1 1 1 17 17 15 o 18 210.353 3.0481  785.62      32.1016  785.62      32.1016  122.007    90          65.3972     270         
1 1 1 17 17 16 o 2  189.514 2.62702 637.48      24.9281  637.48      24.9281  181.692    300         84.8709     300         
1 1 1 17 17 17 o 14 110.766 2.66331 218.279     14.7452  218.279     14.7452  81.7816    150         2.20265     150         
1 1 1 17 17 18 o 18 398.058 4.11557 2813.66     82.0594  2813.66     82.0594  254.264    180         75.3802     360         
1 1 1 17 17 19 o 15 53.71   3.45961 52.4292     9.12517  52.4292     9.12517  5.49326    210         43.7666     30          
1 1 1 17 17 20 o 15 54.0867 3.71618 53.3512     9.83967  53.3512     9.83967  5.73392    60          46.608      240         
1 1 1 17 17 21 o 2  76.5327 3.33191 105.069     12.6669  105.069     12.6669  46.422     270         2.68613     90          
1 1 1 17 17 22 o 5  64.3559 3.57067 74.824      11.3482  74.824      11.3482  15.1218    300         56.5185     120         
1 1 1 17 17 23 o 8  107.26  2.83647 204.872     15.1982  204.872     15.1982  48.7383    150         58.9086     330         
1 1 1 17 17 24 o 14 356.976 3.97698 2263.59     71.1066  2263.59     71.1066  321.381    180         122.751     180         
1 1 1 17 17 25 o 4  105.517 2.87019 198.34      15.1262  198.34      15.1262  79.43      210         5.86668     210         
1 1 1 17 17 26 o 2  217.062 2.87119 836.55      31.2078  836.55      31.2078  156.425    60          2.47375     240         
1 1 1 17 17 27 o 17 218.655 3.43919 849.685     37.6435  849.685     37.6435  185.743    90          54.3134     90          
1 1 1 17 17 28 o 2  79.0669 3.0844  111.919     12.1359  111.919     12.1359  35.0277    120         44.1038     300         
1 1 1 17 17 29 o 7  150.224 2.57343 400.939     19.348   400.939     19.348   146.709    330         76.1868     330         
1 1 1 17 17 30 o 2  11.0318 5.06709 -0.473426   6.70282  -0.473426   6.70282  36.9686    360         77.8447     360         
1 1 1 17 17 31 o 6  13.2622 5.66326 3.01839     6.88618  3.01839     6.88618  36.032     210         77.9165     210         
1 1 1 17 17 32 o 13 107.462 2.58961 205.571     13.9093  205.571     13.9093  19.7392    240         115.137     60          
1 1 1 17 17 33 o 6  229.01  2.85226 931.553     32.7115  931.553     32.7115  173.774    270         18.6421     270         
1 1 1 17 17 34 o 12 21.3684 6.62518 11.6899     7.40275  11.6899     7.40275  10.4264    300         27.7997     300         
1 1 1 17 17 35 o 9  71.0529 2.87395 90.485      10.1562  90.485      10.1562  22.7964    150         16.5061     150         
1 1 1 17 17 36 o 17 14.0849 5.84273 4.13476     6.94287  4.13476     6.94287  1.67468    360         3.74875     360         
1 1 1 17 17 37 o 9  172.123 2.56214 526.499     22.0785  526.499     22.0785  137.276    210         29.2529     210         
1 1 1 17 17 38 o 3  54.9133 3.29629 54.729      8.91496  54.729      8.91496  14.275     240         48.7336     60          
1 1 1 17 17 39 o 15 14.7333 5.95544 4.99815     6.92831  4.99815     6.92831  42.2       270         95.9007     270         
1 1 1 17 17 40 o 11 172.46  2.78439 529.121     24.0362  529.121     24.0362  105.512    300         33.1907     120         
1 1 1 17 17 41 o 10 15.9701 6.39375 6.05967     7.88069  6.05967     7.88069  13.784     150         33.0237     150         
1 1 1 17 17 42 o 7  62.6435 3.41387 71.0568     10.567   71.0568     10.567   28.2737    360         31.4013     180         
1 1 1 17 17 43 o 1  168.637 2.65182 506.032     22.3858  506.032     22.3858  163.966    30          90.769      30          
1 1 1 17 17 44 o 19 15.6565 6.2487  5.88681     7.49628  5.88681     7.49628  23.7033    240         57.842      240         
1 1 1 17 17 45 o 10 22.8279 6.61321 13.0862     7.45967  13.0862     7.45967  1.38202    90.0001     9.23808     90.0001     
1 1 1 17 17 46 o 18 16.3566 6.47957 6.56438     7.98409  6.56438     7.98409  1.27219    120         3.98141     120         
1 1 1 17 17 47 o 8  8.08264 4.02285 -7.19944    6.37901  -7.19944    6.37901  17.2077    330         37.7245     330         
1 1 1 17 17 48 o 17 55.537  3.55358 56.3559     9.69471  56.3559     9.69471  46.0711    1.65231e-06 15.2469     1.65231e-06 
1 1 1 17 17 49 o 10 47.5436 3.855   41.9465     8.87226  41.9465     8.87226  18.068     30          29.6965     210         
1 1 1 17 17 50 o 9  10.0193 4.7715  -2.85319    6.87872  -2.85319    6.87872  5.35818    60          12.7608     60          
1 1 1 17 17 51 o 2  27.3626 6.51164 17.4215     7.97564  17.4215     7.97564  8.90877    90          0.948875    270         
1 1 1 17 17 52 o 9  37.8239 5.39775 28.6775     9.06546  28.6775     9.06546  28.7675    120         11.6524     120         
1 1 1 17 17 53 o 7  39.905  5.19012 31.4139     9.34381  31.4139     9.34381  31.4765    150         11.0296     150         
1 1 1 17 17 54 o 1  31.5038 5.96177 21.347      8.13249  21.347      8.13249  18.0107    360         6.35854     360         
1 1 1 17 17 55 o 19 14.2754 6.00873 4.19025     7.53609  4.19025     7.53609  1.4337     30.0001     5.62767     30.0001     
1 1 1 17 17 56 o 18 31.4555 5.99459 21.3605     8.16559  21.3605     8.16559  15.7556    60          9.56856     240         
1 1 1 17 17 57 o 8  55.726  3.50114 56.9394     9.59174  56.9394     9.59174  47.5749    270         19.7871     270         
1 1 1 17 17 58 o 3  76.1411 2.94269 104.531     11.1514  104.531     11.1514  65.7104    300         28.7305     300         
1 1 1 17 17 59 o 15 51.8376 4.06542 50.153      10.2294  50.153      10.2294  31.6689    150         6.34858     330         
1 1 1 17 17 60 o 4  56.0752 4.30944 58.8332     11.7478  58.8332     11.7478  34.7641    180         5.60776     8.6506e-06  
1 1 1 17 17 61 o 5  34.0991 6.85262 25.9524     10.1432  25.9524     10.1432  24.9365    30          5.16256     30          
1 1 1 17 17 62 o 13 52.2141 5.64583 53.4765     13.7489  53.4765     13.7489  34.9995    60          0.507029    59.9996     
1 1 1 17 17 63 o 1  12.2166 5.87188 -4.85912    10.9035  -4.85912    10.9035  5.39799    89.9999     20.5738     89.9999     
1 1 1 17 17 64 o 19 11.5978 5.54173 -3.5677     9.42894  -3.5677     9.42894  4.5505     300         16.2605     300         
1 1 1 17 17 65 o 15 20.0275 8.13657 10.9736     13.0279  10.9736     13.0279  3.65791    330         15.2283     150         
1 1 1 17 17 66 o 10 21.2094 7.85701 13.0683     10.9905  13.0683     10.9905  4.47357    8.64744e-06 36.0634     8.64744e-06 
1 1 1 17 17 67 o 16 9.26122 4.71147 -17.291     10.7233  -17.291     10.7233  0.918522   210         2.38258     210         
1 1 1 17 17 68 o 10 54.307  4.95048 57.0161     12.8583  57.0161     12.8583  41.0351    60          11.3386     60          
1 1 1 17 17 69 o 4  60.2293 4.72112 69.1575     13.8029  69.1575     13.8029  45.5915    90          13.0294     90          
1 1 1 17 17 70 o 11 21.7503 8.05243 13.9255     11.5387  13.9255     11.5387  8.51555    300         6.36751     120         
1 1 1 17 17 71 o 16 16.1633 7.08781 4.92434     11.4514  4.92434     11.4514  1.65835    330         9.66506     150         
1 1 1 17 17 72 o 14 42.396  7.3406  39.8067     13.5075  39.8067     13.5075  33.0598    180         11.8373     180         
1 1 1 17 17 73 o 1  8.88397 4.54439 -18.9826    10.6458  -18.9826    10.6458  2.26135    30.0001     6.11523     30.0001     
1 1 1 17 17 74 o 14 21.0162 8.18545 13.6808     12.4911  13.6808     12.4911  6.08337    60          5.10279     240         
1 1 1 17 17 75 o 19 16.8592 7.35953 6.63742     12.2112  6.63742     12.2112  0.299619   90          4.4787      270         
1 1 1 17 17 76 o 8  12.957  6.27033 -4.95427    12.8949  -4.95427    12.8949  1.42337    120         4.88275     120         
1 1 1 17 17 77 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 0  0  o 9  210.712 3.99904 788.424     42.1596  788.424     42.1596  4.35236    180         303.127     180         
1 1 1 18 0  1  o 5  256.594 2.5748  1167.34     33.0944  1167.34     33.0944  136.391    60          99.5751     240         
1 1 1 18 0  2  o 14 70.5997 2.16917 88.8152     7.64156  88.8152     7.64156  117.468    120         304.373     120         
1 1 1 18 0  3  o 17 1016.19 8.12189 18314.4     413.493  18314.4     413.493  895.03     360         314.222     360         
1 1 1 18 0  4  o 3  238.92  2.47005 1012.1      29.5603  1012.1      29.5603  184.079    60          28.026      60          
1 1 1 18 0  5  o 18 521.265 4.16731 4816.91     108.83   4816.91     108.83   448.854    120         140.998     120         
1 1 1 18 0  6  o 4  97.4246 2.18667 168.687     10.6517  168.687     10.6517  1.26938    2.64146e-05 9.25256     2.64146e-05 
1 1 1 18 0  7  o 11 602.13  4.88198 6427.83     147.271  6427.83     147.271  383.92     60          105.68      240         
1 1 1 18 0  8  o 1  721.317 5.67433 9224.93     205.06   9224.93     205.06   569.976    300         93.9589     300         
1 1 1 18 0  9  o 2  1075.65 8.62149 20523       464.61   20523       464.61   858.184    2.4394e-06  157.281     2.4394e-06  
1 1 1 18 0  10 o 14 299.451 3.11649 1589.98     46.7456  1589.98     46.7456  279.131    60          128.867     60          
1 1 1 18 0  11 o 4  481.474 3.99935 4109.71     96.4691  4109.71     96.4691  314.61     120         67.8744     300         
1 1 1 18 0  12 o 6  448.714 4.13105 3569.87     92.8591  3569.87     92.8591  285.874    180         77.5028     360         
1 1 1 18 0  13 o 18 609.217 5.92228 6582.13     180.732  6582.13     180.732  515.535    60          150.195     60          
1 1 1 18 0  14 o 14 396.677 4.25136 2790.45     84.4697  2790.45     84.4697  172.285    300         228.562     120         
1 1 1 18 0  15 o 5  72.1219 2.44741 92.803      8.79912  92.803      8.79912  28.7181    180         76.9192     180         
1 1 1 18 0  16 o 5  718.193 6.29052 9147.38     226.328  9147.38     226.328  489.532    60          56.8872     240         
1 1 1 18 0  17 o 4  1608.6  13.7297 45971.1     1106.44  45971.1     1106.44  1404.75    120         491.294     120         
1 1 1 18 0  18 f 0  503.016 4.65719 4486.63     117.354  4486.63     117.354  530.144    360         0           0           
1 1 1 18 0  19 o 7  126.808 2.41945 285.556     15.35    285.556     15.35    18.8517    60.0001     27.1694     240         
1 1 1 18 0  20 o 11 158.057 2.38007 443.27      18.833   443.27      18.833   65.9305    300         72.9802     120         
1 1 1 18 0  21 o 5  659.52  5.45367 7713.31     180.196  7713.31     180.196  632.368    180         318.268     180         
1 1 1 18 0  22 o 6  93.2423 2.41189 154.674     11.2359  154.674     11.2359  14.492     60          106.852     60          
1 1 1 18 0  23 o 8  725.209 6.16804 9328.46     224.093  9328.46     224.093  736.176    300         434.145     300         
1 1 1 18 0  24 o 2  860.567 7.22152 13139.5     311.341  13139.5     311.341  767.565    9.30744e-07 304.743     9.30744e-07 
1 1 1 18 0  25 o 19 525.702 4.65883 4900.97     122.694  4900.97     122.694  310.117    240         130.367     60          
1 1 1 18 0  26 o 17 19.1121 5.37719 8.94308     4.97607  8.94308     4.97607  41.8827    300         86.1113     300         
1 1 1 18 0  27 o 10 18.8585 5.40067 8.77209     4.99116  8.77209     4.99116  14.999     180         30.865      180         
1 1 1 18 0  28 o 7  114.782 2.41421 234.086     13.8592  234.086     13.8592  41.7324    240         2.98279     60          
1 1 1 18 0  29 o 18 28.243  4.57877 16.1746     5.64387  16.1746     5.64387  43.0947    120         93.0597     120         
1 1 1 18 0  30 o 14 465.282 4.5989  3840.23     107.186  3840.23     107.186  285.552    5.81899e-07 88.1983     180         
1 1 1 18 0  31 o 6  85.9154 2.53409 131.491     10.8675  131.491     10.8675  12.6703    240         57.8837     60          
1 1 1 18 0  32 o 11 43.724  3.31282 35.0357     7.04894  35.0357     7.04894  28.4903    300         73.564      300         
1 1 1 18 0  33 o 1  372.268 3.63538 2457.95     67.7921  2457.95     67.7921  290.632    1.22923e-10 56.5115     1.22923e-10 
1 1 1 18 0  34 o 1  57.189  2.50493 58.626      7.11524  58.626      7.11524  17.6951    240         65.1236     240         
1 1 1 18 0  35 o 6  321.623 3.17461 1834.58     51.1455  1834.58     51.1455  258.417    120         65.171      120         
1 1 1 18 0  36 o 5  21.854  5.18857 10.9055     5.0721   10.9055     5.0721   40.7692    180         86.037      180         
1 1 1 18 0  37 o 15 557.66  5.02716 5518.73     140.441  5518.73     140.441  468.841    60          157.658     60          
1 1 1 18 0  38 o 14 602.158 5.31245 6435.66     160.256  6435.66     160.256  465.391    120         90.2592     120         
1 1 1 18 0  39 o 5  542.359 4.66301 5219.5      126.698  5219.5      126.698  466.227    360         177.011     360         
1 1 1 18 0  40 o 19 66.4582 2.66294 79.034      8.80328  79.034      8.80328  8.36905    240         56.2484     60          
1 1 1 18 0  41 o 7  329.962 3.53674 1931.65     58.4524  1931.65     58.4524  207.712    300         42.1463     120         
1 1 1 18 0  42 o 2  209.069 2.78405 775.609     29.146   775.609     29.146   205.556    360         121.92      360         
1 1 1 18 0  43 o 4  485.237 4.49424 4178.83     109.245  4178.83     109.245  397.731    60          125.683     60          
1 1 1 18 0  44 o 4  429.359 4.17675 3271.65     89.8327  3271.65     89.8327  358.968    120         126.708     120         
1 1 1 18 0  45 o 9  157.541 2.69873 440.723     21.2783  440.723     21.2783  130.132    180         44.2605     180         
1 1 1 18 0  46 o 5  101.281 2.60859 182.553     13.2003  182.553     13.2003  70.1977    240         26.1006     240         
1 1 1 18 0  47 o 3  127.791 2.70403 290.266     17.2818  290.266     17.2818  53.688     300         67.1705     120         
1 1 1 18 0  48 o 5  365.233 3.7186  2367.31     68.0311  2367.31     68.0311  351.066    180         204.295     180         
1 1 1 18 0  49 o 16 38.7361 4.14267 28.3765     7.49821  28.3765     7.49821  17.8217    240         56.3776     240         
1 1 1 18 0  50 o 1  46.8853 3.37216 40.176      7.72001  40.176      7.72001  3.57773    120         26.4336     120         
1 1 1 18 0  51 o 9  13.1207 5.39451 3.68041     5.83238  3.68041     5.83238  16.8714    9.07797e-06 35.0331     9.07797e-06 
1 1 1 18 0  52 o 8  338.355 3.49606 2031.99     59.252   2031.99     59.252   278.998    240         101.867     240         
1 1 1 18 0  53 o 15 179.458 2.53136 571.661     22.745   571.661     22.745   72.683     300         95.8561     120         
1 1 1 18 0  54 o 6  53.0916 3.18828 51.0695     8.33668  51.0695     8.33668  11.6593    180         28.7363     360         
1 1 1 18 0  55 o 11 13.8626 5.76484 3.91965     6.78776  3.91965     6.78776  8.40632    240         18.0408     240         
1 1 1 18 0  56 o 6  341.228 3.45615 2067.78     59.0741  2067.78     59.0741  256.942    120         59.341      120         
1 1 1 18 0  57 o 6  12.5176 5.59718 1.08306     7.51872  1.08306     7.51872  30.7189    180         65.3319     180         
1 1 1 18 0  58 o 18 35.0073 6.57942 25.9421     9.97254  25.9421     9.97254  0.188961   240         3.39458     240         
1 1 1 18 0  59 o 9  43.6905 4.8725  36.3844     9.87575  36.3844     9.87575  4.89705    120         3.95634     300         
1 1 1 18 0  60 o 6  201.822 3.17774 724.405     32.104   724.405     32.104   143.468    180         21.5187     180         
1 1 1 18 0  61 o 2  120.622 2.89046 259.226     17.427   259.226     17.427   69.1101    240         19.881      60          
1 1 1 18 0  62 o 1  23.4241 6.41956 13.386      7.16286  13.386      7.16286  3.45859    120         10.7762     120         
1 1 1 18 0  63 o 10 13.9105 5.70201 4.25947     6.48523  4.25947     6.48523  15.8069    180         35.296      180         
1 1 1 18 0  64 o 18 190.984 2.89736 649.054     27.7018  649.054     27.7018  151.412    60          55.0798     60          
1 1 1 18 0  65 o 4  10.7813 4.87407 0.405695    5.88923  0.405695    5.88923  12.4839    300         27.3925     300         
1 1 1 18 0  66 o 9  49.9359 3.42237 45.6248     8.36742  45.6248     8.36742  25.1235    180         13.7556     8.6512e-06  
1 1 1 18 0  67 o 8  77.6176 2.80571 107.975     10.8481  107.975     10.8481  49.8741    60          0.150416    60.0004     
1 1 1 18 0  68 o 18 122.384 2.55672 266.996     15.6498  266.996     15.6498  82.9804    300         9.50452     300         
1 1 1 18 0  69 o 6  24.9077 6.04082 14.4683     6.77646  14.4683     6.77646  4.13164    360         7.74369     180         
1 1 1 18 0  70 o 17 33.1066 6.27505 23.5212     8.9955   23.5212     8.9955   0.407787   240.001     0.173747    240.001     
1 1 1 18 0  71 o 8  115.104 2.76226 236.802     15.892   236.802     15.892   68.9697    120         7.52464     300         
1 1 1 18 0  72 o 19 8.71331 4.33664 -8.24621    7.41162  -8.24621    7.41162  3.02706    180         6.88326     180         
1 1 1 18 0  73 o 1  30.5668 7.02789 21.5559     9.52426  21.5559     9.52426  11.4121    60.0001     3.29929     60.0001     
1 1 1 18 0  74 o 13 8.97678 4.46665 -8.63232    7.8474   -8.63232    7.8474   0.229953   300.001     0.539444    300.001     
1 1 1 18 0  75 o 12 33.616  6.91622 25.1352     10.1128  25.1352     10.1128  21.5659    360         9.7557      360         
1 1 1 18 0  76 o 17 27.4781 7.57626 19.0277     9.95245  19.0277     9.95245  8.2021     60          16.6129     240         
1 1 1 18 0  77 o 13 22.9275 7.64244 14.4219     9.90147  14.4219     9.90147  3.37058    300         19.6872     120         
1 1 1 18 0  78 o 13 23.2724 7.70444 14.9283     10.0492  14.9283     10.0492  8.9006     1.37472e-08 2.41432     180         
1 1 1 18 0  79 o 6  25.6265 7.89405 17.7244     10.5147  17.7244     10.5147  8.56746    240         12.4199     60          
1 1 1 18 0  80 o 4  15.8793 6.79132 5.20145     9.93449  5.20145     9.93449  0.0885234  120         6.08592     120         
1 1 1 18 0  81 f 0  40.9404 7.42044 36.8074     13.1587  36.8074     13.1587  36.2945    2.5759e-06  0           0           
1 1 1 18 0  82 o 10 18.4249 7.38803 9.07605     10.5443  9.07605     10.5443  0.289277   59.9999     12.513      240         
1 1 1 18 0  83 o 19 64.8508 5.09425 80.1579     16.034   80.1579     16.034   38.7649    300         0.345234    120         
1 1 1 18 0  84 o 10 14.0965 6.53515 -0.368309   11.5277  -0.368309   11.5277  0.140608   5.3283e-05  1.00721     5.3283e-05  
1 1 1 18 0  85 o 18 14.8049 6.76248 1.27068     11.716   1.27068     11.716   0.0237577  60          1.92902     60          
1 1 1 18 0  86 o 7  20.7821 8.17741 12.4617     12.6129  12.4617     12.6129  0.350911   300         22.3047     120         
1 1 1 18 0  87 o 18 25.5319 9.85728 20.8305     17.9454  20.8305     17.9454  7.56424    360         12.7673     180         
1 1 1 18 0  88 f 0  26.8402 10.8788 24.9894     23.2095  24.9894     23.2095  12.8092    240         0           0           
1 1 1 18 0  89 o 1  13.9286 6.86487 -11.1911    17.295   -11.1911    17.295   2.31836    120         8.02052     120         
1 1 1 18 0  90 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 1  0  o 1  411.515 3.66016 3002.26     75.4555  3002.26     75.4555  383.898    5.25881e-06 169.637     5.25881e-06 
1 1 1 18 1  1  o 9  931.37  7.7714  15300.9     362.713  15474.5     362.735  622.785    121.764     99.7608     301.764     
1 1 1 18 1  2  o 3  476.407 4.20952 4026.3      98.6209  4019.18     102.343  360.952    146.296     49.3759     146.296     
1 1 1 18 1  3  o 10 849.98  7.13787 12890       315.589  12737.2     292.18   545.798    185.166     134.585     5.16563     
1 1 1 18 1  4  o 19 852.48  7.00635 12862.6     293.732  12914.6     304.827  619.098    306.443     9.72191     306.443     
1 1 1 18 1  5  o 14 753.131 6.10263 10085.6     230.324  10028.9     230.332  476.184    278.169     131.399     98.1686     
1 1 1 18 1  6  o 17 649.875 5.38513 7372.54     181.407  7603.06     168.911  491.996    277.646     54.622      277.646     
1 1 1 18 1  7  o 9  604.48  4.97044 6444.36     153.121  6510.45     147.944  545.079    259.168     233.029     259.168     
1 1 1 18 1  8  o 9  640.898 5.15844 7305.02     168.515  7258.38     162.811  486.359    189.385     57.6376     189.385     
1 1 1 18 1  9  o 15 758.905 6.20858 10188.6     244.382  10236.9     227.523  621.521    182.183     156.193     182.183     
1 1 1 18 1  10 o 3  88.2306 2.23155 139.228     9.82775  137.016     9.8736   66.9927    1.63188     206.227     1.63188     
1 1 1 18 1  11 o 18 681.104 5.75923 8125.31     207.046  8326.14     185.216  387.152    254.815     201.278     74.8146     
1 1 1 18 1  12 o 16 711.884 6.20843 9095.66     216.937  8878.77     225.819  474.212    89.3347     70.0277     269.335     
1 1 1 18 1  13 o 1  415.126 3.97399 3088.4      82.6813  3020.69     82.6586  329.876    300.067     87.1217     300.067     
1 1 1 18 1  14 o 11 1326.07 11.1194 31424.9     723.88   31071.6     753.515  931.735    168.919     47.1356     348.919     
1 1 1 18 1  15 o 6  357.361 3.35196 2267.74     60.0234  2258.94     60.036   222.66     203.15      47.6425     23.1499     
1 1 1 18 1  16 f 0  216.938 2.65058 838.404     29.8925  829.605     27.7095  215.618    37.3752     0           0           
1 1 1 18 1  17 o 17 548.183 4.84119 5350.62     138.03   5304.79     127.807  449.485    307.575     126.002     307.575     
1 1 1 18 1  18 o 14 822.128 7.20184 11885.5     308.666  12100.9     284.013  558.989    165.423     57.7571     345.423     
1 1 1 18 1  19 o 17 616.66  5.89938 6763.32     186.603  6725.85     177.938  508.874    190.925     144.131     190.925     
1 1 1 18 1  20 o 7  299.33  3.14103 1601.34     48.039   1574.71     46.1909  174.365    37.6877     61.1655     217.688     
1 1 1 18 1  21 o 1  455.234 4.21188 3665.14     97.9626  3682.93     94.1668  350.04     324.933     61.6832     324.933     
1 1 1 18 1  22 o 5  262.369 2.97949 1202.78     39.1612  1237.46     39.1843  145.967    54.8116     64.7646     234.812     
1 1 1 18 1  23 o 3  270.536 2.97964 1281.12     39.5938  1313.41     41.1995  227.341    92.3961     97.2414     92.3961     
1 1 1 18 1  24 o 12 445.157 4.08358 3520.3      87.5108  3506.65     94.5377  371.72     197.739     121.005     197.74      
1 1 1 18 1  25 o 3  242.995 2.76794 1027.11     32.3998  1066.14     35.0026  169.721    14.1139     15.0011     14.1139     
1 1 1 18 1  26 o 15 415.008 3.87013 3047.17     77.3434  3060.29     83.5308  306.72     198.08      33.1965     198.08      
1 1 1 18 1  27 o 5  297.802 3.1651  1543.29     46.2982  1601.23     48.1783  242.993    321.087     80.7794     321.087     
1 1 1 18 1  28 o 3  147.246 2.31655 396.78      16.4001  371.948     17.7075  75.2745    337.861     29.3707     157.861     
1 1 1 18 1  29 o 10 202.324 2.56019 735.804     24.9583  715.394     26.8918  138.404    100.832     10.8894     100.832     
1 1 1 18 1  30 o 6  381.802 3.77835 2537.92     72.2723  2632.67     72.2974  272.646    120.499     13.8965     120.499     
1 1 1 18 1  31 o 14 403.919 4.04411 2896.98     80.0679  2890.67     83.6118  302.82     306.753     43.7128     306.753     
1 1 1 18 1  32 o 7  323.701 3.46316 1860.87     54.9553  1855.37     57.3739  197.213    236.97      52.9116     56.9704     
1 1 1 18 1  33 o 18 392.924 3.94966 2746.09     76.0721  2731.3      79.4279  296.963    185.12      49.7419     185.12      
1 1 1 18 1  34 o 8  215.549 2.784   816.073     29.4245  831.387     30.7175  110.224    281.33      69.1821     101.33      
1 1 1 18 1  35 o 19 268.2   2.98367 1232.29     39.301   1319.31     40.9073  236.761    147.294     116.504     147.294     
1 1 1 18 1  36 o 6  99.8361 2.35015 164.068     11.5292  190.175     11.9323  30.2284    338.575     186.204     338.574     
1 1 1 18 1  37 o 15 357.03  4.05641 2189.87     74.3637  2335.1      70.5642  178.038    247.383     137.68      67.3827     
1 1 1 18 1  38 o 1  423.441 4.33004 3091.1      93.9132  3275.33     89.624   292.054    333.223     1.7257      153.223     
1 1 1 18 1  39 o 8  132.391 2.65237 315.692     17.5704  306.377     17.5858  72.7162    31.3351     23.9032     211.335     
1 1 1 18 1  40 f 0  177.869 2.80264 559.625     26.1872  562.416     23.7087  154.501    157.699     0           0           
1 1 1 18 1  41 o 10 309.59  3.5969  1660.68     52.9723  1741.09     58.6054  257.34     32.1368     93.3122     32.1368     
1 1 1 18 1  42 o 10 51.1683 2.98397 43.9328     7.53296  49.6603     7.61554  20.5811    131.164     87.7508     131.164     
1 1 1 18 1  43 o 7  141.685 2.47857 354.651     17.1837  357.482     17.993   98.1009    219.767     18.1754     219.767     
1 1 1 18 1  44 o 9  470.824 4.26077 3905.09     100.525  3968.51     100.535  406.641    344.105     170.219     344.105     
1 1 1 18 1  45 o 12 190.401 2.64037 642.89      25.2155  642.939     25.1721  120.711    103.149     10.0222     283.149     
1 1 1 18 1  46 o 5  161.207 2.73353 444.169     22.5848  478.291     21.4846  120.085    155.393     34.9987     155.393     
1 1 1 18 1  47 o 3  93.9894 2.66494 153.18      12.8203  160.728     12.205   48.3074    338.858     2.46519     158.858     
1 1 1 18 1  48 o 12 279.836 3.10327 1412.38     44.4812  1366.72     42.5595  198.959    315.677     23.3142     315.677     
1 1 1 18 1  49 o 3  228.804 2.88281 968.002     32.3417  890.316     33.6569  202.227    266.983     105.624     266.983     
1 1 1 18 1  50 o 7  203.63  2.69921 734.061     26.9406  737.068     28.1382  124.187    339.198     20.0148     159.198     
1 1 1 18 1  51 o 3  155.349 2.69578 440.237     21.0105  416.494     20.9362  85.1182    160.778     30.6784     340.778     
1 1 1 18 1  52 o 7  138.741 2.6216  360.575     17.602   323.254     18.7123  91.7135    137.604     7.65951     137.604     
1 1 1 18 1  53 o 2  185.909 2.67258 606.983     23.6728  619.729     26.0905  133.005    230.69      23.4239     230.69      
1 1 1 18 1  54 o 14 185.882 2.64105 609.237     23.3701  617.242     25.7896  120.734    257.245     2.17468     77.245      
1 1 1 18 1  55 o 2  123.569 2.52025 269.418     15.0402  273.06      16.1284  48.737     171.224     61.812      351.224     
1 1 1 18 1  56 o 18 165.436 2.47467 488.353     20.4196  483.34      20.6119  82.0794    90.1423     51.7564     270.142     
1 1 1 18 1  57 o 7  230.503 3.17273 959.124     36.624   930.252     36.6682  179.466    132.497     57.4046     132.497     
1 1 1 18 1  58 o 1  130.668 2.68235 320.388     17.0232  287.284     17.9644  103.613    240.167     43.2999     240.167     
1 1 1 18 1  59 o 18 142.813 2.64903 375.394     19.4711  350.263     18.4191  86.5804    307.087     10.1964     127.087     
1 1 1 18 1  60 o 12 124.784 2.86371 283.534     18.9593  271.111     16.784   100.661    177.457     45.6297     177.457     
1 1 1 18 1  61 o 4  139.627 2.99643 350.32      19.0422  344.617     22.6506  94.0938    214.739     10.4062     214.739     
1 1 1 18 1  62 o 15 118.87  2.89639 254.836     17.4762  249.108     16.9808  63.4036    57.4315     23.553      237.431     
1 1 1 18 1  63 o 2  66.6605 3.11524 75.5807     10.09    83.7084     10.6064  40.2558    347.015     7.98815     347.015     
1 1 1 18 1  64 o 8  65.2857 3.05005 80.3291     9.65661  72.5039     10.1352  36.7436    357.857     2.279       177.857     
1 1 1 18 1  65 o 8  105.125 2.70043 191.063     13.8787  203.518     14.5298  76.6528    327.511     21.8528     327.511     
1 1 1 18 1  66 o 6  82.4336 2.84049 119.519     11.4103  123.638     11.9877  51.7325    265.041     1.00118     265.041     
1 1 1 18 1  67 f 0  181.492 2.72492 604.076     24.1959  572.3       25.3146  107.216    211.825     0           0           
1 1 1 18 1  68 o 10 78.4284 3.04171 109.188     11.4009  111.727     12.4057  45.8723    71.4051     5.19664     251.405     
1 1 1 18 1  69 o 14 115.369 2.47598 227.591     13.9079  248.372     14.6922  63.4051    331.715     18.2501     151.715     
1 1 1 18 1  70 o 14 77.4066 3.17899 120.818     12.4333  95.8491     12.0364  54.5113    143.211     14.6433     143.211     
1 1 1 18 1  71 o 5  85.7145 2.91475 132.466     13.3644  131.688     11.5358  56.945     270.071     8.48212     270.071     
1 1 1 18 1  72 o 18 18.9395 5.08696 -0.685543   8.13655  7.68862     6.1965   3.38302    346.363     20.6955     346.363     
1 1 1 18 1  73 o 12 31.1442 4.99668 23.2198     8.85835  14.3717     6.47311  11.4676    209.423     8.3309      29.423      
1 1 1 18 1  74 o 5  105.984 2.97278 216.013     16.8388  189.201     14.6939  59.0647    311.518     12.695      131.518     
1 1 1 18 1  75 o 17 45.6376 3.9599  42.2152     10.3682  35.0075     7.2968   19.9856    183.551     13.696      3.55145     
1 1 1 18 1  76 o 12 40.0017 5.87507 28.5769     12.4156  34.118      10.3059  23.5963    255.438     2.75883     255.438     
1 1 1 18 1  77 o 19 31.3398 5.97076 27.5031     10.2009  11.48       9.94778  17.179     40.111      5.13021     40.111      
1 1 1 18 1  78 o 3  65.7478 4.09291 78.4538     13.5462  82.5271     13.1243  34.861     95.84       9.05946     275.84      
1 1 1 18 1  79 o 1  51.1011 5.27534 63.7145     12.3526  38.9091     12.9673  30.338     13.5432     1.46423     13.5431     
1 1 1 18 1  80 o 3  38.7948 5.99716 28.4626     11.5033  32.4249     11.174   20.1312    247.005     2.36436     67.0047     
1 1 1 18 1  81 o 1  56.4251 4.74495 71.8705     13.2077  50.9685     12.781   24.3621    140.276     17.2474     320.276     
1 1 1 18 1  82 o 10 21.0095 6.09151 9.50332     11.0601  -1.05177    9.94533  1.67957    347.955     2.50062     167.955     
1 1 1 18 1  83 o 17 27.9425 6.96947 18.0967     12.1591  12.3882     12.3575  9.61837    200.673     2.7406      200.673     
1 1 1 18 1  84 o 7  30.4309 7.29189 18.3081     13.7692  19.9636     12.7793  15.6451    306.153     4.63467     306.153     
1 1 1 18 1  85 o 17 33.3534 7.13987 29.2473     13.1087  18.4804     13.3492  9.4536     210.872     17.3321     30.8716     
1 1 1 18 1  86 o 18 22.4553 6.67052 20.0506     16.4343  -18.0734    11.5818  4.59562    78.8999     10.7676     258.9       
1 1 1 18 1  87 o 12 25.945  7.82588 11.928      17.9104  6.50775     18.0941  5.28269    334.256     0.653348    334.256     
1 1 1 18 1  88 o 3  24.8847 7.66681 7.32761     17.8134  7.41954     18.0749  3.64043    116.434     1.02703     296.434     
1 1 1 18 1  89 o 14 27.572  7.89097 28.9314     18.7009  -4.08298    18.4027  6.98285    135.916     2.72916     315.916     
1 1 1 18 1  90 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 2  0  f 0  607.125 5.05157 6535.36     153.649  6535.36     153.649  408.094    2.5589e-06  0           0           
1 1 1 18 2  1  o 11 923.251 7.65431 15012.2     340.343  15231.3     367.612  695.276    281.312     57.6764     281.312     
1 1 1 18 2  2  f 0  605.156 5.16059 6485.38     159.371  6499.19     153.578  519.14     51.7858     0           0           
1 1 1 18 2  3  o 5  198.316 2.45031 688.287     24.3483  705.624     24.3535  105.894    33.9242     14.7561     213.924     
1 1 1 18 2  4  o 17 400.464 3.86071 2852.26     79.0178  2832.51     75.9217  276.844    304.442     5.19121     124.442     
1 1 1 18 2  5  o 18 372.184 3.47994 2451.07     63.6883  2458.88     66.1064  244.748    8.04724     27.0646     188.047     
1 1 1 18 2  6  o 14 288.029 2.91257 1466.17     42.0409  1474.18     42.0407  240.238    342.383     123.612     342.383     
1 1 1 18 2  7  o 13 324.584 3.13275 1895.75     50.9513  1838.64     50.9559  132.539    250.251     185.246     70.2507     
1 1 1 18 2  8  o 2  637.699 5.27483 7164.45     168.562  7255.22     168.577  410.324    189.195     92.046      9.19514     
1 1 1 18 2  9  o 17 579.119 4.95913 5926.46     146.552  5964.84     141.229  363.071    56.6135     99.8924     236.613     
1 1 1 18 2  10 o 2  452.595 4.22379 3569.92     97.6482  3692.47     93.8321  256.377    19.6343     126.625     199.634     
1 1 1 18 2  11 f 0  868.087 7.1046  13349       303.291  13387.3     314.767  494.847    332.881     0           0           
1 1 1 18 2  12 o 2  395.48  3.61531 2754.02     72.9468  2790.2      70.3144  244.184    303.259     64.4664     123.259     
1 1 1 18 2  13 o 15 248.357 2.93078 1059.43     36.4624  1127.31     36.4653  149.742    169.723     24.1012     349.723     
1 1 1 18 2  14 o 13 525.888 4.71144 4864.1      121.656  4941.96     126.662  366.195    348.772     13.3596     168.772     
1 1 1 18 2  15 o 3  402.882 3.68592 2828.63     73.0376  2925.7      75.8056  279.7      159.145     3.50645     339.145     
1 1 1 18 2  16 o 2  432.589 3.81606 3321.79     82.7219  3312.26     82.7331  260.09     129.453     89.6746     309.453     
1 1 1 18 2  17 o 7  336.438 3.21382 2003.52     54.1758  2008.76     54.196   178.382    3.58772     111.512     183.588     
1 1 1 18 2  18 o 8  522.593 4.58238 4869.25     119.991  4815.06     120.025  392.449    334.025     44.9034     334.025     
1 1 1 18 2  19 o 18 416.707 3.89105 3085.55     81.2468  3070.9      81.2657  292.816    98.5578     0.466374    98.5574     
1 1 1 18 2  20 o 9  62.0688 2.55434 71.5526     8.00273  65.527      7.81461  34.7002    201.398     99.7848     201.398     
1 1 1 18 2  21 o 1  426.206 4.01028 3221.88     87.3363  3219.07     83.9422  416.046    187.845     241.605     187.845     
1 1 1 18 2  22 o 5  178.489 2.54948 563.081     22.7727  566.158     22.8368  93.5105    244.019     40.3837     64.0192     
1 1 1 18 2  23 o 10 233.125 2.84231 995.804     33.1594  931.263     33.2232  174.57     172.169     42.0825     172.169     
1 1 1 18 2  24 o 13 448.172 4.24838 3584.8      95.3891  3538.76     95.4428  389.053    264.4       150.293     264.4       
1 1 1 18 2  25 f 0  382.478 3.77169 2602.81     72.2608  2584.74     72.3265  226.211    72.6219     0           0           
1 1 1 18 2  26 f 0  469.694 4.34527 3996.71     100.129  3829.52     104.266  374.114    12.6333     0           0           
1 1 1 18 2  27 o 4  393.54  3.80186 2769.31     70.2648  2723.32     79.3394  252.253    80.8821     47.3999     260.882     
1 1 1 18 2  28 o 18 472.872 4.37423 4001.72     97.1546  3931.25     109.665  354.822    357.642     44.8663     357.642     
1 1 1 18 2  29 o 1  308.482 3.30707 1713.6      46.6113  1661.09     55.1394  272.879    330.424     124.853     330.424     
1 1 1 18 2  30 o 18 286.888 3.09635 1480.58     41.7267  1438.04     47.0615  276.113    186.6       169.459     186.6       
1 1 1 18 2  31 o 8  314.034 3.21671 1764.28     47.4665  1733.04     53.5396  216.508    238.199     0.234768    58.1983     
1 1 1 18 2  32 o 9  355.445 3.586   2264.1      61.1227  2217.51     66.4581  249.492    48.241      6.54162     48.2413     
1 1 1 18 2  33 o 4  82.4136 2.38035 123.115     9.37026  118.105     10.2108  1.45869    269.302     75.0442     89.3015     
1 1 1 18 2  34 o 1  454.042 4.47192 3661.18     97.0209  3656.52     106.269  347.223    39.9324     62.7841     39.9324     
1 1 1 18 2  35 o 13 307.722 3.50373 1700.62     52.7241  1658.68     55.271   165.913    23.8097     92.895      203.81      
1 1 1 18 2  36 o 15 61.6966 2.89285 71.8767     8.72785  63.8273     9.01376  0.1514     270.201     12.9989     90.2011     
1 1 1 18 2  37 o 2  42.0427 3.48885 30.3468     6.53497  33.2536     7.87076  27.8866    295.447     81.7927     295.447     
1 1 1 18 2  38 o 15 116.684 2.60398 246.904     14.4798  236.435     15.8677  52.6919    166.333     42.4286     346.333     
1 1 1 18 2  39 o 19 259.787 3.34928 1202.41     42.4497  1192.04     44.7188  182.361    224.648     10.1997     224.648     
1 1 1 18 2  40 o 16 104.023 2.52161 187.102     12.5528  197.133     13.6968  43.5238    126.856     40.6951     306.856     
1 1 1 18 2  41 o 12 187.072 2.64229 597.258     23.5972  644.326     25.9522  115.319    290.315     18.9712     110.315     
1 1 1 18 2  42 o 9  215.726 2.82443 791.982     29.8448  859.443     31.2272  195.162    218.59      107.115     218.59      
1 1 1 18 2  43 o 14 152.884 2.5094  396.649     19.1919  432.671     19.2349  80.62      332.74      38.5581     152.74      
1 1 1 18 2  44 o 10 249.926 2.94863 1043.41     36.8528  1174.54     36.9162  197.993    166.169     61.123      166.169     
1 1 1 18 2  45 o 4  247.425 3.10135 1060.87     39.2851  1111.68     37.5491  158.864    194.583     15.0555     14.5827     
1 1 1 18 2  46 o 5  185.699 2.73815 575.756     25.9543  648.623     24.8643  107.817    43.6525     29.6693     223.652     
1 1 1 18 2  47 o 6  49.3675 3.42046 49.4871     7.93546  38.2268     8.54224  2.25038    61.857      22.3523     61.8571     
1 1 1 18 2  48 o 1  111.407 2.63965 227.403     15.4463  213.49      13.9855  62.9827    107.976     8.29622     287.976     
1 1 1 18 2  49 o 18 160.718 2.66403 433.511     21.8261  483.857     20.9629  96.3942    321.895     15.7144     141.895     
1 1 1 18 2  50 o 4  32.518  4.83058 23.9088     7.85639  15.4404     7.43175  13.2734    7.40006     37.0391     7.40006     
1 1 1 18 2  51 f 0  331.299 3.6901  1948.02     64.2827  1951.73     58.0846  183.856    316.859     0           0           
1 1 1 18 2  52 o 9  195.379 2.65192 683.29      26.5239  671.512     25.4037  144.332    298.623     32.4344     298.623     
1 1 1 18 2  53 o 13 282.983 3.33828 1456.55     47.382   1389.1      47.2833  211.965    75.9693     47.3803     75.9693     
1 1 1 18 2  54 o 9  22.5812 4.97493 5.3171      6.15146  12.445      6.70801  7.91626    323.136     20.001      323.136     
1 1 1 18 2  55 o 2  83.5424 2.77868 123.98      11.2853  124.463     11.9088  38.9555    295.183     23.401      115.183     
1 1 1 18 2  56 o 4  112.96  2.516   225.081     13.4979  228.497     14.926   93.4159    277.476     50.5588     277.476     
1 1 1 18 2  57 o 7  73.3645 2.99975 103.023     11.1144  89.232      10.8241  14.7203    66.8115     60.5059     246.811     
1 1 1 18 2  58 o 10 75.9346 2.76946 114.741     10.6861  91.4476     10.26    25.3868    266.86      42.0129     86.8601     
1 1 1 18 2  59 o 7  108.789 2.89416 221.426     15.3243  200.486     16.0973  75.2727    147.419     14.7714     147.419     
1 1 1 18 2  60 o 14 109.321 2.65504 217.588     14.6881  208.066     14.3601  78.6901    53.5042     21.3903     53.5042     
1 1 1 18 2  61 o 13 69.8582 2.60545 96.4206     9.28129  78.1816     8.85916  40.0276    195.148     0.0919313   195.147     
1 1 1 18 2  62 o 16 107.778 2.78653 211.443     14.3886  202.913     15.6054  56.6187    319.864     22.3007     139.864     
1 1 1 18 2  63 o 2  187.156 2.78715 626.032     25.4466  622.221     26.8129  114.429    349.51      12.2849     169.51      
1 1 1 18 2  64 o 12 143.289 2.68641 360.346     18.7309  371.981     19.8144  84.435     238.892     14.4883     58.8919     
1 1 1 18 2  65 o 12 34.2793 4.33976 18.3507     6.80811  25.4774     7.54595  11.4814    209.777     11.4434     29.7768     
1 1 1 18 2  66 o 16 64.3088 2.96859 75.2089     9.15588  73.2416     9.84843  26.8928    23.673      25.5991     203.673     
1 1 1 18 2  67 o 18 29.353  5.28781 16.8613     8.25215  15.8019     7.34941  7.54998    152.729     2.96682     332.729     
1 1 1 18 2  68 o 10 63.2534 3.21807 77.7686     10.6443  66.7337     9.62879  40.8443    254.897     5.53264     254.897     
1 1 1 18 2  69 o 16 12.7484 4.02258 -4.11749    3.50524  1.71618     6.5564   5.8279     103.107     15.6318     103.107     
1 1 1 18 2  70 o 12 58.9623 3.71627 58.5626     11.2373  68.1646     10.334   33.636     266.478     3.54052     86.4781     
1 1 1 18 2  71 o 7  119.383 3.08875 246.736     19.4581  266.433     17.2567  80.9707    116.945     12.9153     116.945     
1 1 1 18 2  72 o 19 50.309  4.0288  50.5583     10.5079  42.6773     9.45612  23.5806    194.757     12.3977     14.7569     
1 1 1 18 2  73 o 10 13.2657 4.29386 -6.2181     7.85663  -1.9643     4.9863   9.2076     318.609     26.8802     318.609     
1 1 1 18 2  74 o 14 61.0627 3.4786  74.1648     11.6538  61.9963     9.47295  31.6827    112.638     10.397      292.638     
1 1 1 18 2  75 o 5  73.474  3.22646 111.332     12.9657  85.6285     10.7129  44.3386    342.208     0.719101    162.208     
1 1 1 18 2  76 o 8  71.0654 3.3759  88.6688     13.011   95.7692     10.6369  40.8483    83.4757     4.43612     263.476     
1 1 1 18 2  77 o 15 19.2862 5.29447 9.77592     9.23261  1.04768     5.51246  3.03735    172.614     5.15386     352.614     
1 1 1 18 2  78 o 18 16.7807 5.29712 -2.56527    8.99693  -2.0698     9.14757  0.576407   177.007     5.34276     357.007     
1 1 1 18 2  79 o 6  25.3962 6.56085 13.8619     10.1019  8.43993     12.101   8.91096    89.8678     3.86274     269.868     
1 1 1 18 2  80 o 11 29.0877 6.61512 8.22797     10.6025  25.7288     12.4384  12.9237    260.287     1.04499     260.287     
1 1 1 18 2  81 o 8  30.7257 6.89287 17.028      11.0587  22.3571     12.7995  12.5732    317.417     4.57063     137.417     
1 1 1 18 2  82 o 2  22.6587 6.62169 4.23336     11.3338  7.46394     13.0977  3.30652    151.806     12.68       331.806     
1 1 1 18 2  83 o 19 24.3888 6.91228 6.16511     11.6924  11.3442     13.9898  4.31674    108.684     15.1471     288.684     
1 1 1 18 2  84 o 13 19.0501 6.19218 -9.72289    11.264   -0.491184   15.3243  0.342503   104.64      17.7953     104.64      
1 1 1 18 2  85 o 2  36.2762 7.96472 23.8639     14.1373  36.5617     17.9431  21.7692    49.0709     7.8225      49.0709     
1 1 1 18 2  86 o 7  21.0768 6.83472 -3.86312    16.823   -4.47162    15.8943  3.45416    193.008     9.25948     13.0077     
1 1 1 18 2  87 o 8  20.4822 6.68822 -10.9511    16.4853  -0.130858   15.9711  1.76765    91.523      3.26756     271.523     
1 1 1 18 2  88 o 8  20.3357 6.72147 -3.88854    17.1904  -9.5573     16.8394  0.891591   89.2404     3.68561     269.24      
1 1 1 18 2  89 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 3  0  o 3  131.296 2.23897 305.984     14.7126  305.984     14.7126  16.0242    180         30.599      6.20468e-06 
1 1 1 18 3  1  o 3  747.853 6.17014 9893.35     226.932  9943.33     235.499  608.628    91.9585     142.701     91.9585     
1 1 1 18 3  2  o 14 557.157 4.80716 5538.79     136.701  5467.54     131.726  418.862    223.463     44.2951     223.463     
1 1 1 18 3  3  o 4  195.685 2.41228 694.855     23.6545  662.469     23.648   22.6042    137.61      210.006     317.61      
1 1 1 18 3  4  o 10 329.921 3.18971 1908.74     52.732   1949.46     52.7394  264.567    157.22      86.7282     157.22      
1 1 1 18 3  5  o 11 236.593 2.79409 979.349     33.7631  1004.68     32.4604  163.439    199.27      40.2806     199.27      
1 1 1 18 3  6  o 14 651.687 5.36345 7559.07     175.162  7501.18     175.164  559.229    135.924     187.629     135.924     
1 1 1 18 3  7  o 9  447.584 3.94517 3573.47     88.4891  3528.32     88.4908  288.468    124.951     55.713      304.951     
1 1 1 18 3  8  o 7  344.995 3.30483 2098        56.0629  2120.87     58.2029  307.714    329.371     155.35      329.371     
1 1 1 18 3  9  o 8  343.646 3.2979  2079.94     57.8237  2106.01     55.7321  227.427    235.689     20.0129     55.6887     
1 1 1 18 3  10 f 0  692.492 5.78305 8521.63     196.93   8486.7      204.371  554.146    356.721     0           0           
1 1 1 18 3  11 o 7  424.365 3.78024 3178.44     80.3861  3205.61     80.3994  275.177    58.6273     48.0399     238.627     
1 1 1 18 3  12 o 15 256.277 2.91959 1193.69     36.6919  1134.61     38.2285  106.561    113.067     135.737     293.067     
1 1 1 18 3  13 o 18 542.268 4.88153 5099.56     130.006  5329.13     135.323  463.78     37.616      158.809     37.616      
1 1 1 18 3  14 o 12 1083.85 8.95465 20965.7     504.827  20764.7     467.384  891.541    217.026     221.085     217.026     
1 1 1 18 3  15 o 9  358.925 3.56862 2279.67     60.2374  2287.33     67.9239  177.076    198.916     150.683     18.9159     
1 1 1 18 3  16 o 10 538.571 4.63009 5157.49     127.262  5128.49     122.64   486.654    339.489     210.998     339.489     
1 1 1 18 3  17 o 14 418.216 3.73015 3080.41     78.1668  3120.63     78.188   231.866    235.158     128.624     55.1578     
1 1 1 18 3  18 o 7  144.663 2.1824  370.816     15.799   370.9       15.8444  71.3417    120.209     3.88272     120.21      
1 1 1 18 3  19 o 5  214.421 2.55731 812.328     27.4734  817.322     27.4858  105.246    282.922     77.474      102.922     
1 1 1 18 3  20 o 12 587.989 5.15143 6154.35     145.819  6110.45     157.502  402.27     225.57      33.8222     45.5698     
1 1 1 18 3  21 o 4  296.015 2.96675 1551.29     43.9988  1554.98     44.022   243.124    305.452     82.3667     305.452     
1 1 1 18 3  22 o 3  251.195 2.76377 1132.75     34.7787  1104.11     34.7998  207.063    195.707     80.0254     195.707     
1 1 1 18 3  23 o 1  109.996 2.28942 216.27      12.7928  212.966     12.4196  20.2867    248.168     81.8712     68.1676     
1 1 1 18 3  24 o 4  223.971 2.68649 884.491     30.13    893.765     30.1766  24.1965    258.989     262.121     78.989      
1 1 1 18 3  25 o 11 458.847 4.29638 3714.2      102.779  3754.21     94.5925  373.254    164.582     100.129     164.582     
1 1 1 18 3  26 o 18 161.029 2.44746 453.133     19.6748  466.105     19.8253  28.6784    349.023     158.498     169.023     
1 1 1 18 3  27 o 2  345.626 3.58268 2110.97     60.6482  2125.56     63.4389  230.798    210.785     21.313      30.785      
1 1 1 18 3  28 o 15 408.243 3.84662 2939.38     77.0686  2972.37     80.3082  287.084    155.682     1.48088     155.682     
1 1 1 18 3  29 o 17 218.999 2.65179 842.919     28.4389  857.5       29.7623  151.885    333.503     10.4556     333.503     
1 1 1 18 3  30 o 12 89.9114 2.37008 141.782     10.3245  145.215     10.9928  18.3438    134.858     19.7192     314.858     
1 1 1 18 3  31 o 2  408.845 4.13226 2970.79     80.6836  2960.56     88.4543  282.069    175.427     6.97661     355.427     
1 1 1 18 3  32 o 3  264.048 3.12584 1246.02     39.3823  1226.69     43.2219  207.098    274.148     56.841      274.148     
1 1 1 18 3  33 o 14 166.388 2.75162 502.399     21.0786  479.737     24.5633  55.2106    205.562     111.045     25.5618     
1 1 1 18 3  34 o 18 356.093 3.93565 2254.95     66.619   2244.72     73.6533  211.433    151.346     72.2108     331.346     
1 1 1 18 3  35 o 17 304.331 3.62542 1653.47     50.7209  1632.61     59.459   196.035    345.147     28.2923     165.147     
1 1 1 18 3  36 o 9  194.229 2.8412  679.547     27.6192  658.422     27.6849  136.448    44.7468     12.9004     44.7468     
1 1 1 18 3  37 o 12 324.657 3.89617 1910.6      59.667   1830.75     66.7415  244.73     195.763     40.949      195.763     
1 1 1 18 3  38 o 6  311.417 3.51281 1740.43     53.4965  1700.91     56.0822  182.545    295.078     65.1225     115.078     
1 1 1 18 3  39 o 18 72.7256 2.41282 89.9449     8.55742  98.1012     8.98179  21.0856    155.738     15.2098     335.738     
1 1 1 18 3  40 o 7  344.992 3.60197 2075.53     60.9118  2148.88     63.6404  270.47     147.966     67.0519     147.966     
1 1 1 18 3  41 f 0  211.358 2.73663 783.674     27.0399  800.857     30.8464  131.04     210.184     0           0           
1 1 1 18 3  42 o 17 172.652 2.58037 513.11      21.4265  544.329     23.2279  144.996    26.1334     68.8546     26.1334     
1 1 1 18 3  43 o 12 113.994 2.39106 227.503     13.115   233.756     14.1656  46.8597    7.55164     49.6172     187.552     
1 1 1 18 3  44 o 8  212.963 2.78621 789.293     27.7856  819.728     31.6259  95.8465    320.263     95.3275     140.263     
1 1 1 18 3  45 o 4  360.443 3.6561  2276.14     60.3252  2336.79     71.4246  286.824    344.608     83.8154     344.608     
1 1 1 18 3  46 o 9  90.8799 2.48685 141.978     10.828   151.479     11.7832  43.2209    220.737     13.0795     40.7365     
1 1 1 18 3  47 o 10 394.445 4.24107 2711.63     81.6425  2817.74     86.0301  325.491    134.379     116.452     134.379     
1 1 1 18 3  48 o 2  138.229 2.82873 333.435     19.108   345.167     20.0419  92.0152    181.605     9.44187     181.605     
1 1 1 18 3  49 o 3  242.173 3.11372 984.652     38.5988  1098.74     36.7713  156.664    170.804     10.1085     350.804     
1 1 1 18 3  50 o 13 71.6383 3.13742 95.9962     11.8297  87.0165     10.5934  24.9293    160.331     3.60584     160.331     
1 1 1 18 3  51 o 19 149.377 2.71344 395.587     20.7377  396.904     19.8423  127.519    92.3174     67.1439     92.3174     
1 1 1 18 3  52 o 13 30.5158 4.76742 23.9006     6.8705   10.8339     7.5956   11.9728    146.361     38.2687     146.361     
1 1 1 18 3  53 o 17 145.573 2.61569 370.591     18.4581  382.003     19.6847  99.5228    316.697     10.4561     316.697     
1 1 1 18 3  54 o 12 92.6861 2.73236 144.378     12.1921  161.49      13.1408  53.6643    67.9359     6.21644     247.936     
1 1 1 18 3  55 f 0  176.852 2.58901 541.505     22.333   569.459     23.5621  96.7148    194.353     0           0           
1 1 1 18 3  56 o 2  44.1506 3.64594 30.6472     7.63512  40.0149     8.13091  1.71374    212.319     39.1897     32.3194     
1 1 1 18 3  57 o 9  114.312 2.66711 238.306     16.3141  226.69      14.1721  44.8276    152.954     57.3439     332.954     
1 1 1 18 3  58 o 8  150.909 2.46814 404.784     19.4815  404.526     17.8129  117.58     151.18      41.2952     151.18      
1 1 1 18 3  59 o 3  88.5494 2.65674 136.746     12.0746  142.671     11.423   27.2894    283.568     57.092      103.568     
1 1 1 18 3  60 o 18 163.656 2.50477 481.838     21.9395  470.844     19.076   132.785    1.5774      55.5829     1.5774      
1 1 1 18 3  61 o 2  47.0033 3.60283 39.1692     9.20012  40.6956     7.32202  16.1908    120.459     6.84946     300.459     
1 1 1 18 3  62 o 7  80.7125 2.70545 119.414     11.1414  113.197     10.6841  43.1883    175.269     12.2243     355.269     
1 1 1 18 3  63 o 4  90.118  2.48367 149.611     11.8311  140.082     10.5555  29.858     40.9544     54.3009     220.954     
1 1 1 18 3  64 o 16 103.655 2.23688 198.15      11.9415  184.707     11.2737  70.3713    163.847     9.49952     163.847     
1 1 1 18 3  65 o 11 49.8523 3.59645 36.1681     8.61742  54.8619     8.78502  11.504     73.5144     37.6426     253.514     
1 1 1 18 3  66 o 18 58.0202 3.39092 63.6748     9.26956  57.9494     10.1808  26.7577    173.461     17.222      353.461     
1 1 1 18 3  67 o 13 59.846  3.35071 56.1538     9.75111  73.8324     10.0692  37.382     163.593     2.84555     163.593     
1 1 1 18 3  68 o 5  63.6136 3.58399 69.3174     10.752   77.4939     11.9188  27.9471    93.4395     22.3675     273.439     
1 1 1 18 3  69 o 19 31.9878 5.82941 16.3807     8.27297  23.3038     10.5882  7.30847    52.3873     19.6274     232.387     
1 1 1 18 3  70 o 9  93.1747 3.13403 153         14.1862  159.884     14.9989  67.2497    320.585     19.0002     320.585     
1 1 1 18 3  71 o 14 77.234  3.34058 104.874     12.4428  111.002     13.2952  53.3989    9.59386     12.32       9.59386     
1 1 1 18 3  72 o 14 31.9926 5.84495 21.0417     9.48024  18.6971     9.41192  6.40391    329.361     22.4635     149.361     
1 1 1 18 3  73 o 13 73.6086 3.62803 95.0621     13.4211  102.4       13.1489  42.881     199.369     4.30011     19.3692     
1 1 1 18 3  74 o 1  28.3985 5.94232 10.6799     9.30611  20.2448     9.32392  5.71139    177.036     19.508      357.036     
1 1 1 18 3  75 o 18 33.3574 5.79317 22.1557     9.79276  21.7279     9.43314  12.0108    22.6169     13.391      202.617     
1 1 1 18 3  76 o 7  58.0643 3.85988 68.387      11.7896  56.6998     10.4225  38.0796    305.133     6.98198     305.133     
1 1 1 18 3  77 o 4  57.1705 4.02136 67.2307     12.1673  54.9573     10.5875  39.8578    303.126     12.2922     303.126     
1 1 1 18 3  78 o 17 20.5935 6.16166 -0.207584   9.39174  6.29514     12.4681  3.56658    264.223     3.57675     84.223      
1 1 1 18 3  79 f 0  44.5582 5.50269 36.6165     11.8244  41.9058     11.8274  36.0647    207.342     0           0           
1 1 1 18 3  80 o 6  30.1367 6.48745 18.3069     10.6213  19.0733     10.731   11.8878    92.8992     6.20993     272.899     
1 1 1 18 3  81 o 3  27.0438 6.78728 14.1243     11.7813  14.2705     11.2942  4.54463    15.1522     18.1018     195.152     
1 1 1 18 3  82 o 6  19.6324 5.76958 -14.0183    10.6435  11.0055     10.7391  1.88435    345.741     10.8286     165.741     
1 1 1 18 3  83 o 17 17.7077 5.64398 1.33284     10.8399  -9.81849    10.8241  1.34191    242.97      9.74575     62.9696     
1 1 1 18 3  84 o 3  36.9066 7.13455 21.1505     14.1575  38.0542     13.8972  23.7629    293.037     13.9304     293.037     
1 1 1 18 3  85 o 17 46.5431 7.35073 27.6784     19.736   69.2056     15.7106  34.3067    248.73      19.7815     248.73      
1 1 1 18 3  86 o 19 37.479  8.34919 27.0387     18.8747  40.8884     17.233   14.7754    43.9016     10.4175     223.902     
1 1 1 18 3  87 o 3  20.6187 6.61028 -1.84189    16.6698  -0.355036   12.8307  1.72765    253.746     4.68327     73.7457     
1 1 1 18 3  88 o 8  26.7121 8.04187 15.7958     18.0838  8.94913     20.077   2.29122    128.579     0.312767    308.579     
1 1 1 18 3  89 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 4  0  o 13 90.007  2.39371 144.158     10.7624  144.158     10.7624  14.0755    180         66.8932     180         
1 1 1 18 4  1  o 4  467.169 4.14389 3888.54     98.8089  3848.88     95.2058  425.606    343.661     195.751     343.661     
1 1 1 18 4  2  o 11 220.275 2.65753 866.594     28.186   853.159     30.4249  152.872    193.491     83.4657     193.491     
1 1 1 18 4  3  o 11 892.802 7.21234 14261.6     322.693  14024.8     322.68   690.27     265.254     89.3864     265.254     
1 1 1 18 4  4  f 0  591.525 4.97069 6214.18     147.349  6193.38     147.351  427.202    265.859     0           0           
1 1 1 18 4  5  o 3  387.088 3.61351 2672.89     71.3905  2638.72     68.7937  292.599    198.702     44.1077     198.702     
1 1 1 18 4  6  o 15 576.739 4.90877 5865.6      139.233  5929.54     144.498  387.175    45.6707     52.8134     225.671     
1 1 1 18 4  7  o 6  497.332 4.23644 4416.65     105.583  4352.72     105.586  307.709    287.786     95.0038     107.786     
1 1 1 18 4  8  o 13 485.378 4.17111 4193.84     101.457  4158.91     101.461  333.575    166.091     24.2548     346.091     
1 1 1 18 4  9  o 11 646.243 5.72009 7384.18     196.011  7429.61     173.747  378.29     90.2545     173.789     270.255     
1 1 1 18 4  10 o 18 661.774 5.57381 7661.42     181.417  7873.33     188.289  487.503    7.13887     23.9815     7.13887     
1 1 1 18 4  11 o 15 531.486 4.61597 5023.94     120.632  4992.83     125.203  378.672    1.76354     2.0443      181.764     
1 1 1 18 4  12 o 18 466.843 4.1934  3849.46     98.0921  3878.13     98.12    317.325    136.093     29.7466     316.093     
1 1 1 18 4  13 o 2  609.121 5.40256 6474.89     168.107  6687.02     161.521  479.588    99.0259     86.8354     99.0259     
1 1 1 18 4  14 o 8  276.348 3.0657  1363.47     44.1835  1343.68     40.6815  237.798    305.163     108.226     305.163     
1 1 1 18 4  15 o 11 85.4051 2.37054 137.113     9.68416  122.033     10.4787  4.57412    155.901     56.7766     155.901     
1 1 1 18 4  16 o 17 816.696 6.86659 11807.2     270.031  11872.1     291.679  592.627    68.2695     10.0961     68.2695     
1 1 1 18 4  17 o 14 188.544 2.32394 632.92      21.951   627.074     21.965   72.1792    18.4268     107.206     198.427     
1 1 1 18 4  18 o 12 207.871 2.55391 767.17      27.0786  764.464     26.1241  159.474    186.989     54.307      186.989     
1 1 1 18 4  19 o 14 531.068 4.60527 4965.27     120.284  5038.61     124.832  353.723    89.719      50.3597     269.719     
1 1 1 18 4  20 o 3  435.858 3.8442  3351.63     83.956   3385        83.9777  368.98     32.3577     123.014     32.3577     
1 1 1 18 4  21 o 8  333.036 3.11042 1978.37     51.8997  1953.88     51.9232  334.428    329.93      216.022     329.93      
1 1 1 18 4  22 o 12 455.054 3.92358 3651.35     89.4545  3692.58     89.4952  320.17     64.3907     4.91983     244.391     
1 1 1 18 4  23 f 0  602.202 5.02292 6456.97     151.572  6412.04     151.598  382.527    55.8147     0           0           
1 1 1 18 4  24 o 9  38.5795 3.25749 22.6493     5.87902  31.2294     6.40492  49.2674    14.9283     117.564     14.9283     
1 1 1 18 4  25 o 18 352.129 3.41814 2193.7      60.2957  2203.43     60.3417  272.069    285.231     51.5556     285.231     
1 1 1 18 4  26 o 11 354.24  3.37999 2217.5      61.0888  2232.65     58.8892  260.513    202.919     25.2788     202.919     
1 1 1 18 4  27 o 2  346.297 3.36777 2103.83     58.4152  2149.26     58.4717  274.226    359.903     66.0948     359.903     
1 1 1 18 4  28 o 2  294.591 3.20504 1523.48     47.3057  1554.26     47.3241  257.313    252.79      111.962     252.79      
1 1 1 18 4  29 o 16 90.4017 2.54017 142.576     11.4654  147.65      11.5028  20.1657    143.348     34.1424     323.348     
1 1 1 18 4  30 o 17 190.534 2.8122  656.48      27.4457  630.932     26.261   6.04894    327.718     249.067     147.718     
1 1 1 18 4  31 o 11 265.477 3.12764 1265.23     41.5774  1234.43     41.6382  150.542    89.649      64.8782     269.649     
1 1 1 18 4  32 o 10 246.579 3.07031 1062.09     36.9646  1094.4      38.9134  198.214    55.6175     62.8758     55.6175     
1 1 1 18 4  33 o 5  31.2873 4.27989 14.1331     6.1405   22.1829     6.80016  19.4521    87.917      45.6539     87.917      
1 1 1 18 4  34 o 3  204.612 2.76742 736.124     26.9424  748.574     29.7635  143.925    335.932     12.0051     335.932     
1 1 1 18 4  35 o 16 163.275 2.74453 487.845     22.2878  457.792     22.5978  147.117    357.432     93.8344     357.432     
1 1 1 18 4  36 o 16 67.2592 2.76469 76.2736     8.86506  84.8167     9.69804  55.3349    234.631     195.07      234.631     
1 1 1 18 4  37 f 0  201.59  2.7863  745.303     28.0233  696.429     28.2418  116.843    91.7795     0           0           
1 1 1 18 4  38 o 8  321.943 3.38398 1852.92     53.3115  1824.87     55.8315  216.619    162.6       11.6072     342.6       
1 1 1 18 4  39 o 14 253.687 2.98867 1169.98     37.1163  1113.41     38.7975  200.004    18.1227     54.9434     18.1227     
1 1 1 18 4  40 o 6  255.942 3.19848 1155.67     40.9642  1168.63     41.0847  267.401    304.87      197.945     304.87      
1 1 1 18 4  41 o 16 322.28  3.43527 1813.46     49.114   1873.06     61.357   198.356    29.3566     46.0855     209.357     
1 1 1 18 4  42 o 6  42.3532 3.4622  36.0852     6.45294  28.6559     7.65245  44.8097    94.4795     129.597     94.4795     
1 1 1 18 4  43 o 1  143.682 2.64859 368.236     18.6115  364.551     19.4833  44.2365    356.285     101.35      176.285     
1 1 1 18 4  44 o 7  48.8981 3.51085 42.7581     7.61473  42.9924     9.26294  3.64503    87.9942     27.8296     87.9942     
1 1 1 18 4  45 o 8  168.887 2.67187 505.069     20.9705  506.762     24.1499  135.137    209.672     53.1669     209.672     
1 1 1 18 4  46 o 1  178.39  2.66379 554.601     22.7465  574.425     24.8656  128.802    243.404     23.9527     243.404     
1 1 1 18 4  47 o 8  127.002 2.53741 285.402     15.4634  287.24      16.7804  100.214    245.333     51.9675     245.333     
1 1 1 18 4  48 o 13 68.3499 3.03151 84.285      9.68955  82.1917     10.9169  18.8347    194.279     28.7679     14.2785     
1 1 1 18 4  49 o 13 162.425 2.70412 459.497     21.0593  476.799     22.9512  99.807     53.2627     13.2429     233.263     
1 1 1 18 4  50 o 18 97.7086 2.54175 159.265     12.022   180.304     12.8283  67.9153    50.3683     24.6346     50.3683     
1 1 1 18 4  51 o 14 128.681 2.50721 284.682     15.5299  303.58      16.7795  92.0345    330.911     19.9785     330.911     
1 1 1 18 4  52 o 17 63.8355 3.02332 77.2295     9.35076  68.3027     9.81512  27.4094    321.142     11.967      141.142     
1 1 1 18 4  53 o 19 172.029 2.56094 525.98      20.728   524.774     23.3467  76.7996    343.616     74.1641     163.616     
1 1 1 18 4  54 o 16 58.6909 3.20373 67.08       8.64489  56.3589     9.83922  3.32862    166.477     62.4994     346.477     
1 1 1 18 4  55 o 7  104.702 2.54587 190.428     12.7347  199.48      13.9374  53.2076    90.4511     26.7448     270.451     
1 1 1 18 4  56 o 9  147.214 2.36748 374.695     17.4101  395.185     17.5154  114.511    156.126     39.3542     156.126     
1 1 1 18 4  57 o 7  63.1205 2.76037 73.3162     8.4084   68.9384     8.93692  35.9659    129.007     12.1882     129.007     
1 1 1 18 4  58 o 10 67.1817 2.64237 73.8958     8.68302  87.3995     9.01576  16.6664    17.7971     48.7004     197.797     
1 1 1 18 4  59 o 8  30.9654 4.62155 25.1654     7.50287  11.4035     6.57317  5.59077    4.20498     33.1007     4.20498     
1 1 1 18 4  60 o 15 122.196 2.69772 273.713     17.9651  258.56      14.9714  87.953     110.304     21.2308     110.304     
1 1 1 18 4  61 o 19 117.883 2.81322 249.412     18.4361  246.347     14.5411  72.3507    124.677     5.13072     304.677     
1 1 1 18 4  62 o 18 143.393 2.68384 381.233     19.7419  352.263     18.7996  85.2009    79.3208     14.3319     259.321     
1 1 1 18 4  63 o 15 51.0909 3.46056 55.9405     9.14101  39.0919     8.26679  11.8368    217.448     38.2426     37.448      
1 1 1 18 4  64 o 12 66.1698 3.08168 72.9027     10.833   84.5195     9.25059  37.0301    43.0679     7.73977     223.068     
1 1 1 18 4  65 o 16 67.2819 3.12969 85.8921     11.0094  76.9905     9.98612  15.4154    250.315     53.7804     70.3153     
1 1 1 18 4  66 o 4  16.2682 4.84218 -0.192606   5.80082  2.11363     7.57583  6.22701    321.485     20.9108     321.485     
1 1 1 18 4  67 o 13 41.9784 4.23434 39.9878     9.66435  25.8666     7.65559  10.2844    1.6435      29.1021     181.644     
1 1 1 18 4  68 o 12 80.5701 3.18173 127.191     13.2344  107.22      12.3464  48.4487    358.35      3.4474      178.35      
1 1 1 18 4  69 o 16 58.4895 3.97037 59.9624     11.4196  65.2079     11.558   30.8903    283.896     9.20267     103.896     
1 1 1 18 4  70 o 10 42.6764 4.45431 31.2744     9.12162  36.6402     9.32538  28.6736    47.5285     15.3133     47.5285     
1 1 1 18 4  71 o 11 42.601  4.50817 36.0006     9.18478  31.8192     9.42306  16.6412    236.19      16.515      56.1897     
1 1 1 18 4  72 o 10 68.4573 3.61327 88.8435     11.6522  81.9726     12.8534  49.8903    358.548     16.99       358.548     
1 1 1 18 4  73 o 15 39.0441 5.19657 29.2217     9.16602  29.1821     10.3989  16.5381    28.1891     12.0563     208.189     
1 1 1 18 4  74 o 4  57.6521 4.06135 66.9645     10.7509  56.253      12.1149  34.0011    263.004     1.48997     83.0035     
1 1 1 18 4  75 o 18 45.3968 4.59308 40.9482     10.2593  37.1062     10.0332  31.0073    218.1       9.95037     218.1       
1 1 1 18 4  76 o 10 76.1399 3.31374 115.927     13.605   96.6363     11.585   58.1574    129.124     24.2623     129.124     
1 1 1 18 4  77 o 18 64.1702 3.71858 73.9325     12.8589  78.656      10.6169  35.9012    67.1711     5.42917     247.171     
1 1 1 18 4  78 o 2  28.2703 6.4761  18.2109     10.3585  13.6402     10.7716  10.4096    15.4268     7.83917     195.427     
1 1 1 18 4  79 o 8  18.9627 5.7518  2.4354      9.54009  0.13522     10.0947  1.53434    96.5704     7.7733      276.57      
1 1 1 18 4  80 o 10 53.5922 5.18997 54.65       14.2507  57.5334     12.7625  29.9585    279.99      2.08966     99.9901     
1 1 1 18 4  81 o 11 66.617  4.67088 90.1686     15.8362  79.8561     14.9374  45.781     198.567     13.6587     198.567     
1 1 1 18 4  82 o 17 16.4222 5.34736 -2.21076    10.2239  -10.5045    10.3748  0.486626   80.4473     3.41625     260.447     
1 1 1 18 4  83 o 5  33.4707 5.60251 -6.39339    12.5012  47.1026     12.5163  9.24701    63.1502     18.7855     243.15      
1 1 1 18 4  84 o 12 37.7119 7.30417 26.5461     14.0642  36.5197     14.5821  21.2431    189.549     2.35675     189.549     
1 1 1 18 4  85 o 8  24.8962 7.38365 10.421      17.4073  7.38307     13.5911  7.82992    242.809     4.62399     62.8087     
1 1 1 18 4  86 f 0  22.8923 7.02619 -0.67928    17.0505  8.44695     13.6233  4.12039    228.795     0           0           
1 1 1 18 4  87 o 15 21.5078 6.70724 -11.1788    17.0205  9.22155     13.3756  1.98309    325.926     4.98095     145.926     
1 1 1 18 4  88 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 5  0  o 6  128.768 2.49707 294.48      16.0865  294.48      16.0865  46.2584    8.35233e-06 276.233     8.35233e-06 
1 1 1 18 5  1  o 9  128.982 2.28246 293.246     14.4513  296.578     15.0402  28.6122    328.758     10.9691     148.758     
1 1 1 18 5  2  o 17 332.08  3.2543  1933.34     53.1531  1975.9      55.161   175.464    190.576     116.757     10.576      
1 1 1 18 5  3  o 16 454.239 3.98035 3659.65     90.6076  3655.71     90.6081  240.68     118.837     169.338     298.837     
1 1 1 18 5  4  o 17 126.776 2.2445  291.848     13.9838  278.053     14.4993  31.9922    236.617     18.1537     56.6171     
1 1 1 18 5  5  o 13 527.336 4.50056 4961.68     118.935  4899.18     118.934  449.949    265.989     146.645     265.989     
1 1 1 18 5  6  o 3  576.138 4.94038 5873.71     145.25   5898.46     139.973  469.242    115.67      111.764     115.67      
1 1 1 18 5  7  o 9  834.952 6.87181 12345.9     282.168  12398.2     292.827  630.277    73.281      52.133      73.281      
1 1 1 18 5  8  o 6  195.385 2.34858 677.827     22.9923  675.211     23.0001  28.5493    227.86      208.674     47.8599     
1 1 1 18 5  9  o 8  618.151 5.22473 6789.67     164.826  6764.17     158.834  434.431    182.963     21.5114     2.96306     
1 1 1 18 5  10 o 7  376.602 3.60357 2527.22     68.0041  2501.09     68.0156  281.542    144.731     31.5654     144.731     
1 1 1 18 5  11 o 2  201.37  2.49576 722.121     25.1737  715.161     25.1976  125.183    180.103     12.9598     0.102646    
1 1 1 18 5  12 o 13 447.411 3.88735 3520.13     87.1496  3577.69     87.1679  342.348    305.216     47.5896     305.216     
1 1 1 18 5  13 o 8  509.202 4.54821 4526.13     111.561  4670.29     120.51   308.016    287.656     114.454     107.656     
1 1 1 18 5  14 o 2  254.924 3.01541 1159.83     39.3391  1143.94     37.6988  71.9479    134.894     213.23      314.894     
1 1 1 18 5  15 o 18 528.531 4.66658 4945.43     123.607  4962.95     123.599  290.12     239.486     178.426     59.4862     
1 1 1 18 5  16 o 7  506.553 4.5247  4556.55     110.35   4544.73     119.191  343.988    299.725     36.7947     119.725     
1 1 1 18 5  17 o 3  187.773 2.44932 621.551     23.0372  628.245     23.0591  122.947    290.096     2.52794     290.096     
1 1 1 18 5  18 o 3  535.671 4.53069 5065.73     121.611  5112.9      121.638  372.518    234.151     21.3741     54.1507     
1 1 1 18 5  19 o 12 269.627 2.8358  1294.26     38.3019  1282.99     38.3328  158.155    0.586082    59.2139     180.586     
1 1 1 18 5  20 o 4  103.229 2.15616 184.688     11.1206  193.401     11.1599  25.8686    254.655     56.1728     74.6546     
1 1 1 18 5  21 o 13 343.461 3.24169 2092.2      55.7787  2090.58     55.815   190.54     112.042     104.656     292.042     
1 1 1 18 5  22 o 10 512.116 4.33701 4660.52     111.293  4643.75     111.318  371.632    294.512     13.5139     294.512     
1 1 1 18 5  23 o 4  374.732 3.53535 2482.43     67.5841  2497.68     65.1693  225.018    266.953     80.1473     86.9526     
1 1 1 18 5  24 o 2  488.027 4.39537 4124.14     107.467  4328.02     107.482  328.407    172.882     36.7536     352.882     
1 1 1 18 5  25 o 3  115.054 2.27593 249.226     13.0845  220.831     13.0978  20.5106    126.448     101.642     306.448     
1 1 1 18 5  26 o 16 499.515 4.62181 4360.93     115.666  4495.74     115.708  454.201    48.1624     203.314     48.1624     
1 1 1 18 5  27 o 17 482.304 4.47489 4116.5      108.142  4139.68     108.175  366.114    171.179     50.6566     171.179     
1 1 1 18 5  28 o 13 226.371 2.88857 882.918     33.4441  934.578     32.0177  120.152    20.1436     69.766      200.144     
1 1 1 18 5  29 o 12 157.886 2.59429 439.595     21.4197  444.271     19.5826  98.1293    67.2859     4.80714     247.286     
1 1 1 18 5  30 o 4  135.28  2.30303 329.188     16.1949  319.662     15.0244  71.6342    201.854     25.6545     21.8539     
1 1 1 18 5  31 o 17 62.1427 2.66151 65.5414     8.31228  71.9695     8.16467  6.16224    17.3464     55.6726     17.3464     
1 1 1 18 5  32 o 17 598.08  5.27276 6338.98     161.128  6370.36     154.866  491.732    135.008     140.519     135.008     
1 1 1 18 5  33 o 3  196.732 2.62752 679.841     26.3653  692.633     25.4252  130.743    184.854     5.40635     4.85409     
1 1 1 18 5  34 f 0  254.291 2.90671 1142.08     36.9814  1151.4      37.1022  164.414    117.296     0           0           
1 1 1 18 5  35 f 0  251.381 2.92765 1125.35     36.8116  1116.07     36.9509  144.186    222.014     0           0           
1 1 1 18 5  36 o 2  179.509 2.80003 583.703     23.1474  559.32      26.9922  145.434    14.0274     53.2255     14.0274     
1 1 1 18 5  37 o 5  182.762 2.73533 613.375     23.7481  571.678     26.1884  104.384    340.77      38.3254     160.77      
1 1 1 18 5  38 o 10 124.287 2.67728 290.347     15.0965  258.505     17.8895  85.8022    18.8696     19.1978     18.8696     
1 1 1 18 5  39 o 7  285.033 3.55408 1436.08     47.8133  1447.58     53.5785  161.19     233.111     70.3752     53.1108     
1 1 1 18 5  40 o 12 275.567 3.68416 1357.47     49.2285  1338.37     52.4503  208.684    102.988     40.8349     102.988     
1 1 1 18 5  41 o 11 446.9   5.09093 3585.46     103.293  3517.42     123.615  315.734    242.523     13.6439     242.523     
1 1 1 18 5  42 o 3  88.8626 2.95701 145.687     12.1074  135.206     13.9977  24.0682    165.04      10.8023     165.04      
1 1 1 18 5  43 o 14 112.952 2.65469 223.13      14.5668  229.965     15.4429  66.0407    183.431     5.16929     3.43121     
1 1 1 18 5  44 o 16 80.5925 2.5617  112.71      10.3158  118.182     10.3195  34.2174    5.22135     1.93421     185.221     
1 1 1 18 5  45 o 11 131.907 2.38915 304.522     15.4093  313.047     16.1505  53.5171    76.8878     64.7085     256.888     
1 1 1 18 5  46 o 14 226.342 2.76399 884.974     29.4144  933.13      33.2565  177.807    215.461     53.3443     215.461     
1 1 1 18 5  47 o 14 286.427 3.1091  1383.34     42.695   1530.89     46.5878  239.694    44.8993     93.6604     44.8993     
1 1 1 18 5  48 o 6  117.393 2.49311 234.735     13.3813  254.873     15.8959  75.7685    78.6096     4.80696     78.6095     
1 1 1 18 5  49 o 1  246.8   3.21178 1051.34     37.7632  1112.49     41.6748  176.434    239.801     21.436      239.801     
1 1 1 18 5  50 o 15 150.512 2.58808 404.608     18.2461  399.739     20.6849  120.529    2.95817     46.0806     2.95817     
1 1 1 18 5  51 o 10 137.238 2.51954 335.435     16.2162  333.368     18.3479  108.231    4.69336     40.0762     4.69336     
1 1 1 18 5  52 o 16 161.449 2.58799 452.987     19.575   472.67      22.2663  109.821    127.686     7.30128     127.686     
1 1 1 18 5  53 o 14 163.904 2.58706 463.916     20.8101  490.379     21.6926  77.6275    121.241     61.6456     301.241     
1 1 1 18 5  54 f 0  202.02  2.65132 745.499     25.7107  704.787     27.8539  159.698    320.828     0           0           
1 1 1 18 5  55 o 14 197.901 2.63112 684.312     24.944   707.633     27.2274  170.043    272.245     80.4756     272.245     
1 1 1 18 5  56 o 18 249.373 2.9465  1076        36.7482  1137.03     36.8796  188.627    318.527     47.1785     318.527     
1 1 1 18 5  57 o 2  93.4334 2.6095  157.102     11.5909  153.84      12.7556  64.1849    229.372     12.9074     229.372     
1 1 1 18 5  58 o 19 192.327 2.66599 633.534     25.6738  683.201     25.6904  138.631    166.963     25.5642     166.963     
1 1 1 18 5  59 o 3  19.4448 5.04145 4.98125     6.07421  6.04672     6.77984  10.2178    192.391     26.4689     192.391     
1 1 1 18 5  60 o 11 177.824 2.75954 571.039     25.7188  555.628     23.4388  104.018    272.944     23.5942     92.9438     
1 1 1 18 5  61 o 16 82.4335 3.1042  128.008     13.4751  115.425     12.0881  42.6096    168.856     17.8051     348.856     
1 1 1 18 5  62 o 17 56.2014 3.35858 60.8053     9.62104  53.1113     9.11453  39.867     155.884     19.1763     155.884     
1 1 1 18 5  63 f 0  37.2764 4.49772 26.0932     8.16886  25.4067     8.03299  2.80186    319.551     0           0           
1 1 1 18 5  64 o 9  41.256  4.04901 24.8471     8.2265   38.3145     7.53786  12.3461    170.044     23.6525     350.044     
1 1 1 18 5  65 o 11 20.0532 5.05974 6.57884     6.64139  6.19405     6.19512  3.85565    182.351     22.0933     182.351     
1 1 1 18 5  66 o 11 74.4569 2.83061 103.59      11.116   95.5211     9.93152  17.0072    252.423     60.1426     72.423      
1 1 1 18 5  67 o 12 81.0309 3.1911  135.303     13.3449  102.499     12.3914  29.1627    134.36      43.9421     314.36      
1 1 1 18 5  68 o 6  40.2697 4.87794 30.2859     10.3857  30.6624     8.4979   13.6498    24.7869     19.6106     204.787     
1 1 1 18 5  69 o 6  67.8752 3.11073 98.6171     11.8445  69.0888     9.25509  51.1705    75.0327     20.1166     75.0327     
1 1 1 18 5  70 o 7  58.0424 4.21276 63.0505     12.1915  60.9654     11.9687  44.9091    174.344     22.0288     174.344     
1 1 1 18 5  71 o 1  37.8491 5.62555 31.2693     10.7346  24.2373     9.95479  19.9279    163.812     1.71392     343.812     
1 1 1 18 5  72 o 5  75.4929 3.52582 109.648     13.0016  98.0412     13.4586  51.5051    221.578     10.213      221.578     
1 1 1 18 5  73 o 17 28.5039 5.93495 19.1134     8.77572  12.104      9.7425   11.5997    338.593     6.0463      158.593     
1 1 1 18 5  74 o 11 64.8708 3.7229  75.2009     11.5139  79.7205     12.4842  37.837     89.8263     3.43332     269.826     
1 1 1 18 5  75 o 2  15.8155 4.92092 2.46283     7.53022  -8.64347    8.46089  1.45536    24.9176     14.1668     24.9176     
1 1 1 18 5  76 f 0  34.7472 5.65238 19.704      9.27434  28.8103     10.1044  18.2894    30.8458     0           0           
1 1 1 18 5  77 o 17 21.4833 5.97988 1.00262     8.3463   11.6024     10.9163  2.4304     252.129     15.2851     72.1287     
1 1 1 18 5  78 o 10 32.7681 6.44232 26.2273     10.3026  17.7654     12.1908  15.1419    72.6593     4.21729     252.659     
1 1 1 18 5  79 o 4  20.5297 5.93856 8.3045      8.57977  -3.77121    12.398   0.209173   340.526     17.3981     160.526     
1 1 1 18 5  80 o 7  19.9907 6.15887 -1.3375     10.0851  3.50622     12.938   2.65403    337.468     23.7445     337.468     
1 1 1 18 5  81 o 4  20.6759 6.21118 4.88489     10.5566  0.216131    12.1158  3.51494    5.97679     2.91225     185.977     
1 1 1 18 5  82 o 18 27.1976 7.05081 14.1233     11.5618  14.2316     13.6362  5.58282    299.733     17.6659     119.733     
1 1 1 18 5  83 o 6  21.6329 6.41858 7.55586     11.1277  0.375971    12.8379  5.7272     112.862     3.75686     292.862     
1 1 1 18 5  84 o 5  30.4897 7.87412 30.8505     18.1432  10.3933     13.8325  9.74886    79.9587     12.4327     259.959     
1 1 1 18 5  85 o 17 28.7523 7.75464 9.70442     18.5706  22.8643     14.3759  11.4903    198.825     0.894257    198.825     
1 1 1 18 5  86 o 12 28.8475 8.14144 24.9514     18.5832  11.5008     17.3844  10.0116    229.121     1.52866     49.1206     
1 1 1 18 5  87 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 6  0  o 14 648.902 5.57897 7468.35     181.363  7468.35     181.363  559.381    180         171.43      180         
1 1 1 18 6  1  o 12 298.973 3.06261 1585.12     46.7338  1583.48     45.0241  219.138    248.518     21.7953     248.518     
1 1 1 18 6  2  o 19 583.128 4.89181 6037.93     142.951  6022.81     142.955  443.608    11.0473     45.6894     11.0473     
1 1 1 18 6  3  o 12 174.875 2.3925  542.692     20.9646  541.224     20.9696  120.475    265.82      43.476      265.82      
1 1 1 18 6  4  o 15 944.668 7.5765  15916       358.679  15778.4     358.677  677.363    44.561      18.3059     224.561     
1 1 1 18 6  5  o 8  226.269 2.64941 925.676     29.4464  889.257     30.5953  122.532    71.5879     64.2887     251.588     
1 1 1 18 6  6  o 2  434.008 3.82904 3343.54     83.2758  3335.25     83.2871  340.993    266.011     62.4672     266.011     
1 1 1 18 6  7  o 6  432.445 3.9131  3318.64     86.3594  3312.36     83.2211  368.107    199.314     120.718     199.314     
1 1 1 18 6  8  o 12 418.267 3.83044 3104.11     78.7839  3099.13     81.7662  282.932    321.694     32.1364     141.694     
1 1 1 18 6  9  o 13 314.703 3.13383 1752.66     49.4247  1758.33     49.4229  226.206    245.29      10.7431     245.29      
1 1 1 18 6  10 o 6  557.99  4.81631 5508.15     137.137  5536.2      132.163  329.836    343.788     145.344     163.788     
1 1 1 18 6  11 o 9  326.251 3.07923 1901.13     50.3361  1872.33     50.351   147.364    13.4464     169.135     193.446     
1 1 1 18 6  12 o 10 472.997 4.12663 3958.07     99.6002  3976.18     95.9921  368.719    97.073      60.4778     97.073      
1 1 1 18 6  13 o 4  495.238 4.27278 4351.6      106.034  4347.1      106.054  314.351    149.716     82.7721     329.716     
1 1 1 18 6  14 o 15 475.81  4.57648 3962.24     106.738  4069.04     111.51   303.44     315.691     75.7132     135.691     
1 1 1 18 6  15 o 11 713.559 6.08937 9006.63     225.931  9070.77     209.188  531.801    109.808     34.4404     109.808     
1 1 1 18 6  16 o 1  102.68  2.26105 191.696     11.3937  182.437     11.8271  22.0913    172.836     64.736      352.836     
1 1 1 18 6  17 o 8  565.125 4.89137 5656.39     138.525  5675.85     138.529  411.148    21.9212     10.8449     21.9212     
1 1 1 18 6  18 o 14 68.8203 2.33304 83.19       8.0261   85.0879     8.01886  52.0594    175.791     178.813     175.791     
1 1 1 18 6  19 o 5  622.045 5.25837 6904.9      160.824  6830.09     166.922  466.062    200.859     39.0787     200.859     
1 1 1 18 6  20 o 9  298.791 3.00864 1593.27     45.8751  1572.19     44.22    252.472    354.868     89.4908     354.868     
1 1 1 18 6  21 o 12 312.352 3.3829  1685.25     54.0302  1775.28     51.7667  249.414    67.5814     62.0747     67.5814     
1 1 1 18 6  22 o 17 237.145 2.83174 995.739     33.6475  998.239     33.659   200.218    240.308     80.5156     240.308     
1 1 1 18 6  23 o 17 56.2396 2.73194 64.7682     7.58971  48.4977     7.58668  18.1166    248.093     65.1428     248.093     
1 1 1 18 6  24 o 5  218.262 2.72543 830.968     29.7957  858.234     29.8205  90.2505    292.41      121.236     112.41      
1 1 1 18 6  25 o 19 600.233 5.50392 6366.52     169.085  6431.83     161.914  452.903    213.609     50.6414     213.609     
1 1 1 18 6  26 o 14 258.779 2.90148 1179.77     38.327   1194.97     36.905   151.381    122.224     56.2185     302.224     
1 1 1 18 6  27 o 4  632.586 5.41754 7083.77     171.715  7132.81     171.772  501.196    16.7398     103.105     16.7398     
1 1 1 18 6  28 o 2  257.832 2.84329 1161.96     36.7097  1195.57     36.762   171.822    212.156     13.0451     32.1566     
1 1 1 18 6  29 o 13 308.216 3.09508 1655.92     47.7574  1713.66     47.8466  187.025    253.777     57.569      73.7772     
1 1 1 18 6  30 o 8  439.171 4.19368 3420.55     96.0394  3425.64     88.3901  328.582    314.506     37.8571     314.506     
1 1 1 18 6  31 o 8  148.807 2.3987  378.901     17.8075  406.478     17.9568  75.6528    10.3847     47.0225     190.385     
1 1 1 18 6  32 o 5  351.184 3.51126 2147.33     62.9594  2229.04     60.5469  208.243    330.193     77.0429     150.193     
1 1 1 18 6  33 o 19 383.844 3.71017 2597.14     72.732   2631.84     69.9577  244.752    62.1388     49.7074     242.139     
1 1 1 18 6  34 o 8  217.898 2.87479 853.495     30.6204  830.665     32.1211  139.404    162.775     20.8565     342.775     
1 1 1 18 6  35 o 8  217.824 2.78336 849.556     29.621   833.374     31.111   131.309    28.7746     36.7353     208.775     
1 1 1 18 6  36 o 3  216.553 3.15554 818.613     34.2275  845.324     34.2565  134.808    304.753     27.0018     124.753     
1 1 1 18 6  37 o 17 90.8032 2.56562 153.329     11.3244  139.72      11.9227  34.5352    86.3786     37.9254     266.379     
1 1 1 18 6  38 o 3  103.304 2.49412 197.354     12.5608  181.725     13.1754  13.823     342.112     105.613     162.112     
1 1 1 18 6  39 o 3  134.658 2.46    331.585     16.196   311.891     16.9452  87.4593    41.6806     2.71676     41.6807     
1 1 1 18 6  40 o 16 311.986 3.45204 1731.85     53.9243  1723.18     54.0199  234.178    173.957     39.3164     173.957     
1 1 1 18 6  41 o 1  337.638 3.71162 2041.81     61.2474  2006.16     64.2894  251.978    61.9714     39.5023     61.9714     
1 1 1 18 6  42 o 12 149.159 2.58272 405.595     19.1127  383.998     19.4602  111.19     288.99      31.3831     288.99      
1 1 1 18 6  43 o 8  180.827 2.7378  605.844     24.068   554.78      25.4363  121.709    346.368     2.91808     346.368     
1 1 1 18 6  44 o 5  73.1752 2.8534  91.4556     9.61182  99.1996     11.224   24.9419    329.757     3.12993     149.757     
1 1 1 18 6  45 o 18 304.291 3.23663 1606.78     47.1131  1680.8      51.5801  259.891    47.4454     106.985     47.4454     
1 1 1 18 6  46 f 0  68.3971 2.96064 79.3939     9.49032  87.3706     10.7126  35.7723    335.163     0           0           
1 1 1 18 6  47 o 13 252.712 2.95339 1108.25     34.8364  1159.21     39.8972  189.609    202.215     38.2364     202.215     
1 1 1 18 6  48 o 16 38.5469 4.62621 32.1748     7.48569  22.5052     9.2785   3.47448    208.391     22.6175     208.391     
1 1 1 18 6  49 o 15 172.472 2.66778 514.114     21.8674  542.05      24.2389  123.935    27.6723     18.9804     27.6723     
1 1 1 18 6  50 o 3  417.055 3.96333 3045.8      79.3036  3144.88     86.313   338.346    136.165     111.37      136.165     
1 1 1 18 6  51 o 5  298.497 3.38107 1560.19     48.2177  1608.61     52.8904  245.191    252.691     88.8231     252.691     
1 1 1 18 6  52 o 1  158.717 2.56402 458.696     19.9146  436.127     20.8303  102.236    306.755     5.00093     126.755     
1 1 1 18 6  53 o 3  124.627 2.57823 273.505     15.727   278.757     16.4413  82.3039    321.273     3.43809     321.273     
1 1 1 18 6  54 o 6  251.875 3.08583 1102.56     35.2239  1154.92     42.4876  192.921    133.571     50.2505     133.571     
1 1 1 18 6  55 o 7  113.96  2.56607 225.902     13.652   236.261     15.593   80.1315    173.467     14.7627     173.467     
1 1 1 18 6  56 o 13 141.314 2.55216 350.726     17.6797  359.859     18.4382  96.4426    334.024     8.8937      334.024     
1 1 1 18 6  57 o 10 127.22  2.56556 276.742     15.2867  299.737     17.3896  82.3874    258.671     0.416035    258.671     
1 1 1 18 6  58 o 2  114.108 2.43118 223.569     13.6298  240.199     14.1437  69.1256    305.688     7.90984     125.688     
1 1 1 18 6  59 o 7  33.6318 4.49535 29.0524     7.00805  13.8646     7.37785  1.95347    113.345     10.5557     293.345     
1 1 1 18 6  60 o 15 16.9641 4.82315 0.688179    5.98116  4.09381     6.65546  15.9556    229.653     40.5717     229.653     
1 1 1 18 6  61 o 15 148.756 2.76414 379.618     21.9785  410.254     18.9481  96.8628    308.425     0.314352    308.423     
1 1 1 18 6  62 o 19 116.249 2.69072 233.537     16.5478  249.239     14.6214  64.0008    60.9865     22.4121     240.986     
1 1 1 18 6  63 o 11 78.274  2.85171 109.209     11.7579  110.33      10.4935  62.1237    222.285     27.1326     222.285     
1 1 1 18 6  64 o 19 71.2946 2.9022  92.9979     11.0642  89.4882     9.55432  53.0856    196.101     18.3013     196.101     
1 1 1 18 6  65 o 16 62.1069 3.38197 79.6406     12.1339  60.506      8.79657  29.8745    61.4786     17.3773     241.479     
1 1 1 18 6  66 o 5  48.9985 4.05235 39.1036     10.5642  49.27       8.3372   14.8766    281.003     30.0563     101.003     
1 1 1 18 6  67 o 11 70.2976 2.48158 82.8353     9.12454  94.489      8.18197  25.6383    271.402     37.045      91.402      
1 1 1 18 6  68 o 10 47.3208 4.29125 35.5781     10.884   47.6114     7.99469  5.801      111.644     46.3986     291.644     
1 1 1 18 6  69 o 15 98.2811 2.75782 189.665     14.9352  158.127     12.2023  83.9034    324.625     45.4746     324.625     
1 1 1 18 6  70 o 7  16.3146 4.99789 -1.38424    8.83838  0.457976    6.23395  1.61137    246.532     9.76565     246.532     
1 1 1 18 6  71 o 5  18.0432 5.23664 -2.85822    9.21125  5.20243     6.76937  3.9501     204.758     23.8272     204.758     
1 1 1 18 6  72 o 14 115.715 2.98928 239.557     18.17    244.409     16.3692  74.975     193.073     4.90754     193.073     
1 1 1 18 6  73 o 4  32.6433 5.83443 13.155      10.4687  28.8218     9.52925  17.4997    231.621     0.230869    231.622     
1 1 1 18 6  74 o 19 33.8046 5.69123 21.3567     8.81185  24.0928     10.1987  6.63923    347.369     26.1627     167.369     
1 1 1 18 6  75 o 18 26.1614 5.85247 17.7192     8.67939  8.13265     9.27915  11.2692    330.226     0.777659    330.226     
1 1 1 18 6  76 o 12 73.6596 3.56296 103.934     12.7539  96.5521     13.3431  46.9937    199.683     4.39971     199.683     
1 1 1 18 6  77 o 5  18.0849 5.31811 -6.44403    8.09648  7.85967     8.96594  1.12759    98.0835     9.06786     278.083     
1 1 1 18 6  78 o 4  38.0955 6.13295 29.1644     10.9537  30.384      11.9376  17.3027    196.99      7.90723     16.9901     
1 1 1 18 6  79 o 12 59.5064 4.91714 69.5174     14.1125  67.5112     14.6391  40.7277    338.016     12.1347     338.016     
1 1 1 18 6  80 o 19 75.8287 4.4087  117.846     16.391   100.644     16.6888  42.8766    355.624     5.09785     175.624     
1 1 1 18 6  81 f 0  44.8223 6.17643 47.1806     13.2134  35.3479     13.4716  14.3547    207.788     0           0           
1 1 1 18 6  82 o 1  37.827  6.87343 37.6711     12.2041  23.5057     14.9182  21.2463    172.273     1.30394     172.273     
1 1 1 18 6  83 o 14 20.7917 6.43192 -2.51818    12.0354  5.32642     13.5426  4.37896    193.873     2.47182     13.873      
1 1 1 18 6  84 o 6  47.6608 8.20352 45.5076     19.6374  62.9017     19.5452  31.9637    8.51981     12.4164     8.51981     
1 1 1 18 6  85 o 19 38.8269 8.7711  34.9828     20.5206  43.3403     18.6046  19.3386    81.4048     1.35068     261.405     
1 1 1 18 6  86 o 18 22.9196 7.20145 -6.49181    18.0649  10.3368     16.268   3.06372    74.6049     5.81033     254.605     
1 1 1 18 6  87 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 7  0  o 19 327.627 3.17817 1903.36     52.1595  1903.36     52.1595  187.627    180         103.561     8.65648e-06 
1 1 1 18 7  1  o 4  68.2593 2.62367 83.092      8.90889  82.5562     8.97309  5.23219    130.77      24.6598     130.77      
1 1 1 18 7  2  o 9  554.209 4.68525 5494.05     130.125  5401.23     130.122  386.594    152.086     28.5245     332.086     
1 1 1 18 7  3  o 18 366.948 3.42635 2414.94     63.0108  2359.31     62.9992  275.417    132.982     28.4036     132.982     
1 1 1 18 7  4  o 8  273.241 2.90093 1333.56     38.9729  1313.19     40.4465  168.53     252.999     46.3363     72.9991     
1 1 1 18 7  5  o 19 94.9903 2.23985 160.043     10.6637  160.133     10.6315  9.24243    293.421     69.5075     113.421     
1 1 1 18 7  6  o 11 461.924 4.12071 3767.91     97.1249  3799.39     93.6063  407.484    138.284     153.469     138.284     
1 1 1 18 7  7  o 2  252.349 2.82761 1132.75     37.1202  1124.71     34.3531  187.838    17.8064     27.986      17.8064     
1 1 1 18 7  8  o 3  527.72  4.772   4933.38     123.656  4946.32     128.703  405.307    154.356     49.6437     154.356     
1 1 1 18 7  9  o 1  422.682 3.94263 3191.44     83.5075  3144.67     83.5177  276.051    174.442     54.8548     354.442     
1 1 1 18 7  10 o 6  138.883 2.21205 344.012     15.3858  339.673     15.4054  36.2043    124.72      107.613     304.72      
1 1 1 18 7  11 o 2  91.2529 2.22636 150.757     10.157   144.782     10.1715  37.6153    148.688     185.999     148.688     
1 1 1 18 7  12 o 5  256.591 2.68199 1177.82     34.4772  1156.22     34.495   207.308    293.709     61.2369     293.709     
1 1 1 18 7  13 o 9  137.582 2.23739 342.63      15.3816  328.403     15.4642  78.1773    298.655     6.82764     118.655     
1 1 1 18 7  14 o 15 55.9558 2.72797 52.8203     7.30848  58.7871     7.90113  8.42961    285.231     30.0701     285.231     
1 1 1 18 7  15 o 6  600.023 5.33867 6500.75     170.037  6280.38     150.74   379.723    235.621     106.693     55.6208     
1 1 1 18 7  16 o 14 375.833 3.54127 2507.82     66.6858  2501.53     66.7104  238.565    86.3113     59.6        266.311     
1 1 1 18 7  17 o 7  163.234 2.50396 477.27      20.0031  467.351     20.941   80.0217    178.296     57.2138     358.296     
1 1 1 18 7  18 o 8  257.637 3.01912 1189.49     38.102   1164.18     39.8185  162.974    237.056     34.1731     57.0561     
1 1 1 18 7  19 o 8  301.292 3.38079 1609.88     51.0391  1609.53     51.054   238.181    31.1181     54.2723     31.1181     
1 1 1 18 7  20 o 7  723.158 6.79583 9262.3      240.35   9333.24     252.119  619.014    145.213     198.762     145.213     
1 1 1 18 7  21 o 6  488.161 4.8227  4204.09     115.138  4255.71     120.788  396.558    276.236     96.6304     276.236     
1 1 1 18 7  22 o 9  352.29  3.81429 2225.39     65.6862  2177.81     68.9143  230.131    82.9263     38.556      262.926     
1 1 1 18 7  23 o 15 101.729 2.32757 181.788     11.5513  185.493     12.1473  3.56725    231.439     117.218     51.4391     
1 1 1 18 7  24 o 2  232.256 2.72256 966.837     31.0058  945.973     32.3402  173.436    28.8409     29.8493     28.8409     
1 1 1 18 7  25 o 14 53.6926 2.82786 44.8738     7.32149  58.3716     7.7319   65.8366    218.554     186.619     218.554     
1 1 1 18 7  26 o 12 53.6975 2.85706 58.0778     7.3108   45.1667     7.78127  23.4134    185.093     85.1501     185.093     
1 1 1 18 7  27 o 3  59.2311 2.75747 62.2966     7.67469  62.6523     8.58004  6.02565    203.866     48.0718     203.866     
1 1 1 18 7  28 o 18 363.239 3.59467 2316.57     61.3919  2365        69.3143  302.636    10.7057     94.1609     10.7057     
1 1 1 18 7  29 o 14 200.406 2.53185 709.94      24.8897  714.197     25.9576  120.765    111.155     34.4396     291.155     
1 1 1 18 7  30 o 6  316.363 3.16312 1753.06     48.1449  1797.48     52.1177  223.913    196.081     3.09967     196.08      
1 1 1 18 7  31 o 6  355.785 3.60346 2221.65     64.1875  2270.54     64.3065  278.19     193.312     56.0838     193.312     
1 1 1 18 7  32 o 18 240.162 3.08174 1022.97     34.2813  1023.13     39.7006  168.093    59.921      3.18621     59.921      
1 1 1 18 7  33 o 18 150.431 2.58745 406.646     19.9442  395.93      19.0672  111.582    359.731     26.1553     359.731     
1 1 1 18 7  34 o 16 58.5839 2.8869  56.9649     8.23339  65.5196     8.60134  3.79355    243.829     11.4196     63.8291     
1 1 1 18 7  35 o 13 213.977 2.90691 823.13      31.9669  801.187     30.373   145.559    104.089     1.94526     284.089     
1 1 1 18 7  36 o 13 247.499 3.03956 1068.77     38.5276  1104.71     36.8174  108.175    139.454     126.9       319.454     
1 1 1 18 7  37 o 10 318.857 3.37124 1787.42     52.6706  1821.05     55.0614  189.88     208.306     63.6895     28.3065     
1 1 1 18 7  38 o 4  162.446 2.5192  445.994     18.968   490.491     22.0449  108.4      154.801     1.21415     154.8       
1 1 1 18 7  39 f 0  327.136 3.36882 1848.17     52.8265  1951.15     57.6267  209.848    254.227     0           0           
1 1 1 18 7  40 o 10 352.155 3.61842 2106.6      62.321   2298.74     65.4006  240.047    345.412     7.11358     165.412     
1 1 1 18 7  41 o 4  380.654 3.9696  2545.74     72.1251  2601.61     79.227   276.246    178.782     26.3849     178.782     
1 1 1 18 7  42 o 12 353.463 3.73657 2154.18     59.8388  2284.04     72.2697  280.394    56.7073     74.5683     56.7072     
1 1 1 18 7  43 o 5  221.32  2.80857 857.476     28.8541  880.687     33.3402  165.51     64.5483     32.2763     64.5483     
1 1 1 18 7  44 o 16 228.244 2.96152 933.507     32.033   915.537     35.5853  157.518    201.551     6.05155     201.551     
1 1 1 18 7  45 o 7  118.954 2.54336 252.686     14.4809  249.833     15.7717  85.873     211.467     24.3395     211.467     
1 1 1 18 7  46 o 11 320.599 3.43408 1835.97     53.7805  1815.63     56.5162  229.903    342.739     22.1344     342.739     
1 1 1 18 7  47 o 7  171.7   2.61831 507.148     21.7781  539.486     23.2862  117.145    235.343     5.22309     235.343     
1 1 1 18 7  48 o 19 151.58  2.50977 411.779     18.7899  403.759     19.3295  108.937    259.602     17.4995     259.602     
1 1 1 18 7  49 o 8  65.1507 3.17732 65.4332     9.45394  86.8892     11.1826  32.6906    231.494     7.94026     231.494     
1 1 1 18 7  50 o 13 149.81  2.66546 397.779     20.0945  399.583     19.9104  117.942    295.91      39.5222     295.91      
1 1 1 18 7  51 o 2  251.768 2.96558 1107.65     36.5156  1145.68     38.3193  152.749    89.7117     33.7951     269.712     
1 1 1 18 7  52 o 5  48.6252 3.66585 40.5645     8.85128  44.6504     8.71141  13.8469    188.199     15.2026     8.19902     
1 1 1 18 7  53 o 15 71.6938 3.02691 88.9049     10.6144  94.651      11.0383  47.739     257.378     20.2441     257.378     
1 1 1 18 7  54 o 6  56.6304 3.38246 52.0657     9.50029  63.2866     9.43331  0.768989   77.8902     67.4316     257.89      
1 1 1 18 7  55 o 12 182.933 2.70314 597.146     25.3004  593.423     24.2537  144.859    67.0281     48.4917     67.0281     
1 1 1 18 7  56 o 19 130.107 2.47908 303.235     16.247   299.31      16.0519  83.6561    142.491     1.87622     322.491     
1 1 1 18 7  57 o 3  208.531 2.57384 749.891     26.8875  798.307     26.8877  147.87     47.7248     20.5111     47.7248     
1 1 1 18 7  58 o 3  53.9846 3.20632 49.8183     8.47004  55.0055     8.71186  11.966     236.922     6.42107     236.922     
1 1 1 18 7  59 o 9  107.021 2.43004 192.623     12.776   215.884     13.2466  67.8046    80.4227     1.81344     260.423     
1 1 1 18 7  60 o 3  132.568 2.63531 306.531     18.1478  320.546     16.7663  108.223    158.515     44.8837     158.515     
1 1 1 18 7  61 o 10 111.749 2.78612 212.887     15.8137  233.693     15.2868  71.1854    223.999     2.40466     43.9989     
1 1 1 18 7  62 o 14 48.8787 3.58711 43.0267     9.31228  43.6735     7.92215  12.3962    140.637     35.5155     320.637     
1 1 1 18 7  63 o 18 44.3501 3.90328 33.5108     8.63606  38.5479     8.25837  16.1114    63.7341     20.9136     243.734     
1 1 1 18 7  64 o 13 83.491  2.79103 118.256     12.2285  131.961     10.918   66.3577    43.4071     28.0982     43.4071     
1 1 1 18 7  65 o 7  112.81  2.51529 209.982     14.9892  246.114     13.1295  72.728     151.971     0.911064    151.971     
1 1 1 18 7  66 o 3  57.8917 3.20595 64.0142     9.96498  57.3609     8.48816  36.8423    299.639     3.16903     299.639     
1 1 1 18 7  67 o 16 19.2571 5.29067 8.43262     8.74997  1.02168     6.04192  2.12293    260.483     18.0967     260.483     
1 1 1 18 7  68 o 14 43.9685 4.42839 37.7975     10.4085  34.2149     8.52772  21.6485    311.087     8.4985      131.087     
1 1 1 18 7  69 o 1  55.5388 3.74215 57.9594     11.4637  54.9672     9.00115  29.4968    78.0648     8.82535     258.065     
1 1 1 18 7  70 o 11 36.0333 5.15308 22.7793     10.0835  26.9526     7.7682   18.9286    36.4956     2.14977     216.496     
1 1 1 18 7  71 f 0  59.4498 3.59438 66.4458     11.7941  63.0412     9.3079   29.3079    88.7703     0           0           
1 1 1 18 7  72 o 14 56.3275 3.6359  67.394      11.5253  49.9945     8.82883  28.304     341.048     12.4409     161.048     
1 1 1 18 7  73 o 7  72.2639 3.23531 114.551     13.4451  77.9441     9.95412  39.0737    188.082     11.2746     8.08213     
1 1 1 18 7  74 o 3  27.4006 6.42454 9.96663     11.6263  18.1287     9.73179  10.6241    144.401     6.90598     324.401     
1 1 1 18 7  75 o 9  54.6546 4.93508 53.6204     13.8015  61.4132     12.3416  39.7419    175.134     14.928      175.134     
1 1 1 18 7  76 o 6  94.0058 3.6693  164.34      18.3897  162.924     15.9549  66.6606    345.395     18.081      345.395     
1 1 1 18 7  77 o 12 44.0412 5.68018 22.0912     11.4379  59.012      12.3378  28.2339    302.404     7.01147     302.404     
1 1 1 18 7  78 o 1  43.1646 6.44065 38.2225     12.9704  39.0133     14.0138  21.3314    340.127     6.34973     160.127     
1 1 1 18 7  79 o 12 27.2559 6.8503  16.3687     10.5052  11.8293     13.5445  9.13636    78.0781     8.48626     258.078     
1 1 1 18 7  80 o 8  32.2508 7.35313 28.4558     11.1536  6.76263     21.6357  11.7575    184.914     11.7511     4.91354     
1 1 1 18 7  81 o 6  37.0786 6.95841 25.364      11.3561  34.3269     14.9654  20.5583    358.119     0.624371    358.119     
1 1 1 18 7  82 o 13 21.7882 6.29377 4.43118     9.81286  8.22363     11.9161  5.59956    135.384     1.40166     315.384     
1 1 1 18 7  83 o 7  35.2114 7.33747 25.0224     14.1773  31.458      13.6888  19.8582    208.63      11.5545     208.63      
1 1 1 18 7  84 o 13 18.4347 5.92807 2.36325     11.8625  -10.9153    12.8651  0.507076   204.109     2.35488     24.1086     
1 1 1 18 7  85 o 14 21.4048 6.71357 3.64103     13.8203  1.07607     14.9181  1.94462    339.516     4.33137     159.516     
1 1 1 18 7  86 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 8  0  o 19 590.736 4.96254 6189.85     146.866  6189.85     146.866  379.086    4.93093e-06 106.147     180         
1 1 1 18 8  1  o 16 351.506 3.33457 2192.19     57.6394  2188.85     59.8185  255.61     296.296     8.79735     296.296     
1 1 1 18 8  2  o 13 415.764 3.86639 3058.47     80.552   3072.06     80.5651  238.498    351.464     123.224     171.464     
1 1 1 18 8  3  o 15 171.429 2.38125 515.217     20.4635  526.535     20.4494  58.437     332.67      116.953     152.67      
1 1 1 18 8  4  o 7  132.212 2.28451 312.042     15.4366  307.566     14.834   69.9365    34.8635     15.3971     214.863     
1 1 1 18 8  5  o 6  161.053 2.34483 460.757     18.5655  458.671     19.2764  40.9703    76.0379     137.176     256.038     
1 1 1 18 8  6  o 7  238.664 2.72197 1011.61     33.1472  1007.71     31.9563  178.605    329.313     27.1722     329.313     
1 1 1 18 8  7  o 11 447.109 4.2865  3562.86     96.0367  3528.69     96.0523  365.843    267.582     88.299      267.582     
1 1 1 18 8  8  o 2  94.0242 2.39922 157.261     11.4848  156.529     11.0854  64.0436    253.105     250.063     253.105     
1 1 1 18 8  9  o 18 323.567 3.34869 1859.06     50.9148  1853.47     57.4761  253.055    217.257     46.5779     217.257     
1 1 1 18 8  10 o 12 51.9077 2.7258  51.9036     6.85947  44.2996     7.15531  46.9635    41.0742     134.933     41.0742     
1 1 1 18 8  11 o 19 311.296 3.08859 1705.23     47.2657  1730.86     49.0948  238.03     60.5665     34.9135     60.5665     
1 1 1 18 8  12 o 8  45.8737 3.15172 36.4835     6.93054  38.8582     7.37995  61.0664    205.25      157.787     205.25      
1 1 1 18 8  13 o 16 332.935 3.84812 1963.91     62.5004  1967.96     65.8684  239.963    111.197     6.05649     111.197     
1 1 1 18 8  14 o 6  90.7654 2.71776 144.74      12.0454  147.877     12.6211  1.18633    279.537     106.882     279.537     
1 1 1 18 8  15 o 10 468.782 4.71224 3883.44     108.035  3916.35     113.328  398.482    7.54601     124.577     7.54601     
1 1 1 18 8  16 o 9  390.661 4.16235 2717.32     81.4846  2697.79     81.4927  260.375    279.738     38.3822     99.7378     
1 1 1 18 8  17 o 8  426.895 4.4684  3228.24     90.692   3239.56     100.272  302.994    81.703      5.54454     261.703     
1 1 1 18 8  18 o 3  336.205 3.63395 2043.63     58.3208  1966.42     63.8822  166.216    323.387     147.172     143.387     
1 1 1 18 8  19 o 17 201.926 2.63468 746.933     26.057   699.166     27.194   162.511    11.6287     56.6711     11.6287     
1 1 1 18 8  20 o 18 240.913 2.79199 1023.29     32.9892  1034.76     34.4188  195.56     333.756     61.0314     333.756     
1 1 1 18 8  21 o 9  396.475 3.80703 2795.02     74.0842  2782.31     77.1609  394.733    90.2056     231.225     90.2056     
1 1 1 18 8  22 o 1  164.582 2.45596 485.944     19.7773  474.47      20.7114  80.6736    272.589     59.5823     92.589      
1 1 1 18 8  23 o 4  291.484 3.04758 1504.09     42.7406  1509.24     46.2316  218.413    317.643     27.7514     317.643     
1 1 1 18 8  24 o 13 213.64  2.62538 817.033     26.9359  801.428     29.2107  157.208    240.274     21.5964     240.274     
1 1 1 18 8  25 o 15 77.9747 2.49427 106.474     9.0679   109.561     10.3488  15.8567    157.226     43.2935     337.226     
1 1 1 18 8  26 o 13 320.745 3.33794 1830.77     50.2606  1818.88     56.823   200.675    194.71      52.6872     14.7096     
1 1 1 18 8  27 o 14 724.196 6.33751 9246.38     220.222  9416.79     239.537  605.969    164.259     176.997     164.259     
1 1 1 18 8  28 o 6  327.647 3.60325 1883.1      56.4035  1926.55     61.8557  213.564    221.62      36.6301     41.6204     
1 1 1 18 8  29 o 2  251.815 3.07433 1113.95     36.9648  1135.53     40.5757  176.706    352.021     1.1139      352.021     
1 1 1 18 8  30 o 3  135.711 2.61583 329.544     17.3078  324.119     18.2194  115.534    172.815     72.0756     172.815     
1 1 1 18 8  31 o 18 148.59  2.5189  378.227     17.8339  404.995     19.6812  134.038    249.861     91.4656     249.861     
1 1 1 18 8  32 o 15 135.15  2.55734 325.896     17.2219  322.36      17.3867  99.0959    4.8765      25.1783     4.8765      
1 1 1 18 8  33 o 18 288.382 3.3049  1446.82     43.1971  1504.66     52.0732  235.899    37.1087     70.5806     37.1087     
1 1 1 18 8  34 o 8  145.147 2.58169 369.086     17.7436  378.415     19.7646  126.563    2.94501     77.1893     2.94501     
1 1 1 18 8  35 o 7  344.574 3.63905 2128.67     58.5205  2086.5      66.7953  266.713    216.762     52.2765     216.762     
1 1 1 18 8  36 o 12 215.822 2.79811 812.064     29.4875  840.475     31.0397  192.174    259.112     93.2197     259.112     
1 1 1 18 8  37 f 0  266.658 2.91435 1248.33     37.1921  1274.62     40.6544  210.402    296.274     0           0           
1 1 1 18 8  38 o 5  71.7299 2.70197 86.4045     9.53485  96.7857     9.81017  1.70232    157.666     79.7593     337.666     
1 1 1 18 8  39 o 1  251.644 2.96227 1105.98     38.0554  1141.19     36.615   185.407    47.7029     25.6587     47.703      
1 1 1 18 8  40 o 4  103.486 2.80391 171.818     14.8037  209.658     14.0252  54.6118    238.08      17.7995     58.0797     
1 1 1 18 8  41 f 0  237.178 2.99886 967.376     33.8133  1029.54     37.4695  158.572    353.116     0           0           
1 1 1 18 8  42 o 13 335.767 3.46884 1998.81     58.2731  2004.81     58.465   254.964    202.516     47.3786     202.516     
1 1 1 18 8  43 o 7  56.0123 3.18264 55.4751     8.39526  56.6336     9.30536  5.2619     209.804     38.7578     29.8035     
1 1 1 18 8  44 o 4  66.0975 3.11179 68.5186     9.1238   87.8948     11.4122  24.245     187.051     10.3081     7.05099     
1 1 1 18 8  45 o 6  136.865 2.47416 328.988     16.4112  335.973     17.5054  90.4887    183.903     1.16316     183.903     
1 1 1 18 8  46 o 13 191.394 2.6576  649.259     24.8089  651.099     26.1561  112.273    193.212     34.5845     13.2116     
1 1 1 18 8  47 o 13 338.254 3.55648 2050.51     58.8137  2017.91     61.6991  236.041    8.18015     9.42006     8.18013     
1 1 1 18 8  48 o 12 250.29  2.94179 1105.81     36.708   1119.96     37.0906  198.519    80.5413     57.9483     80.5413     
1 1 1 18 8  49 o 2  121.203 2.54403 263.137     15.1897  259.022     15.6724  65.2165    26.6993     29.0036     206.699     
1 1 1 18 8  50 o 17 155.311 2.49379 423.599     19.9733  433.154     18.8141  106.61     61.7799     6.96516     61.7799     
1 1 1 18 8  51 o 2  171.352 2.47976 509.783     21.4689  533.416     21.1011  107.956    165.456     12.9292     345.456     
1 1 1 18 8  52 o 19 28.4172 4.90331 10.0659     7.22385  20.0227     6.98177  10.2685    117.999     38.9042     117.999     
1 1 1 18 8  53 o 1  139.375 2.52647 339.08      18.1301  351.803     17.1066  119.485    258.642     58.0021     258.642     
1 1 1 18 8  54 o 6  77.3473 2.97546 101.938     12.1407  111.854     10.7011  35.6375    270.683     25.5586     90.6825     
1 1 1 18 8  55 o 13 70.5021 3.24501 82.4639     12.1058  95.8212     10.4473  47.4433    245.109     14.8181     245.109     
1 1 1 18 8  56 o 9  21.5379 5.44555 1.54866     8.07141  11.0567     7.68462  9.78846    230.768     27.9377     230.768     
1 1 1 18 8  57 o 13 87.384  2.72867 132.25      11.827   140.416     12.0093  47.3228    265.63      15.9966     85.6303     
1 1 1 18 8  58 o 9  188.923 2.62959 610.157     24.8333  662.23      24.9314  142.771    341.988     36.5747     341.988     
1 1 1 18 8  59 o 6  154.7   2.53163 411.893     19.5416  441.247     19.6998  127.925    316.552     53.381      316.552     
1 1 1 18 8  60 o 5  106.669 2.56706 191.323     13.8824  215.281     13.4566  72.1642    304.001     5.88869     304.001     
1 1 1 18 8  61 o 17 41.6705 4.09439 25.6535     8.04037  38.7916     8.3494   25.4667    358.194     10.3736     358.194     
1 1 1 18 8  62 o 8  43.7127 3.73254 34.7144     7.7945   35.064      8.22287  15.3904    238.293     21.8425     58.2929     
1 1 1 18 8  63 o 15 85.5149 2.88806 131.451     12.469   131.094     12.212   63.9109    245.329     19.418      245.329     
1 1 1 18 8  64 o 11 53.4348 3.6119  55.3533     9.44083  48.6865     9.617    42.9489    299.231     26.7291     299.231     
1 1 1 18 8  65 o 3  15.4685 4.64735 -0.841207   5.97606  1.57176     6.61617  19.4428    160.121     53.7827     160.121     
1 1 1 18 8  66 o 15 21.5829 5.17447 6.56772     6.66034  9.55359     6.76418  0.343749   24.335      19.2626     24.3351     
1 1 1 18 8  67 o 8  24.6661 5.94643 19.6884     10.6491  -2.03988    9.42455  5.42548    282.087     8.67086     102.087     
1 1 1 18 8  68 o 3  74.4766 3.00065 119.242     12.261   82.7166     10.0577  41.2774    139.118     10.951      319.118     
1 1 1 18 8  69 o 10 26.2564 5.65152 10.7556     9.1009   14.9618     7.42815  9.58925    16.7704     2.9083      196.77      
1 1 1 18 8  70 o 2  35.9753 5.15378 32.0201     9.92248  18.6894     8.11832  22.1509    200.962     4.87862     200.962     
1 1 1 18 8  71 o 10 40.7267 5.2794  28.087      11.6715  36.0587     8.60297  17.9146    297.881     12.7026     117.881     
1 1 1 18 8  72 o 16 72.7886 3.46179 101.241     14.1033  93.1498     10.893   42.7624    153.777     4.91367     333.777     
1 1 1 18 8  73 o 17 31.6583 5.88209 17.3988     11.3741  22.2959     7.97233  18.6583    117.183     8.60039     117.183     
1 1 1 18 8  74 f 0  33.0577 6.34644 32.3865     11.7252  12.6546     11.1029  28.2743    122.841     0           0           
1 1 1 18 8  75 o 11 109.992 3.36328 208.095     17.9113  237.169     19.0771  77.9487    60.2513     19.6691     60.2513     
1 1 1 18 8  76 o 17 56.3819 5.02478 55.2945     14.1906  68.2979     13.2251  43.5951    126.797     21.6191     126.797     
1 1 1 18 8  77 o 13 30.8006 6.92783 19.9151     11.105   19.862      13.0258  12.0948    300.644     7.36435     120.644     
1 1 1 18 8  78 o 16 20.209  5.76136 -9.22168    8.90821  13.4878     11.0947  2.99437    96.9593     8.2533      276.959     
1 1 1 18 8  79 o 18 40.2633 6.35601 39.1036     11.9376  28.3023     13.1824  11.6553    219.344     23.6336     39.3435     
1 1 1 18 8  80 o 13 33.4875 6.66788 18.6246     10.605   29.5615     12.8938  15.1227    55.1371     6.53987     235.137     
1 1 1 18 8  81 o 6  19.4216 5.96203 -5.54005    9.20704  7.83269     12.5175  3.56965    55.9495     6.81217     235.949     
1 1 1 18 8  82 o 16 43.917  7.9431  54.246      17.9186  36.3756     17.7083  31.2301    78.349      16.4694     78.349      
1 1 1 18 8  83 o 9  23.0021 6.82709 3.10504     12.7225  11.1496     14.0191  5.09082    219.693     3.34816     39.693      
1 1 1 18 8  84 o 4  20.0569 6.42514 -6.70721    13.2769  4.12748     14.6907  0.820735   54.0326     2.4579      234.033     
1 1 1 18 8  85 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 9  0  o 10 302.05  3.26095 1618.18     49.335   1618.18     49.335   137.607    180         167.253     360         
1 1 1 18 9  1  o 11 442.207 4.22946 3432.37     89.783   3505.48     97.5852  350.441    39.2072     62.039      39.2072     
1 1 1 18 9  2  o 3  142.355 2.35285 365.818     15.7234  352.841     17.7306  52.3839    268.763     84.0094     88.7627     
1 1 1 18 9  3  o 17 253.953 2.96935 1141.4      36.1793  1145.3      39.3394  165.806    118.583     26.8379     298.583     
1 1 1 18 9  4  o 18 233.775 2.8937  969.578     31.6254  968.12      36.0297  132.195    306.558     64.7384     126.558     
1 1 1 18 9  5  o 15 216.66  2.85662 822.71      29.6192  841.699     32.3806  188.693    50.421      86.1416     50.421      
1 1 1 18 9  6  o 16 656.165 6.15465 7610.88     193.023  7686.21     211.411  461.63     133.63      31.8122     313.63      
1 1 1 18 9  7  o 1  71.373  2.73332 97.0578     9.26603  84.3083     10.0966  0.689245   161.168     32.404      341.168     
1 1 1 18 9  8  o 2  308.328 3.75386 1680.98     53.2525  1691.18     62.417   145.06     261.605     152.183     81.6054     
1 1 1 18 9  9  o 2  307.802 3.85578 1690.04     56.0753  1670.9      62.6555  213.717    277.213     11.1308     97.213      
1 1 1 18 9  10 o 2  232.348 3.12311 957.795     34.5077  956.619     38.13    180.863    96.8953     40.6672     96.8953     
1 1 1 18 9  11 f 0  184.173 2.86478 603.296     25.1003  599.431     27.7085  86.4896    254.408     0           0           
1 1 1 18 9  12 o 4  538.941 5.42403 5096.98     139.044  5219.59     153.735  427.509    28.9011     75.7757     28.9011     
1 1 1 18 9  13 f 0  161.875 2.83296 469.459     21.048   460.036     24.7042  101.099    185.999     0           0           
1 1 1 18 9  14 o 6  375.617 4.03572 2418.82     70.4808  2588.88     81.3665  274.12     217.994     10.3738     217.994     
1 1 1 18 9  15 o 5  367.441 3.68756 2417.67     64.9824  2372.19     70.6455  305.682    125.958     87.765      125.958     
1 1 1 18 9  16 o 15 28.3359 4.36583 20.1717     5.54794  9.53856     6.65906  43.7174    93.151      96.4304     93.151      
1 1 1 18 9  17 o 7  331.851 3.53587 1946.97     60.0213  1959.72     57.5501  239.418    158.008     7.0651      158.008     
1 1 1 18 9  18 f 0  65.0158 2.6198  75.3133     7.84013  75.0549     9.1088   142.301    165.185     0           0           
1 1 1 18 9  19 o 1  283.751 3.10592 1423.02     42.2864  1432.64     45.9803  146.55     170.472     109.79      350.472     
1 1 1 18 9  20 o 5  178.981 2.60546 565.115     22.3541  570.783     24.3519  138.397    312.941     39.4158     312.941     
1 1 1 18 9  21 o 13 78.8487 2.52703 106.943     9.90995  114.012     10.0039  25.9894    123.431     148.566     123.431     
1 1 1 18 9  22 o 16 215.429 2.79974 819.254     28.1027  826.6       32.2262  152.203    105.897     5.60503     105.897     
1 1 1 18 9  23 o 11 377.56  4.04157 2523.79     76.4402  2536.04     76.5017  222.673    333.111     94.4112     153.111     
1 1 1 18 9  24 o 5  216.431 2.90426 831.411     30.7148  829.958     32.2652  147.192    203.595     7.65207     23.5952     
1 1 1 18 9  25 o 16 112.939 2.54448 225.743     14.3485  227.031     14.4176  43.1291    351.67      62.7465     171.67      
1 1 1 18 9  26 o 13 379.036 3.95636 2523.76     75.1278  2576.39     75.1695  312.271    13.0903     85.4929     13.0903     
1 1 1 18 9  27 o 2  166.117 2.70075 497.572     22.999   481.179     21.9682  76.1945    40.7234     77.2435     220.723     
1 1 1 18 9  28 o 16 73.1475 2.71978 96.2067     9.9517   94.0924     9.91756  24.2434    47.6249     16.7789     227.625     
1 1 1 18 9  29 o 18 445.317 4.41938 3513.04     98.6108  3531.06     98.6404  358.642    88.5458     84.8585     88.5458     
1 1 1 18 9  30 o 12 272.866 3.02051 1306.31     41.2445  1335.27     41.3605  173.954    333.974     35.5369     153.974     
1 1 1 18 9  31 o 6  171.352 2.55628 515.867     22.3092  525.509     21.5789  142.712    16.0366     57.2849     16.0366     
1 1 1 18 9  32 o 13 57.9635 3.03224 55.9778     8.57031  64.0133     8.90951  9.00036    314.267     76.8497     314.267     
1 1 1 18 9  33 o 7  249.135 2.94504 1102.33     35.8904  1099.8      37.6258  243.943    295.832     147.792     295.832     
1 1 1 18 9  34 o 7  95.2677 2.46694 162.112     11.6378  160.218     11.8751  52.8332    24.5328     21.9239     24.5328     
1 1 1 18 9  35 o 9  423.182 4.13206 3197.24     83.8504  3164.86     91.2144  331.045    37.8516     67.7661     37.8516     
1 1 1 18 9  36 o 17 110.256 2.42405 215.115     13.4871  216.465     13.2663  53.3865    217.163     33.432      37.1629     
1 1 1 18 9  37 o 17 385.14  3.64843 2615.6      70.3619  2651.74     70.4726  291.507    178.077     44.8774     178.077     
1 1 1 18 9  38 o 9  258.412 2.83297 1174        36.605   1195.42     36.7688  166.357    16.7417     24.6551     196.742     
1 1 1 18 9  39 o 3  117.561 2.46476 248.032     14.4741  242.664     14.534   76.4937    197.674     5.15377     197.674     
1 1 1 18 9  40 o 5  306.291 3.33059 1589.3      49.8242  1743.42     52.4267  231.075    98.7857     38.715      98.7857     
1 1 1 18 9  41 o 3  194.311 2.67454 660.541     25.9005  679.292     26.1869  141.214    79.2639     19.5993     79.2639     
1 1 1 18 9  42 f 0  121.535 2.61309 266.164     15.6759  258.494     16.1059  61.1161    94.5015     0           0           
1 1 1 18 9  43 o 11 135.53  2.59109 315.107     17.7156  337.435     17.4222  125.284    267.449     85.6497     267.449     
1 1 1 18 9  44 o 13 233.614 2.92413 930.379     34.7715  1008.35     33.5971  133.814    48.3241     52.5987     228.324     
1 1 1 18 9  45 o 14 57.3529 3.33118 58.4847     9.10671  59.1976     9.86145  20.3353    43.2641     0.0818699   223.264     
1 1 1 18 9  46 o 13 58.505  3.42822 52.7782     9.65427  70.3926     10.1665  19.2609    78.1718     4.21412     78.1718     
1 1 1 18 9  47 o 4  86.8522 2.81366 124.499     11.5939  144.417     12.8444  42.3395    279.218     25.4985     99.2179     
1 1 1 18 9  48 o 2  208.369 2.95843 778.251     29.736   765.081     31.9868  163.075    156.202     44.7646     156.202     
1 1 1 18 9  49 o 17 76.3715 2.99806 110.236     11.3904  97.9807     11.4342  52.2915    194.582     18.6133     194.582     
1 1 1 18 9  50 o 3  251.596 3.0032  1124.35     37.653   1127.46     38.0784  172.719    244.051     4.61191     244.051     
1 1 1 18 9  51 o 7  111.281 2.5276  213.482     14.2279  227.23      13.9042  56.6731    300.554     32.8073     120.554     
1 1 1 18 9  52 o 7  123.895 2.37535 285.555     14.8121  260.692     14.6413  92.337     199.916     22.897      199.916     
1 1 1 18 9  53 o 15 48.5564 3.41977 40.4871     8.18184  44.5        8.22564  15.6567    321.066     20.0684     141.066     
1 1 1 18 9  54 o 3  71.1418 2.76805 90.0894     9.82425  90.6941     9.83699  36.6667    216.395     13.7857     36.3949     
1 1 1 18 9  55 o 10 88.6005 2.67532 144.993     12.317   135.189     11.3892  38.5684    125.531     36.492      305.531     
1 1 1 18 9  56 o 5  105.81  2.65429 204.436     13.7661  194.983     14.3135  71.6519    288.629     6.92425     288.629     
1 1 1 18 9  57 o 14 59.107  3.19376 71.6335     9.71938  54.5137     9.00317  33.6677    186.083     3.45153     6.083       
1 1 1 18 9  58 o 8  122.053 2.4355  256.614     14.8568  274.701     14.8953  104.515    143.49      50.1004     143.49      
1 1 1 18 9  59 o 19 88.3011 2.64022 139.36      11.6298  139.363     11.684   47.2326    35.8864     20.2373     215.886     
1 1 1 18 9  60 o 19 111.791 2.62898 216.237     14.6618  230.616     14.7446  80.1825    81.8422     14.8542     81.8422     
1 1 1 18 9  61 o 13 53.7206 3.49691 47.326      9.01326  57.5503     9.57842  20.7656    177.837     25.6736     357.837     
1 1 1 18 9  62 o 1  101.668 2.54876 165.116     12.1244  205.933     13.8194  62.0708    46.2114     7.44763     226.212     
1 1 1 18 9  63 o 3  81.5815 2.85579 120.65      11.9661  118.546     11.3078  46.5221    161.559     11.3692     341.559     
1 1 1 18 9  64 o 6  82.9442 2.68561 132.339     11.4202  114.945     10.8383  70.2955    204.736     36.4486     204.736     
1 1 1 18 9  65 o 11 75.3774 2.77108 102.836     10.7643  101.527     10.0917  52.7798    325.995     10.6433     325.995     
1 1 1 18 9  66 o 3  49.0004 3.70491 52.6827     8.80622  36.0408     8.79774  33.0318    85.8722     8.07374     85.8722     
1 1 1 18 9  67 o 5  20.9491 5.14802 2.97592     6.7799   11.0626     7.05518  1.38435    185.004     2.16581     5.00375     
1 1 1 18 9  68 o 18 87.507  3.18338 143.144     15.1867  134.235     12.5825  60.8874    23.6173     11.1946     23.6173     
1 1 1 18 9  69 o 10 65.5453 3.74241 78.3356     13.6141  79.3205     10.4913  38.1642    126.704     5.58381     306.704     
1 1 1 18 9  70 o 13 80.4014 3.44514 131.938     14.5304  105.022     13.0915  59.3333    158.908     18.0414     158.908     
1 1 1 18 9  71 o 2  28.0363 5.97303 8.24451     10.9903  20.8065     8.66579  14.1204    234.717     2.76098     234.717     
1 1 1 18 9  72 o 19 66.0673 3.67356 86.6121     12.7427  75.0078     11.3998  41.4335    10.2051     1.16632     10.2052     
1 1 1 18 9  73 o 15 59.8467 4.38098 71.382      12.6243  64.1666     13.1867  45.4642    210.001     18.7057     210.001     
1 1 1 18 9  74 o 2  75.9685 3.76278 103.602     14.4592  111.085     13.9689  48.1457    301.396     2.62703     301.396     
1 1 1 18 9  75 o 13 31.8845 6.4469  21.1073     11.107   21.2098     10.5375  17.3635    206.968     5.03136     206.968     
1 1 1 18 9  76 o 9  29.2286 6.51017 21.4055     10.9686  13.7881     10.6069  11.6627    290.665     5.60402     110.665     
1 1 1 18 9  77 o 18 49.0783 5.94219 61.1077     13.9235  37.4943     13.8049  31.9644    240.526     7.213       240.526     
1 1 1 18 9  78 o 1  21.0109 6.33023 4.93782     11.2127  0.587337    12.3955  2.09518    309.589     15.8407     129.589     
1 1 1 18 9  79 f 0  23.0417 6.58041 -1.85716    11.776   14.1091     12.8131  13.1652    48.6049     0           0           
1 1 1 18 9  80 o 6  25.4353 6.81742 9.6101      10.221   14.8995     13.6323  6.47445    263.524     13.3359     83.5244     
1 1 1 18 9  81 o 19 20.6745 6.49792 3.45326     12.4921  -4.33333    14.9645  4.14869    13.9339     3.12129     193.934     
1 1 1 18 9  82 o 18 38.1813 7.24777 45.6151     15.4112  22.8032     13.9088  15.9314    7.65251     10.3365     187.653     
1 1 1 18 9  83 o 10 27.364  7.29367 20.9384     14.2167  11.8854     13.3405  8.33471    161.167     0.111909    161.167     
1 1 1 18 9  84 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 10 0  o 10 411.108 4.60192 2999.28     94.7569  2999.28     94.7569  262.004    180         78.9861     8.65166e-06 
1 1 1 18 10 1  o 15 331.311 4.08939 1943.66     69.8485  1951.19     65.8805  295.699    216.493     119.77      216.493     
1 1 1 18 10 2  o 9  191.42  3.22127 663.428     30.8978  636.211     30.8942  174.269    31.8144     111.67      31.8144     
1 1 1 18 10 3  o 2  186.395 3.31367 634.122     31.916   599.139     29.9469  66.1405    293.785     127.983     113.785     
1 1 1 18 10 4  o 5  172.629 3.21809 532.002     28.7338  525.638     26.8772  120.131    101.988     11.0904     101.988     
1 1 1 18 10 5  o 1  204.131 3.28257 744.253     33.5627  733.65      33.5961  128.992    270.151     24.7003     90.1507     
1 1 1 18 10 6  o 7  450.899 5.54623 3614.62     112.06   3607.98     137.281  358.152    326.089     64.0558     326.089     
1 1 1 18 10 7  o 9  273.453 3.4556  1325.98     46.0532  1326.42     48.6223  167.674    206.029     53.9675     26.0292     
1 1 1 18 10 8  o 10 339.397 3.80051 2047.84     67.7973  2038.99     61.337   191.306    80.6016     106.02      260.602     
1 1 1 18 10 9  o 3  282.985 3.52248 1439.98     48.6235  1400.89     51.2086  160.583    28.2168     82.8342     208.217     
1 1 1 18 10 10 o 14 163.146 2.55029 473.843     21.2899  469.883     20.4064  103.308    310.436     9.23321     130.436     
1 1 1 18 10 11 o 1  181.438 2.58083 584.465     22.5054  582.762     24.387   91.0214    23.5657     67.4547     203.566     
1 1 1 18 10 12 o 4  226.125 2.74937 915.01      30.5343  898.189     31.7526  137.017    69.4852     42.6394     249.485     
1 1 1 18 10 13 o 10 322.814 3.3212  1829.34     52.6663  1867.19     54.7882  197.635    198.135     67.1302     18.1354     
1 1 1 18 10 14 o 8  189.433 2.69491 617.096     25.0824  655.666     26.0877  146.157    105.037     37.5167     105.037     
1 1 1 18 10 15 o 3  169.195 2.4867  509.465     21.1158  505.546     21.0539  118.927    142.569     12.4121     142.569     
1 1 1 18 10 16 o 11 281.981 3.0434  1441.07     42.1326  1379.39     43.8129  136.127    313.093     130.66      133.093     
1 1 1 18 10 17 o 19 357.763 3.69989 2288.79     64.8769  2252.92     67.7371  304.907    24.8849     98.7942     24.8849     
1 1 1 18 10 18 o 4  147.042 2.61677 390.378     19.8101  376.629     18.7385  74.2125    79.9083     49.9101     259.908     
1 1 1 18 10 19 o 8  100.448 2.63076 179.412     12.9817  178.87      13.4533  53.9678    310.042     0.513375    310.042     
1 1 1 18 10 20 o 2  162.213 2.76988 461.357     22.5748  471.847     22.4552  124.009    318.812     30.6376     318.812     
1 1 1 18 10 21 o 9  164.695 2.82614 476.108     22.812   485.921     23.8368  110.187    292.414     5.04033     112.414     
1 1 1 18 10 22 o 14 31.6385 4.57116 17.7868     7.03203  19.0695     6.97263  33.6572    201.883     85.7259     201.883     
1 1 1 18 10 23 o 2  127.167 2.72938 294.413     17.0216  279.749     17.6935  82.3064    194.839     2.72218     14.8387     
1 1 1 18 10 24 o 16 143.064 2.71318 370.07      18.5401  356.417     20.253   72.6348    132.53      50.0739     312.53      
1 1 1 18 10 25 o 16 96.3815 2.51222 166.421     11.8485  163.462     12.3672  1.38742    135.175     130.969     135.175     
1 1 1 18 10 26 o 13 514.055 4.99124 4690.38     122.599  4702.45     134.309  416.532    163.299     97.2568     163.299     
1 1 1 18 10 27 o 10 87.479  2.61173 137.945     10.8424  133.965     11.9586  18.4133    196.473     73.0908     16.4729     
1 1 1 18 10 28 o 16 69.352  2.73845 83.6615     9.39874  87.4958     9.56001  18.9599    359.47      21.0082     179.47      
1 1 1 18 10 29 o 6  171.704 2.47058 511.105     20.7554  534.626     21.765   108.26     307.641     18.73       127.641     
1 1 1 18 10 30 o 15 230.632 2.65058 962.611     30.5863  924.303     30.6728  199.149    338.668     79.6567     338.668     
1 1 1 18 10 31 o 2  168.347 2.54062 494.809     22.1691  510.462     20.6443  105.053    312.006     19.5226     132.006     
1 1 1 18 10 32 o 5  69.1347 2.78728 75.8224     9.16575  94.8225     10.0553  19.1552    51.1865     16.3312     231.187     
1 1 1 18 10 33 o 1  122.791 2.48582 274.068     16.2352  261.234     14.3049  41.1558    44.9493     81.576      224.949     
1 1 1 18 10 34 o 19 120.416 2.43033 261.359     14.5395  253.385     14.7556  80.5499    141.271     9.17946     141.271     
1 1 1 18 10 35 o 8  131.641 2.39695 320.113     15.9625  294.997     15.6404  94.4352    248.725     19.8546     248.725     
1 1 1 18 10 36 o 17 235.106 2.73031 973.932     32.6827  987.196     31.6383  205.954    356.089     89.7272     356.089     
1 1 1 18 10 37 o 9  232.931 2.74456 971.797     32.5817  953.37      31.4927  146.641    246.348     29.0067     66.3478     
1 1 1 18 10 38 o 1  507.127 4.51694 4551.16     114.725  4595.45     114.863  422.352    226.364     133.881     226.364     
1 1 1 18 10 39 o 13 261.454 3.00168 1201.39     37.4783  1225.14     41.1286  200.623    83.0658     40.3037     83.0658     
1 1 1 18 10 40 o 5  102.192 2.48361 182.949     12.6529  188.033     12.747   50.7471    243.679     28.9026     63.6787     
1 1 1 18 10 41 o 15 132.383 2.48326 311.652     16.2493  310.662     16.6675  96.9411    244.563     20.6062     244.563     
1 1 1 18 10 42 o 14 134.369 2.43746 318.917     15.9819  322.222     16.8111  111.826    283.449     49.1304     283.449     
1 1 1 18 10 43 o 18 96.7362 2.62607 156.346     12.3779  176.65      13.0322  29.1863    183.328     69.1181     3.32833     
1 1 1 18 10 44 o 14 382.739 3.60796 2544.13     69.0773  2666.66     69.3053  297.86     273.063     66.4348     273.063     
1 1 1 18 10 45 o 17 33.2778 4.92953 14.0567     7.99904  27.565      8.01444  17.7414    298.169     65.3928     298.169     
1 1 1 18 10 46 o 18 67.3508 3.11727 79.9358     10.0697  82.0357     10.8513  39.4481    54.7887     11.5893     54.7887     
1 1 1 18 10 47 o 9  333.996 3.34066 1963.74     55.7777  2005.95     56.0516  281.701    235.27      105.797     235.27      
1 1 1 18 10 48 o 7  338.815 3.34193 1989.74     54.3464  2097.68     59.1366  256.99     323.627     50.3046     323.627     
1 1 1 18 10 49 o 3  305.082 3.20078 1629.75     46.8624  1684.13     50.9806  262.242    81.0975     109.055     81.0975     
1 1 1 18 10 50 o 14 233.573 2.8523  946.066     31.0593  995.493     35.6557  174.184    15.6502     31.9813     15.6502     
1 1 1 18 10 51 o 2  117.354 2.55235 241.281     14.6478  249.02      15.338   103.129    63.6662     55.8207     63.6662     
1 1 1 18 10 52 o 12 177.044 2.58879 563.211     22.175   552.203     23.7192  122.298    96.2394     7.44842     96.2394     
1 1 1 18 10 53 o 7  59.7937 3.1434  59.0639     9.01136  69.3859     9.6879   33.3398    318.649     16.5611     318.649     
1 1 1 18 10 54 o 2  86.019  2.66653 122.853     10.9422  141.556     11.9988  25.9494    39.6571     59.5828     219.657     
1 1 1 18 10 55 o 5  85.1727 2.72711 127.098     11.2983  132.038     11.9221  53.5575    343.266     1.43826     163.266     
1 1 1 18 10 56 o 18 53.5607 3.26247 44.7614     8.1816   59.0697     9.13687  13.1532    122.635     40.5416     302.635     
1 1 1 18 10 57 o 12 113.258 2.60164 233.603     14.8341  224.38      14.6582  79.2383    337.477     9.40413     337.477     
1 1 1 18 10 58 o 14 85.2683 2.69809 144.248     11.6633  116.599     11.2745  50.2207    292.476     10.456      112.476     
1 1 1 18 10 59 o 19 41.1975 3.92885 28.1681     7.74549  34.2305     8.02204  24.4053    341.884     12.9399     341.884     
1 1 1 18 10 60 o 16 101.949 2.55273 177.188     13.1993  194.813     12.7981  75.8407    28.7841     19.2963     28.7841     
1 1 1 18 10 61 o 18 69.6368 2.91584 80.0631     10.0999  94.6805     10.1026  56.648     83.1245     26.6386     83.1245     
1 1 1 18 10 62 o 18 91.3789 2.68457 139.861     12.0487  160.022     12.467   47.1483    225.91      24.0844     45.9097     
1 1 1 18 10 63 o 9  70.0466 2.99599 85.9874     11.01    90.9616     9.84695  38.4748    336.465     12.2305     156.465     
1 1 1 18 10 64 o 1  72.2298 3.18872 91.6256     11.9876  97.0562     10.9113  43.0384    256.665     5.64602     76.6647     
1 1 1 18 10 65 o 4  76.1904 3.20132 103.874     12.2625  106.139     12.0697  59.3941    223.124     23.0435     223.124     
1 1 1 18 10 66 o 6  132.88  2.60216 320.597     17.4136  313.307     17.2095  91.711     268.408     12.142      268.408     
1 1 1 18 10 67 o 14 49.5217 4.63144 45.7732     11.7998  46.1062     10.5703  31.7583    217.255     3.49967     217.255     
1 1 1 18 10 68 o 12 39.8165 4.90667 30.9499     10.2022  29.5823     8.63534  17.2858    214.142     13.4186     34.1423     
1 1 1 18 10 69 o 19 65.5982 3.68571 89.1705     12.6444  69.7171     11.3707  48.8539    8.53129     16.2165     8.53129     
1 1 1 18 10 70 o 19 40.779  5.24556 32.7754     11.3499  31.9272     9.23111  26.4577    332.687     5.32604     332.687     
1 1 1 18 10 71 o 6  19.8987 5.70638 5.63088     9.78909  3.23709     7.91271  3.73483    210.141     2.83819     30.1409     
1 1 1 18 10 72 o 7  47.687  4.81342 43.2561     12.1434  44.3582     10.0217  26.8154    264.146     3.9158      84.1461     
1 1 1 18 10 73 o 2  33.0685 6.16279 30.2003     10.9333  15.0866     10.4744  10.2498    355.164     17.6035     175.164     
1 1 1 18 10 74 o 12 37.7516 6.37279 22.8442     12.4476  36.6191     11.7186  23.6657    165.092     6.5887      165.092     
1 1 1 18 10 75 f 0  69.6307 4.10024 95.2077     13.8032  87.7005     14.4831  29.9312    52.9084     0           0           
1 1 1 18 10 76 o 13 39.2349 7.21049 30.8997     16.3219  35.5214     12.6523  16.5155    83.9595     11.9996     263.96      
1 1 1 18 10 77 o 5  37.924  7.20065 25.1262     13.8341  37.4127     14.4442  23.6444    60.1599     6.01334     60.1599     
1 1 1 18 10 78 o 12 36.5118 7.08837 23.1716     13.7572  34.7352     13.4358  24.5208    185.981     11.4631     185.981     
1 1 1 18 10 79 o 1  19.7777 6.14931 -4.40334    12.2131  4.02009     11.7277  4.21003    77.2609     5.23107     257.261     
1 1 1 18 10 80 o 14 27.5572 7.11024 13.9271     12.5869  17.7235     12.9927  4.15213    138.319     21.7127     318.319     
1 1 1 18 10 81 o 2  39.5556 7.33131 37.4048     14.6324  35.0872     14.7983  22.9393    195.921     3.25124     195.921     
1 1 1 18 10 82 o 15 25.8772 7.31244 7.69243     15.6413  17.5476     13.8632  6.62225    233.005     0.726626    53.0048     
1 1 1 18 10 83 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 10 84 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 11 0  o 7  166.017 2.90322 489.421     24.1209  489.421     24.1209  102.462    180         38.5737     2.23112e-05 
1 1 1 18 11 1  o 5  132.697 2.78715 309.866     18.4827  315.112     18.5448  69.1573    178.433     30.9243     358.433     
1 1 1 18 11 2  o 8  77.9979 2.87406 110.783     11.8585  105.576     10.5188  11.4151    163.457     108.764     163.457     
1 1 1 18 11 3  o 10 373.526 4.19173 2471.81     76.3763  2480.22     80.5054  375.047    35.723      216.608     35.723      
1 1 1 18 11 4  o 5  116.855 2.69614 243.781     16.1949  240.943     15.3332  46.4383    325.442     53.0095     145.442     
1 1 1 18 11 5  o 6  322.854 3.70657 1846.38     59.9823  1851.96     59.9589  233.388    23.6147     2.9547      23.6147     
1 1 1 18 11 6  o 19 416.36  4.22731 3076.27     88.196   3076.93     88.2138  343.585    240.546     85.0449     240.546     
1 1 1 18 11 7  o 19 164.751 2.6157  489.601     21.5774  472.929     21.6095  122.253    269.151     27.6616     269.151     
1 1 1 18 11 8  o 5  287.908 3.34053 1474.07     49.3205  1466.36     47.0546  262.602    268.665     118.371     268.665     
1 1 1 18 11 9  o 3  95.2372 2.63646 171.863     12.2383  150.603     12.7934  34.4255    300.285     34.0746     120.285     
1 1 1 18 11 10 o 15 209.326 2.97558 790.177     31.171   763.97      31.2497  112.067    177.064     71.0609     357.064     
1 1 1 18 11 11 o 3  167.215 2.66166 509.392     21.2079  482.3       23.283   130.661    132.287     39.4859     132.287     
1 1 1 18 11 12 o 3  207.922 2.87881 770.682     30.6918  762.539     29.2921  108.821    205.488     76.0086     25.4876     
1 1 1 18 11 13 o 5  172.279 2.78934 541.476     24.0769  511.3       24.0724  120.679    353.89      6.07119     353.89      
1 1 1 18 11 14 o 6  226.252 3.32041 922.77      36.4936  893.363     38.726   163.832    205.425     8.63239     205.425     
1 1 1 18 11 15 o 8  307.174 3.89188 1662.18     58.1209  1686.71     61.6711  248.057    183.073     56.5205     183.073     
1 1 1 18 11 16 o 10 157.764 2.89859 437.121     21.5924  446.004     24.1687  122.036    5.97085     32.1809     5.97085     
1 1 1 18 11 17 o 4  107.313 2.92836 207.687     14.243   201.408     17.0221  58.9483    50.6216     17.6907     230.622     
1 1 1 18 11 18 o 13 284.142 3.62263 1449.94     48.6575  1415.32     54.2833  224.937    280.514     43.8436     280.514     
1 1 1 18 11 19 o 13 281.735 3.59049 1388.07     47.8691  1428.95     53.4377  189.424    118.1       24.5553     298.1       
1 1 1 18 11 20 o 9  382.448 3.97191 2569.47     72.6087  2623.38     79.5498  320.787    158.349     91.9099     158.349     
1 1 1 18 11 21 o 5  219.374 2.90821 852.176     30.4747  854.907     33.4065  194.856    323.218     83.6595     323.218     
1 1 1 18 11 22 o 16 270.025 3.13295 1277.98     39.5704  1308.99     45.1007  196.342    358.517     8.5469      358.517     
1 1 1 18 11 23 o 16 337.269 3.69684 2015.75     56.5272  2022.01     67.9329  250.791    349.825     19.2424     349.825     
1 1 1 18 11 24 o 13 313.643 3.34883 1737.02     50.392   1753.96     54.8089  231.599    262.573     16.086      262.573     
1 1 1 18 11 25 o 7  186.135 2.58639 616.348     23.0805  612.476     25.1212  117.148    106.035     24.7766     286.035     
1 1 1 18 11 26 o 1  161.694 2.55044 480.483     19.7601  447.111     21.457   90.3296    41.7474     42.0434     221.747     
1 1 1 18 11 27 o 19 87.6167 2.66345 144.227     10.8134  128.795     12.351   18.171     180.672     74.192      0.671539    
1 1 1 18 11 28 o 3  126.363 2.4139  289.357     14.971   277.422     15.5503  73.6078    234.69      19.5549     54.6895     
1 1 1 18 11 29 o 19 278.727 3.04674 1394.11     41.6812  1362.71     43.3926  250.515    88.7893     110.539     88.7893     
1 1 1 18 11 30 o 3  71.0851 2.78226 102.241     9.96314  78.3729     9.68176  18.5282    189.954     36.5145     9.95448     
1 1 1 18 11 31 o 9  48.4769 3.50592 47.1799     7.56054  37.4166     8.88673  11.1198    45.3069     60.3984     45.3068     
1 1 1 18 11 32 o 7  278.873 3.09496 1361.94     43.2616  1398.22     43.2395  231.567    137.176     73.0937     137.176     
1 1 1 18 11 33 o 12 301.75  3.17112 1599.71     45.035   1632.19     50.7542  177.061    154.467     70.9167     334.467     
1 1 1 18 11 34 o 7  196.28  2.63042 689.342     25.2754  677.464     26.4475  113.215    332.427     45.1452     152.427     
1 1 1 18 11 35 o 5  203.541 2.61004 750.301     26.4911  719.674     26.7407  166.912    214.273     55.3641     214.273     
1 1 1 18 11 36 o 13 111.337 2.38087 215.738     12.8663  224.42      13.6713  62.3481    123.522     18.6011     303.522     
1 1 1 18 11 37 o 18 161.098 2.41055 469.502     18.9276  451.272     19.9547  108.786    33.6567     0.216494    213.655     
1 1 1 18 11 38 o 16 21.7701 5.24788 7.96518     6.54524  7.52374     7.19031  2.8574     210.001     6.60615     210.001     
1 1 1 18 11 39 o 11 143.704 2.37483 376.42      16.5702  356.419     17.5825  80.0257    42.1686     34.3549     222.169     
1 1 1 18 11 40 o 16 112.162 2.43981 205.402     13.0451  242.213     14.3569  45.0871    62.8506     59.5576     242.851     
1 1 1 18 11 41 o 2  95.4747 2.53533 166.309     11.7056  157.754     12.4729  47.7489    345.849     28.6738     165.849     
1 1 1 18 11 42 o 7  170.812 2.45726 500.373     20.4845  535.595     21.5891  128.052    139.712     23.5585     139.712     
1 1 1 18 11 43 o 5  148.933 2.44205 396.477     17.6716  391.005     18.7571  75.638     305.781     51.5317     125.781     
1 1 1 18 11 44 o 1  161.016 2.39504 461.387     18.7379  459.144     19.8939  110.412    56.2393     2.3365      56.2393     
1 1 1 18 11 45 o 8  136.865 2.46966 324.491     16.7835  341.335     17.0648  73.2249    335.386     38.3612     155.386     
1 1 1 18 11 46 o 7  369.487 3.43904 2395.51     63.5676  2465.69     63.7835  277.922    114.854     46.3853     114.854     
1 1 1 18 11 47 o 18 99.4188 2.50735 170.087     12.5897  181.686     12.3346  33.9189    355.465     64.1548     175.465     
1 1 1 18 11 48 o 5  191.449 2.38834 645.163     23.1794  657.347     22.6397  120.547    176.068     19.2607     356.068     
1 1 1 18 11 49 o 15 97.2805 2.60433 166.201     12.4554  170.879     12.8921  83.0536    206.172     44.8835     206.172     
1 1 1 18 11 50 o 7  75.1971 2.92708 97.2632     10.4724  104.819     11.5063  39.0778    97.1768     16.6075     277.177     
1 1 1 18 11 51 o 17 54.7407 3.41201 45.9553     8.72226  62.5005     9.76379  21.146     140.069     21.2092     320.069     
1 1 1 18 11 52 o 2  110.478 2.54503 205.845     13.2308  229.466     14.9225  81.0447    275.442     18.4125     275.442     
1 1 1 18 11 53 o 1  140.719 2.53684 351.832     17.1682  353.6       18.5696  101.109    209.153     15.4365     209.153     
1 1 1 18 11 54 o 14 223.333 2.77985 883.326     30.1844  895.597     32.0246  172.449    236.588     44.6964     236.588     
1 1 1 18 11 55 o 7  102.709 2.56239 181.89      12.5318  194.737     13.8059  71.1503    184.703     7.28909     184.703     
1 1 1 18 11 56 o 14 44.5394 3.82646 34.2533     7.92452  38.1141     8.81319  27.735     137         16.7619     137         
1 1 1 18 11 57 o 1  125.084 2.63007 261.084     15.2525  298.688     17.7012  80.0568    142.165     5.70517     322.165     
1 1 1 18 11 58 o 12 18.8224 5.14877 -3.93486    7.40761  9.06386     7.73882  4.62449    66.7095     22.4716     66.7095     
1 1 1 18 11 59 o 5  42.3049 4.52553 24.4248     8.81765  43.3202     9.34792  14.8369    157.637     21.8753     337.637     
1 1 1 18 11 60 o 8  26.3804 5.9618  10.6024     9.81935  14.5624     8.25682  5.40512    338.885     13.2819     158.884     
1 1 1 18 11 61 o 11 96.8075 2.74457 160.502     13.1355  176.088     13.4309  71.5569    262.01      17.6186     262.01      
1 1 1 18 11 62 o 17 125.864 2.59471 276.216     15.8778  291.789     16.8228  77.2596    72.6004     10.0807     252.6       
1 1 1 18 11 63 o 8  54.0348 3.6837  62.1757     9.67869  45.1959     9.7727   42.1385    238.544     19.6219     238.544     
1 1 1 18 11 64 o 13 73.1019 3.1658  109.406     10.8836  84.7209     11.8813  42.4549    116.921     8.36864     296.921     
1 1 1 18 11 65 o 10 69.8221 3.1684  98.4611     10.5414  78.7288     11.2923  41.7171    33.1729     5.24507     213.173     
1 1 1 18 11 66 o 14 51.1813 3.66958 43.0333     9.38082  53.4524     9.02572  37.1369    83.1888     12.0701     83.1888     
1 1 1 18 11 67 o 9  60.0335 3.82049 76.545      12.3101  56.9879     10.4418  48.623     267.09      23.2335     267.09      
1 1 1 18 11 68 o 14 29.1714 5.81575 13.9371     10.0648  19.2121     8.05972  1.12935    274.195     37.068      274.195     
1 1 1 18 11 69 o 12 39.4439 5.44455 36.9835     11.1759  24.7226     9.61882  29.8266    91.1336     17.0093     91.1336     
1 1 1 18 11 70 o 16 95.6641 3.37852 177.128     15.6196  158.889     16.559   66.6113    93.6759     12.0912     93.6759     
1 1 1 18 11 71 o 17 53.4703 4.62    55.9133     11.9723  53.4269     12.2548  37.1774    147.519     9.40314     147.519     
1 1 1 18 11 72 o 1  39.0322 6.05783 38.2966     12.9038  24.685      10.2624  27.8669    356.644     14.178      356.644     
1 1 1 18 11 73 o 13 16.1612 5.18654 -20.4421    10.0051  3.12279     9.93921  1.41137    331.854     13.3444     331.854     
1 1 1 18 11 74 o 7  35.3501 6.66997 30.9174     11.9292  22.0891     12.4413  14.3073    291.962     11.219      111.962     
1 1 1 18 11 75 o 18 49.2504 5.75302 47.0303     13.9143  50.6229     13.4553  33.0471    239.933     8.48082     239.933     
1 1 1 18 11 76 o 10 17.3813 5.58784 -2.91341    10.7002  -4.95557    10.5879  0.998666   217.443     17.1059     217.443     
1 1 1 18 11 77 o 14 24.077  6.78633 8.17759     12.2211  9.80315     12.4171  9.28797    169.756     0.599628    349.756     
1 1 1 18 11 78 o 15 17.3901 5.71716 -4.04277    12.4758  -10.1183    11.6102  1.86607    254.554     4.35623     74.5542     
1 1 1 18 11 79 o 2  19.3881 6.18869 2.40644     13.7254  -6.45118    11.8286  2.86421    57.7609     2.61636     237.761     
1 1 1 18 11 80 o 12 28.046  7.46421 25.3053     15.8888  8.94924     13.2683  8.28702    339.398     12.0912     159.398     
1 1 1 18 11 81 o 10 19.1606 6.17838 -16.2842    14.8714  4.61384     12.9931  1.13106    242.726     5.41598     62.7258     
1 1 1 18 11 82 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 11 83 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 12 0  o 8  275.802 3.36992 1349.74     46.5463  1349.74     46.5463  167.293    180         71.0621     8.65103e-06 
1 1 1 18 12 1  o 12 190.037 2.80289 644.533     27.3138  636.238     26.0657  136.797    163.959     8.88319     163.959     
1 1 1 18 12 2  o 18 84.3633 2.66777 123.013     11.4626  129.925     11.0141  29.7661    259.376     14.9912     79.3764     
1 1 1 18 12 3  o 14 219.225 3.09842 852.346     33.1173  852.357     34.9384  173.316    6.00208     37.9892     6.00208     
1 1 1 18 12 4  o 2  313.846 3.63669 1752.85     57.2045  1742.32     57.1918  206.762    58.9986     40.5609     238.999     
1 1 1 18 12 5  o 1  84.5966 2.86359 129.124     12.1206  125.286     12.0876  29.6797    105.324     28.2095     285.324     
1 1 1 18 12 6  o 17 396.312 4.50754 2844.15     94.4814  2733.82     84.4556  403.94     43.8495     236         43.8495     
1 1 1 18 12 7  o 16 154.445 2.85238 427.948     20.8845  418.384     23.1582  62.2551    272.327     91.0153     92.3266     
1 1 1 18 12 8  o 18 126.215 2.76698 282.177     17.5541  283.329     17.4062  86.7897    74.4464     12.1678     74.4464     
1 1 1 18 12 9  o 11 292.026 3.78193 1533.07     53.7123  1493.62     56.8874  254.579    50.5683     90.4408     50.5683     
1 1 1 18 12 10 o 7  105.061 2.86847 192.553     14.6968  199.544     15.452   44.5198    22.708      47.0652     202.708     
1 1 1 18 12 11 o 12 90.1005 2.99353 137.698     13.502   151.047     13.4298  47.4522    336.915     6.84473     336.915     
1 1 1 18 12 12 o 3  401.854 4.97055 2897.99     96.7073  2840.35     103.308  258.595    46.5615     67.1684     226.562     
1 1 1 18 12 13 o 3  130.551 2.94684 308.045     19.3374  297.167     19.1702  70.6456    237.681     37.0088     57.6807     
1 1 1 18 12 14 o 11 233.932 3.36276 999.363     38.2004  942.789     40.5178  158.943    356.18      16.645      176.18      
1 1 1 18 12 15 o 17 275.581 3.39864 1363.87     49.2484  1331.08     44.5597  191.234    338.378     13.7826     158.378     
1 1 1 18 12 16 o 18 59.051  2.85217 66.4712     8.5065   57.9388     8.25704  34.5341    60.7515     141.407     60.7515     
1 1 1 18 12 17 o 7  64.4345 2.74155 79.4787     8.91246  68.5164     8.68826  3.59614    130.479     81.3429     130.479     
1 1 1 18 12 18 o 1  156.738 2.6499  436.931     20.2241  434.379     21.3848  108.451    289.624     1.27115     289.623     
1 1 1 18 12 19 o 16 93.2524 2.65601 157.1       13.208   151.849     11.5339  22.3393    102.821     171.139     102.821     
1 1 1 18 12 20 o 10 332.062 3.58939 1974.1      59.7048  1939.89     59.7537  278.926    40.0609     81.6762     40.0609     
1 1 1 18 12 21 o 4  99.999  2.50164 185.762     12.7177  169.517     12.3116  33.6414    132.988     63.3493     312.988     
1 1 1 18 12 22 o 9  217.503 2.7142  837.217     28.9916  840.869     30.1687  121.565    88.8389     65.2529     268.839     
1 1 1 18 12 23 o 10 176.464 2.53338 536.894     21.9771  567.766     22.8327  126.203    221.82      8.26295     221.82      
1 1 1 18 12 24 o 14 460.042 4.25386 3727.65     96.1074  3791.45     100.024  341.566    222.196     21.3737     222.196     
1 1 1 18 12 25 o 13 166.924 2.54447 496.275     19.9602  492.032     22.5213  81.2895    219.479     69.8266     39.4787     
1 1 1 18 12 26 o 7  166.376 2.50402 489.043     19.5995  492.775     22.091   133.729    327.315     42.0416     327.315     
1 1 1 18 12 27 o 1  181.199 2.56462 578.444     21.8704  586.213     24.6414  104.47     347.84      43.3095     167.84      
1 1 1 18 12 28 o 8  52.239  3.10963 46.1175     7.49977  51.4857     8.63468  7.60098    225.676     61.1629     225.676     
1 1 1 18 12 29 o 13 289.354 3.26477 1473.95     46.2679  1498.04     48.4059  203.345    238.907     2.8712      58.9065     
1 1 1 18 12 30 o 9  396.616 3.98969 2797.12     73.9185  2791.55     84.3247  263.696    98.221      37.4474     278.221     
1 1 1 18 12 31 o 2  240.984 3.01884 1041        33.9857  1020.06     38.7235  153.902    58.2544     30.7161     238.254     
1 1 1 18 12 32 o 16 482.115 4.55848 4094.5      105.486  4171.67     114.672  386.063    308.009     86.7752     308.009     
1 1 1 18 12 33 f 0  144.741 2.48161 376.238     16.8358  367.243     19.0498  123.127    307.652     0           0           
1 1 1 18 12 34 o 8  231.57  2.81912 967.455     29.8226  935.751     35.2814  184.926    71.7678     48.0894     71.7678     
1 1 1 18 12 35 o 11 182.718 2.65507 612.202     23.7563  572.85      24.8013  134.974    265.024     19.3502     265.024     
1 1 1 18 12 36 o 3  273.589 3.09419 1315.45     40.6152  1342.43     44.1891  180.057    24.2178     23.3598     204.218     
1 1 1 18 12 37 o 19 106.357 2.69552 205.259     13.2513  196.813     15.3114  67.493     191.473     2.43594     11.4726     
1 1 1 18 12 38 f 0  245.336 2.99582 1056.05     33.6205  1081.64     39.8504  96.4964    243.802     0           0           
1 1 1 18 12 39 o 8  76.7298 2.88936 105.18      10.439   104.498     11.6617  46.9069    213.287     4.15828     213.287     
1 1 1 18 12 40 o 17 323.527 3.48273 1851.93     53.8795  1870.01     58.9614  243.425    163.935     34.7717     163.935     
1 1 1 18 12 41 o 6  50.2908 3.73074 52.1603     8.30792  39.3001     9.73733  10.2309    100.572     32.4625     280.572     
1 1 1 18 12 42 o 7  202.316 2.67375 728.054     25.1374  725.979     28.9399  179.174    286.486     81.2252     286.486     
1 1 1 18 12 43 o 3  316.3   3.34436 1807.36     49.5163  1752.79     56.1816  239.202    161.428     39.3011     161.428     
1 1 1 18 12 44 o 18 121.732 2.51581 270.992     14.9     256.02      15.7182  101.76     213.874     43.6434     213.874     
1 1 1 18 12 45 o 8  47.6646 3.61629 39.1698     8.15868  42.7564     8.85186  13.5264    161.156     1.97688     341.156     
1 1 1 18 12 46 o 14 71.5264 2.84556 93.3349     9.6909   89.2635     10.5809  46.986     320.277     29.9446     320.277     
1 1 1 18 12 47 o 9  151.499 2.67012 412.051     18.2522  404.705     22.0509  113.448    87.2488     22.3882     87.2488     
1 1 1 18 12 48 o 15 236.548 2.84208 1009.92     30.3995  982.459     36.6003  178.304    290.236     33.2375     290.236     
1 1 1 18 12 49 o 15 88.856  2.63592 146.997     11.0637  134.674     12.2561  39.0511    319.753     38.4412     139.753     
1 1 1 18 12 50 o 14 117.913 2.51977 246.859     14.4374  248.496     15.2975  79.6498    276.267     3.11135     276.267     
1 1 1 18 12 51 o 2  93.0733 2.90485 154.604     13.2458  154.927     13.7806  59.3058    273.096     1.95385     93.0963     
1 1 1 18 12 52 o 5  77.7507 2.94181 102.376     10.6613  114.122     12.1864  52.0941    115.818     5.64758     115.818     
1 1 1 18 12 53 o 5  59.5608 3.42478 64.3543     8.90699  63.4699     11.194   31.97      337.452     10.4224     157.452     
1 1 1 18 12 54 o 4  37.5197 4.92001 29.0992     8.02443  23.515      9.62238  15.3035    67.6845     11.7169     247.685     
1 1 1 18 12 55 o 2  158.37  2.7599  428.292     18.9853  468.456     24.6443  100.053    330.677     12.4933     150.677     
1 1 1 18 12 56 o 12 56.8282 3.68782 61.362      9.45123  55.866      11.1242  38.0148    141.608     5.07973     141.608     
1 1 1 18 12 57 o 9  37.9705 5.53413 31.9581     8.30607  22.706      11.8267  16.2279    177.107     11.4964     357.107     
1 1 1 18 12 58 o 16 23.4428 5.77776 10.5165     7.30896  7.40733     9.66689  1.93719    322.095     3.04452     142.095     
1 1 1 18 12 59 o 16 46.7244 4.39427 39.8621     8.76504  40.9724     11.1504  28.0517    340.971     0.403518    160.971     
1 1 1 18 12 60 o 19 60.2047 4.15059 55.7194     11.9822  78.2559     12.5133  32.0272    337.137     12.6664     157.137     
1 1 1 18 12 61 o 13 71.393  3.48118 87.4546     11.509   97.7478     13.2538  30.8801    60.5716     30.6507     240.572     
1 1 1 18 12 62 o 16 33.8434 5.30278 22.1712     7.97553  21.8303     9.53719  6.99379    229.822     26.2164     49.8218     
1 1 1 18 12 63 o 11 19.0018 5.3813  4.99104     6.81766  1.87446     8.96127  0.0240612  235.831     12.3993     235.832     
1 1 1 18 12 64 o 9  74.0889 3.12828 91.535      12.0342  107.597     10.8947  53.9816    225.23      13.5491     225.23      
1 1 1 18 12 65 o 1  37.4651 4.6421  25.3464     8.29327  27.9645     8.49996  14.5849    94.541      16.2272     274.541     
1 1 1 18 12 66 o 8  43.5161 4.5703  47.6016     9.85125  25.591      9.00313  19.1059    339.625     15.6497     159.625     
1 1 1 18 12 67 o 16 44.5278 4.53403 42.6722     9.95287  32.7947     9.59388  27.8188    125.057     1.45098     125.057     
1 1 1 18 12 68 o 19 18.1536 5.48827 5.61764     10.0692  -4.23895    7.92961  1.89779    169.789     10.7085     349.789     
1 1 1 18 12 69 o 1  29.7924 6.22619 20.4294     10.6704  15.7524     9.24321  16.3103    162.29      7.24304     162.29      
1 1 1 18 12 70 o 6  68.4662 4.05233 99.6305     14.7754  76.9779     12.788   51.0595    257.045     16.828      257.045     
1 1 1 18 12 71 o 1  30.5699 6.20836 17.9135     11.2033  20.377      9.03444  14.691     352.322     3.55364     172.322     
1 1 1 18 12 72 o 14 25.166  6.4526  15.0277     10.565   8.11628     10.7789  9.01945    115.407     3.42945     295.407     
1 1 1 18 12 73 o 16 24.3336 6.47325 12.1511     10.8805  8.76055     10.6355  7.1687     340.457     2.79243     160.457     
1 1 1 18 12 74 o 16 21.837  6.32096 6.26085     11.1754  5.41462     10.8338  5.20956    71.9714     6.22707     251.971     
1 1 1 18 12 75 o 6  41.7208 6.6688  42.865      14.3946  31.0538     12.9276  29.7594    13.2725     12.8705     13.2725     
1 1 1 18 12 76 o 9  33.4453 6.7954  10.7128     14.4163  35.3274     12.4838  13.475     180.874     11.2162     0.874263    
1 1 1 18 12 77 o 19 24.0012 6.94061 6.45634     14.2187  10.0701     12.4803  7.27026    340.452     9.13592     160.452     
1 1 1 18 12 78 o 9  26.2228 7.40423 11.7177     16.7291  13.3406     12.919   10.9766    54.894      0.929178    54.894      
1 1 1 18 12 79 o 9  22.8656 7.0368  -0.773625   18.2051  8.34465     12.9768  4.20398    296.536     12.3541     116.536     
1 1 1 18 12 80 o 13 43.6912 7.42304 51.9317     17.1261  38.8651     15.067   27.7642    88.1834     8.16728     88.1834     
1 1 1 18 12 81 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 12 82 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 13 0  o 16 136.108 2.97929 329.342     20.2774  329.342     20.2774  107.486    360         14.8575     360         
1 1 1 18 13 1  o 12 234.298 3.3895  957.82      38.6336  990.175     40.9592  194.499    76.8013     53.4734     76.8013     
1 1 1 18 13 2  o 6  191.915 3.15045 636.544     29.4376  670.339     31.1673  141.386    168.42      10.4818     168.42      
1 1 1 18 13 3  o 12 199.596 3.17089 693.842     30.796   719.652     32.6371  144.675    178.756     5.12877     178.756     
1 1 1 18 13 4  o 18 204.573 3.32159 741.301     34.0494  743.608     34.0563  153.769    293.482     16.1908     293.482     
1 1 1 18 13 5  o 4  291.121 4.02077 1498.33     56.6644  1510.64     60.6046  224        146.241     26.2917     146.241     
1 1 1 18 13 6  o 7  87.3807 3.04983 140.315     13.2872  131.284     13.3278  9.06493    36.2767     97.1047     216.277     
1 1 1 18 13 7  o 3  372.891 4.42383 2461.18     80.2053  2477.65     85.0751  247.271    229.994     49.4456     49.9937     
1 1 1 18 13 8  o 13 284.436 3.99763 1438.26     55.0809  1434.18     58.8185  172.843    243.787     66.9281     63.7874     
1 1 1 18 13 9  o 14 164.24  2.90805 477.366     23.8996  479.796     23.9523  100.086    35.2913     30.7845     215.291     
1 1 1 18 13 10 o 3  321.353 3.90606 1850.55     62.9046  1815.8      62.9003  299.964    164.631     136.129     164.631     
1 1 1 18 13 11 o 19 68.2282 2.83965 83.7894     9.90732  81.9089     9.42384  19.4342    136.524     12.8908     316.524     
1 1 1 18 13 12 o 5  427.274 4.50191 3236.01     96.4004  3249.79     96.3933  326.331    246.988     30.3492     246.988     
1 1 1 18 13 13 o 2  120.711 2.57464 264.49      14.4539  252.825     16.5358  98.219     155.893     54.6321     155.893     
1 1 1 18 13 14 o 1  149.054 2.683   389.135     18.5827  399.202     21.4117  125.007    247.35      50.5116     247.35      
1 1 1 18 13 15 o 7  257.748 3.21558 1155.92     38.5369  1201.67     44.4261  140.645    131.482     90.1602     311.482     
1 1 1 18 13 16 o 1  130.098 2.61326 310.153     16.6291  290.808     17.3664  90.7339    99.8593     8.30712     99.8593     
1 1 1 18 13 17 o 17 213.717 2.95845 839.512     29.2683  781.486     33.7523  141.18     69.1716     21.5756     249.172     
1 1 1 18 13 18 o 18 106.479 2.53228 206.43      12.5925  196.21      14.2891  17.6563    34.6047     182.366     34.6047     
1 1 1 18 13 19 o 4  402.106 4.34557 2869.13     83.0963  2875.75     91.8304  290.737    107.157     0.298178    287.155     
1 1 1 18 13 20 o 4  95.381  2.78295 184.257     12.0811  140.516     13.9529  25.042     34.7172     74.6898     214.717     
1 1 1 18 13 21 o 9  209.934 2.8414  791.523     28.4892  772.133     31.1987  161.204    41.2404     26.9463     41.2404     
1 1 1 18 13 22 o 18 289.665 3.26038 1510.49     46.2559  1467.69     48.3411  213.291    107.686     12.1723     107.686     
1 1 1 18 13 23 o 8  315.363 3.42435 1762.4      52.9073  1768.14     55.3075  234.107    62.429      16.4762     62.429      
1 1 1 18 13 24 o 12 83.3493 2.60062 128.958     10.4922  118.078     11.1253  39.1443    90.0993     13.7435     270.099     
1 1 1 18 13 25 o 17 123.415 2.5276  281.392     15.2285  259.565     15.947   63.9825    329.214     37.5313     149.214     
1 1 1 18 13 26 o 7  147.758 2.58505 404.336     18.6588  370.781     19.5309  118.15     26.068      39.6565     26.068      
1 1 1 18 13 27 o 17 198.345 2.75026 701.715     25.5184  694.118     29.0236  169.458    84.394      64.7515     84.394      
1 1 1 18 13 28 o 19 100.633 2.59277 188.053     12.7049  171.873     13.3451  64.3819    189.072     7.54022     189.072     
1 1 1 18 13 29 o 4  131.431 2.6799  314.828     16.8343  298.671     18.3486  81.1065    118.601     14.0708     298.601     
1 1 1 18 13 30 o 11 315.149 3.51594 1774.06     52.9854  1753.26     57.93    262.437    184.348     78.3478     184.349     
1 1 1 18 13 31 o 16 241.448 2.97403 1032.24     35.2492  1037        36.7105  194.103    236.419     49.6537     236.419     
1 1 1 18 13 32 o 1  151.28  2.51426 417.627     18.2755  394.763     19.748   66.8181    97.3712     75.2885     277.371     
1 1 1 18 13 33 o 12 46.696  3.99158 45.1184     8.18225  33.9394     9.62362  16.4903    152.918     81.0429     152.918     
1 1 1 18 13 34 o 15 205.993 2.76455 770.327     27.9297  736.09      29.0982  140.112    238.958     7.32738     58.9584     
1 1 1 18 13 35 o 7  402.852 4.01684 2886.3      74.0488  2886.88     87.5681  314.602    65.3925     58.8934     65.3925     
1 1 1 18 13 36 o 10 90.9695 2.66203 152.583     11.6758  141.797     12.4862  62.8921    203.713     13.1425     203.713     
1 1 1 18 13 37 o 5  64.0799 3.12464 69.4932     9.16248  77.1908     10.7808  23.2711    248.482     30.1829     68.4819     
1 1 1 18 13 38 f 0  205.574 2.70531 761.919     26.2004  738.943     29.3943  144.856    101.875     0           0           
1 1 1 18 13 39 o 13 44.7264 3.89946 39.2657     7.99954  33.1671     8.92313  8.3195     358.737     15.5202     178.737     
1 1 1 18 13 40 o 17 34.6966 4.82917 18.1318     7.51052  26.725      8.72012  9.60656    183.251     49.3294     183.251     
1 1 1 18 13 41 o 6  119.241 2.57318 253.682     14.4509  251.896     16.2081  60.0267    81.2084     41.805      261.208     
1 1 1 18 13 42 o 11 121.277 2.53584 255.274     14.5898  267.833     16.1903  111.836    95.3032     66.1673     95.3032     
1 1 1 18 13 43 o 3  121.874 2.5159  262.429     14.9829  265.853     15.7119  67.2677    244.437     30.5949     64.4371     
1 1 1 18 13 44 o 2  284.107 3.03655 1447.76     43.0788  1425.52     43.384   224.301    44.9168     54.8566     44.9168     
1 1 1 18 13 45 o 3  52.5973 3.26075 51.347      8.40302  48.0173     8.59597  17.6969    187.85      25.9717     7.84987     
1 1 1 18 13 46 o 4  103.474 2.51885 200.108     12.6312  181.398     13.38    38.7797    18.3443     61.6938     198.344     
1 1 1 18 13 47 o 6  76.5221 2.74709 111.928     10.254   97.3707     10.6713  23.0259    243.823     54.1555     63.8233     
1 1 1 18 13 48 o 3  61.549  2.99985 68.2663     8.94043  67.4581     9.44124  31.2349    125.29      11.8086     305.29      
1 1 1 18 13 49 o 8  93.5258 2.5438  157.983     11.6297  153.965     12.1567  61.3657    177.518     0.951874    177.518     
1 1 1 18 13 50 o 13 87.7658 2.63677 130.726     11.2836  144.425     11.858   51.4249    15.9669     12.0127     195.967     
1 1 1 18 13 51 o 8  154.869 2.48845 420.86      18.3447  433.704     20.259   122.187    97.9289     35.4592     97.9289     
1 1 1 18 13 52 o 18 60.5304 3.12359 67.2654     9.44877  64.4615     9.36925  48.7809    324.83      25.1024     324.83      
1 1 1 18 13 53 o 15 69.3142 3.37894 79.188      11.7357  94.1729     11.4981  35.9536    114.046     19.0506     294.046     
1 1 1 18 13 54 o 3  24.8224 5.75773 12.9092     8.21957  8.82052     8.47886  2.47705    189.616     3.20324     9.61605     
1 1 1 18 13 55 o 1  133.822 2.68949 309.795     17.7511  331.158     18.2846  78.6447    139.757     22.2984     319.757     
1 1 1 18 13 56 o 12 121.794 2.61664 253.601     15.1224  277.64      16.7896  91.1332    325.895     20.1012     325.895     
1 1 1 18 13 57 o 9  19.3225 5.40397 4.42995     6.78162  3.77473     8.75372  0.309412   305.175     8.46391     305.175     
1 1 1 18 13 58 f 0  113.358 2.75004 216.966     15.152   244.648     16.0453  60.4697    144.35      0           0           
1 1 1 18 13 59 o 13 68.3229 3.17131 78.0502     10.575   91.0025     10.9999  39.8484    321.637     8.68791     141.637     
1 1 1 18 13 60 o 6  56.6775 3.76082 45.8507     10.1926  73.2097     10.4677  31.8094    80.8949     8.38898     260.895     
1 1 1 18 13 61 o 2  65.2579 3.51414 92.0151     11.2471  64.222      11.2475  39.1996    249.928     5.28371     69.9281     
1 1 1 18 13 62 o 18 19.6676 5.5141  -2.26809    8.52121  8.62654     8.57381  3.65747    239.274     26.4513     239.274     
1 1 1 18 13 63 o 7  56.6889 3.96054 58.3253     9.59342  60.1393     12.4289  39.3397    248.086     7.50034     248.086     
1 1 1 18 13 64 o 12 68.8186 3.61664 66.9693     11.6006  109.008     12.8441  42.2437    222.748     3.84602     42.748      
1 1 1 18 13 65 o 12 49.7564 4.21353 38.8337     9.43903  54.406      11.1403  33.8338    259.833     5.96172     259.833     
1 1 1 18 13 66 o 3  45.0602 5.48154 34.139      10.8285  45.6111     13.0773  29.7751    105.438     4.68737     105.438     
1 1 1 18 13 67 o 6  33.0966 6.19062 18.3465     10.626   26.2762     10.4564  8.67147    318.035     22.5056     138.035     
1 1 1 18 13 68 o 19 30.4232 5.9694  14.1371     10.2366  23.1273     9.1512   12.8916    316.166     8.87554     136.166     
1 1 1 18 13 69 o 10 27.1469 6.08982 21.3885     10.3849  8.00513     9.01566  12.7059    46.1383     1.52021     226.138     
1 1 1 18 13 70 o 13 24.5633 6.14625 9.49841     10.1553  12.8685     8.95984  5.512      299.941     14.8757     119.941     
1 1 1 18 13 71 o 14 69.1252 4.19722 96.9076     14.8289  84.2381     13.9616  46.3725    223.341     6.73357     223.341     
1 1 1 18 13 72 o 4  20.9735 6.25902 0.0873455   11.9328  6.44723     10.9385  0.38992    67.5968     21.1216     67.5969     
1 1 1 18 13 73 o 15 17.1923 5.62083 -3.90946    12.2581  -8.13349    10.3846  0.00270875 321.31      12.3288     321.308     
1 1 1 18 13 74 o 17 31.8805 7.47688 31.0229     15.5663  13.0758     13.1439  15.3679    45.324      4.37168     225.324     
1 1 1 18 13 75 o 9  15.9853 5.39713 -8.44565    12.9965  -15.528     10.8501  0.965708   356.752     6.19581     176.752     
1 1 1 18 13 76 o 15 39.7901 7.10841 34.5109     14.3661  35.6904     13.9966  18.1863    334.961     10.299      154.961     
1 1 1 18 13 77 o 6  31.7892 7.74595 18.5347     14.2831  28.4944     15.8462  17.4974    132.183     3.23495     132.184     
1 1 1 18 13 78 o 10 29.8909 7.78706 20.7519     14.7959  21.1903     15.9509  13.8955    237.189     0.0189554   57.1934     
1 1 1 18 13 79 o 15 33.8403 8.03648 18.7092     15.9878  39.6741     17.4321  14.8554    162.128     5.53329     342.128     
1 1 1 18 13 80 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 13 81 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 14 0  o 7  165     2.9558  483.573     24.4056  483.573     24.4056  160.22     180         77.2762     180         
1 1 1 18 14 1  o 6  526.224 5.46898 4930.61     140.369  4920.18     147.969  443.39     235.06      114.599     235.06      
1 1 1 18 14 2  o 18 212.813 2.98962 801.257     31.871   805.488     31.8972  169.481    64.9413     35.1736     64.9412     
1 1 1 18 14 3  o 3  243.641 3.18119 1030.6      38.8116  1075.94     38.8596  170.684    35.8539     10.5076     215.854     
1 1 1 18 14 4  o 4  97.8524 2.71003 168.093     13.2327  172.068     13.2941  49.7939    324.15      28.8714     324.15      
1 1 1 18 14 5  o 14 450.722 4.83138 3582.04     106.211  3639.03     112.01   365.279    332.277     70.6733     332.277     
1 1 1 18 14 6  o 17 38.781  3.84988 24.3987     7.23468  30.1982     7.24447  29.097     36.8764     88.6858     36.8764     
1 1 1 18 14 7  o 11 138.33  2.62799 350.164     18.6322  329.19      17.7741  115.813    277.638     89.6135     277.638     
1 1 1 18 14 8  o 10 155.694 2.6163  427.288     19.4884  432.511     21.3087  122.164    112.814     30.1332     112.814     
1 1 1 18 14 9  o 18 154.318 2.60167 423.796     20.1094  420.865     20.1305  80.4495    336.769     56.2138     156.769     
1 1 1 18 14 10 o 5  269.298 3.27067 1267.67     43.0403  1306.14     45.2372  222.251    68.4049     56.5028     68.4048     
1 1 1 18 14 11 o 17 201.917 2.90138 704.595     29.3199  742.089     29.3845  145.049    354.22      2.81142     354.219     
1 1 1 18 14 12 o 1  185.582 2.86117 599.278     26.5489  622.676     26.6652  123.889    357.901     15.0638     177.901     
1 1 1 18 14 13 o 2  101.246 2.77005 179.932     14.3421  184.265     13.6975  10.6151    234.145     116.438     54.1455     
1 1 1 18 14 14 o 6  67.5708 2.94498 85.9079     10.041   76.8292     9.79505  17.8675    13.7458     11.1117     193.746     
1 1 1 18 14 15 o 12 423.57  4.47297 3136.27     94.9231  3240.41     94.9525  292.572    285.091     31.7241     105.091     
1 1 1 18 14 16 o 7  70.4512 2.99966 82.6777     11.1562  94.2688     9.74266  0.850173   340.628     87.9152     340.628     
1 1 1 18 14 17 o 12 202.96  2.76786 723.793     28.722   737.629     27.5577  30.0789    319.116     231.809     139.115     
1 1 1 18 14 18 o 6  174.421 2.64981 517.689     23.5866  561.983     22.6605  136.902    305.102     31.5354     305.102     
1 1 1 18 14 19 f 0  241.164 3.04055 1028.55     36.6964  1035.38     36.7982  122.165    350.097     0           0           
1 1 1 18 14 20 o 16 136.638 2.55068 316.538     18.0907  346.333     16.7029  63.3376    177.139     62.0793     357.139     
1 1 1 18 14 21 o 12 356.533 3.79315 2269.91     64.5942  2245        70.7746  218.101    247.87      79.0487     67.8699     
1 1 1 18 14 22 o 2  341.61  3.61102 2070.85     60.4354  2073.24     63.1731  254.637    313.425     17.4312     313.425     
1 1 1 18 14 23 o 14 155.292 2.57731 429.013     19.5799  426.489     20.5209  109.336    246.715     5.34427     246.716     
1 1 1 18 14 24 o 19 136.027 2.49583 318.586     16.5796  338.378     17.4225  54.7801    211.568     78.4944     31.5683     
1 1 1 18 14 25 o 17 166.813 2.65859 500.044     21.6824  487.261     22.7385  84.2991    220.631     65.1104     40.631      
1 1 1 18 14 26 o 7  73.4348 2.77328 87.6962     9.86208  104.575     10.4595  27.5004    307.822     24.9243     127.822     
1 1 1 18 14 27 o 7  246.043 2.99254 1073.16     36.0195  1075.57     37.7593  210.442    294.925     73.5735     294.925     
1 1 1 18 14 28 o 18 277.135 3.21126 1321.23     44.5424  1406.39     44.626   219.443    311.218     45.2166     311.218     
1 1 1 18 14 29 o 8  22.2944 5.66941 3.92429     7.00865  11.0563     9.33264  20.9226    56.6461     48.1972     56.6461     
1 1 1 18 14 30 o 2  110.258 2.60692 213.045     14.0929  218.86      14.6756  70.3206    325.493     3.65897     145.493     
1 1 1 18 14 31 o 2  311.117 3.37587 1706.07     52.6254  1732.65     52.6411  253.679    96.0294     65.4334     96.0294     
1 1 1 18 14 32 o 14 330.49  3.48222 1908.14     57.6677  1973.77     57.6665  266.87     357.022     64.0893     357.022     
1 1 1 18 14 33 o 5  55.6943 3.37091 60.1852     9.00489  51.0405     9.5207   13.8449    58.3958     30.8243     238.396     
1 1 1 18 14 34 f 0  62.8587 3.29416 70.493      10.6747  70.6943     9.91506  50.7608    319.966     0           0           
1 1 1 18 14 35 o 5  125.554 2.5042  277.176     15.7217  282.896     15.759   97.4431    242.9       25.3063     242.9       
1 1 1 18 14 36 o 19 79.0049 2.84889 108.819     10.9753  113.521     11.5104  41.7896    254.516     17.2908     74.5162     
1 1 1 18 14 37 o 7  165.688 2.6278  472.986     21.7854  502.323     21.8403  122.08     357.956     14.6535     357.956     
1 1 1 18 14 38 o 18 165.23  2.58953 493.069     21.4094  476.804     21.4694  143.283    303.538     59.6027     303.538     
1 1 1 18 14 39 o 7  54.5665 3.43038 53.4013     9.21072  53.4198     9.3544   2.77365    137.07      1.01541     137.07      
1 1 1 18 14 40 f 0  110.281 2.66973 225.238     14.8894  207.708     14.5691  81.5356    200.291     0           0           
1 1 1 18 14 41 o 7  171.227 2.58875 509.637     22.6651  532.628     21.7233  143.794    322.001     52.1905     322.001     
1 1 1 18 14 42 o 13 19.0858 5.13226 2.24532     6.98019  6.48492     6.80216  12.3355    9.88708     31.26       9.88708     
1 1 1 18 14 43 o 16 56.6787 3.44296 51.9104     9.68493  63.8021     9.58264  12.6204    218.956     99.1094     218.956     
1 1 1 18 14 44 o 16 118.156 2.50536 245.775     14.8456  251.261     14.7888  67.524     241.088     25.3131     61.088      
1 1 1 18 14 45 o 16 166.165 2.50164 485.291     20.8603  497.187     20.8     128.285    68.4383     29.2266     68.4383     
1 1 1 18 14 46 o 11 94.4275 2.57613 152.989     12.1199  165.052     12.2052  78.7246    94.7328     36.7369     94.7328     
1 1 1 18 14 47 o 3  73.8649 2.78845 88.6022     10.3227  106.854     10.1577  37.3752    359.085     20.1544     179.085     
1 1 1 18 14 48 o 10 43.891  3.72476 32.9904     7.98477  37.0555     8.05168  14.1143    248.472     20.006      68.4725     
1 1 1 18 14 49 o 13 48.4066 3.80027 35.1115     8.95753  50.6718     8.85343  3.38403    317.286     54.5053     137.286     
1 1 1 18 14 50 o 16 85.2107 2.90591 126.4       11.906   133.585     12.8398  67.1943    309.011     22.5654     309.011     
1 1 1 18 14 51 o 14 129.728 2.60712 304.789     16.4863  296.216     17.3514  96.5644    338.069     17.429      338.069     
1 1 1 18 14 52 o 12 119.944 2.6101  257.425     16.0666  256.737     15.2644  99.9805    153.645     38.7577     153.645     
1 1 1 18 14 53 f 0  94.0743 2.61453 151.567     12.0632  165.278     12.5395  70.1165    235.791     0           0           
1 1 1 18 14 54 o 4  82.1984 2.78173 118.758     11.4624  123.679     11.383   58.8224    253.634     9.21333     253.634     
1 1 1 18 14 55 o 1  78.3486 3.05381 101.705     12.0485  119.726     11.7466  53.9963    293.099     5.03181     293.099     
1 1 1 18 14 56 o 1  30.4561 5.39579 20.3256     8.1353   15.2932     8.39771  12.3516    311.926     1.41328     311.926     
1 1 1 18 14 57 o 9  39.7513 4.67123 31.0199     8.76987  28.3372     9.15592  22.6442    76.2566     1.46937     256.257     
1 1 1 18 14 58 o 5  38.1886 5.20558 23.015      8.66928  33.0815     10.5849  18.9209    153.937     7.42532     333.937     
1 1 1 18 14 59 o 3  108.066 2.86593 193.845     14.2595  227.192     16.7508  77.2744    158.876     11.8115     158.876     
1 1 1 18 14 60 o 7  69.3268 3.55105 87.9993     12.1783  87.1285     12.3273  40.1121    291.863     9.71256     111.863     
1 1 1 18 14 61 o 2  25.4216 5.86274 13.9857     7.92818  9.36867     9.6096   8.14334    345.891     0.636129    165.891     
1 1 1 18 14 62 o 12 20.9251 5.68331 5.40618     7.50376  6.97632     9.22758  0.0545346  283.309     21.3883     103.309     
1 1 1 18 14 63 o 1  34.7212 5.79908 25.6861     10.1626  22.0326     9.71215  19.0136    134.589     2.7463      314.589     
1 1 1 18 14 64 f 0  46.1845 4.9652  40.8453     11.1626  40.8852     11.0982  37.6556    37.6087     0           0           
1 1 1 18 14 65 o 5  37.0146 5.32917 22.9518     8.73134  31.2565     10.41    22.3236    130.565     0.648719    130.565     
1 1 1 18 14 66 o 7  37.5684 5.53648 38.716      10.2543  18.6111     10.0981  25.9028    359.172     8.4217      359.172     
1 1 1 18 14 67 o 10 47.9444 5.33143 38.787      12.9808  51.8664     11.1989  30.1495    81.7637     1.16237     81.7636     
1 1 1 18 14 68 o 14 24.8901 6.45152 5.93693     11.3612  15.3307     10.4614  7.51993    203.475     11.0537     23.4749     
1 1 1 18 14 69 f 0  27.0152 6.79146 17.0202     12.9341  11.9451     10.1654  20.5196    170.374     0           0           
1 1 1 18 14 70 o 2  25.5656 6.56887 16.0356     13.0576  9.52217     8.6561   8.81819    122.549     6.57542     302.549     
1 1 1 18 14 71 o 1  19.5365 6.159   -7.05954    12.9593  2.60195     11.9775  0.923355   194.939     1.25537     14.9387     
1 1 1 18 14 72 o 17 34.9955 6.62407 11.1987     12.8132  41.0898     13.4168  23.0261    155.581     11.9789     155.581     
1 1 1 18 14 73 f 0  19.2264 6.08125 3.17941     11.9744  -9.75832    12.8336  4.28577    65.3563     0           0           
1 1 1 18 14 74 o 13 48.7736 6.46059 32.9533     14.7568  69.6941     15.3404  35.1321    226.141     12.3786     226.141     
1 1 1 18 14 75 o 18 34.122  7.47734 25.8636     13.7738  27.2857     14.4337  18.4266    42.7076     1.12999     222.708     
1 1 1 18 14 76 o 11 26.5573 7.3176  11.4997     12.5834  17.1066     15.4452  11.446     222.023     0.533644    42.0231     
1 1 1 18 14 77 o 8  60.4217 5.52099 66.6037     16.0031  85.3124     16.4193  43.0295    260.448     13.9428     260.448     
1 1 1 18 14 78 f 0  23.4423 6.89304 9.28708     13.3925  9.14223     13.337   12.7684    111.031     0           0           
1 1 1 18 14 79 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 15 0  o 17 69.1467 2.8906  85.6504     9.93569  85.6504     9.93569  11.5002    1.6043e-05  70.7702     180         
1 1 1 18 15 1  o 14 503.471 4.92147 4489.78     124.17   4524.44     124.175  403.116    99.2136     66.3069     99.2136     
1 1 1 18 15 2  o 18 201.564 2.83833 715.142     28.6594  726.273     28.6807  161.986    227.372     37.0672     227.372     
1 1 1 18 15 3  o 17 78.2528 2.76364 110.02      10.8108  107.762     10.7954  12.7959    174.935     72.8143     354.935     
1 1 1 18 15 4  o 8  192.925 2.75578 666.058     26.6583  654.375     26.6278  164.021    244.798     55.6933     244.798     
1 1 1 18 15 5  o 16 234.955 3.05778 985.431     35.1292  973.502     36.847   168.937    109.375     1.14149     289.375     
1 1 1 18 15 6  o 6  80.9579 2.70635 123.771     10.9567  109.474     10.9119  17.2535    20.1834     67.8553     200.183     
1 1 1 18 15 7  o 19 144.9   2.62446 379.426     19.9111  365.675     18.1734  54.2038    210.404     96.4112     30.4042     
1 1 1 18 15 8  o 8  153.709 2.60849 420.204     20.0778  417.881     20.1083  120.696    262.114     29.7542     262.114     
1 1 1 18 15 9  f 0  87.2331 2.60191 135.174     11.5504  135.236     11.1438  78.0732    115.692     0           0           
1 1 1 18 15 10 o 7  274.377 3.31642 1331.91     46.6671  1340.3      44.5024  180.339    274.982     37.5416     94.9824     
1 1 1 18 15 11 o 13 392.686 4.03208 2745.04     79.3406  2732.98     79.3549  346.207    74.5779     119.946     74.5779     
1 1 1 18 15 12 o 15 339.089 3.75638 2020.83     65.3153  2062.69     62.2774  292.207    209.499     91.9377     209.499     
1 1 1 18 15 13 o 12 152.623 2.67959 420.131     20.9325  406.304     20.0587  109.48     26.145      7.68722     26.1449     
1 1 1 18 15 14 o 13 25.909  5.2656  10.5308     7.036    13.8967     7.41849  40.9952    7.84152     96.1789     7.84152     
1 1 1 18 15 15 o 7  477.69  4.92283 4019.83     111.827  4098.05     123.673  380.301    157.4       63.2303     157.401     
1 1 1 18 15 16 f 0  106.219 2.90362 192.32      16.1015  208.803     14.6351  62.907     238.349     0           0           
1 1 1 18 15 17 o 8  273.064 3.29438 1307.64     43.9791  1339.44     46.1784  208.509    93.3941     23.72       93.3941     
1 1 1 18 15 18 o 1  198.321 2.86054 681.588     27.7223  714.258     29.1415  151.835    114.688     23.2595     114.688     
1 1 1 18 15 19 o 14 22.8402 5.42387 10.2072     7.11719  6.88396     7.68938  18.3671    23.7643     41.9058     23.7643     
1 1 1 18 15 20 o 11 170.297 2.88773 507.825     23.9454  521.382     25.3396  141.867    49.0847     48.2917     49.0847     
1 1 1 18 15 21 o 3  208.574 2.97128 772.368     31.0749  771.6       31.04    93.6504    153.314     111.266     333.314     
1 1 1 18 15 22 o 15 21.0799 5.19159 3.11013     7.07393  10.0322     6.89593  70.5541    89.2662     156.003     89.2662     
1 1 1 18 15 23 o 5  215.731 2.73638 836.102     28.9504  815.443     30.1847  178.148    67.2705     51.3092     67.2705     
1 1 1 18 15 24 o 12 143.418 2.48598 366.363     17.4664  363.6       18.2417  80.1237    62.2079     38.6965     242.208     
1 1 1 18 15 25 o 18 123.892 2.47154 260.369     14.6103  284.914     16.0571  65.4711    98.4832     38.1388     278.483     
1 1 1 18 15 26 o 12 84.4516 2.60188 126.683     10.7031  126.881     11.2606  51.4024    130.292     11.6192     130.292     
1 1 1 18 15 27 o 2  174.647 2.58022 547.281     22.0877  535.161     23.0545  130.321    186.769     16.555      186.769     
1 1 1 18 15 28 o 13 182.113 2.73291 585.005     23.6914  592.261     26.1458  97.7467    74.126      61.99       254.126     
1 1 1 18 15 29 o 8  137.655 2.44228 337.816     16.4749  334.854     17.1948  111.225    294.616     35.389      294.616     
1 1 1 18 15 30 o 6  219.301 2.83169 871.837     29.7656  836.08      32.3563  175.564    207.262     40.9765     207.262     
1 1 1 18 15 31 o 5  88.3188 2.76362 144.151     11.8711  133.472     12.4855  67.9436    74.7542     30.3593     74.7542     
1 1 1 18 15 32 o 18 298.102 3.29361 1572.93     48.1288  1585.94     50.2633  263.292    124.332     102.579     124.332     
1 1 1 18 15 33 o 3  146.624 2.61149 393.824     18.4878  370.053     19.7931  81.7512    275.73      41.3985     95.7298     
1 1 1 18 15 34 o 15 63.9538 3.17442 72.4884     9.72161  73.6485     10.4874  18.4653    142.715     43.703      322.715     
1 1 1 18 15 35 o 10 65.5246 3.19167 78.8543     9.89724  74.5941     10.8748  15.0947    24.9419     54.0841     204.942     
1 1 1 18 15 36 o 2  45.8715 4.01545 42.8243     8.68408  33.6097     9.17255  10.7072    315.447     22.1661     135.447     
1 1 1 18 15 37 o 10 105.597 2.51874 191.394     12.9522  205.35      13.6709  89.1932    192.913     40.1182     192.913     
1 1 1 18 15 38 o 19 70.2429 2.92227 82.0251     9.8241   94.2975     10.6624  46.3353    101.702     27.3533     101.702     
1 1 1 18 15 39 o 8  162.861 2.6384  485.97      21.5054  457.29      21.5457  130.092    143.502     34.8513     143.502     
1 1 1 18 15 40 o 12 234.759 2.92166 991.146     33.6627  970.583     35.0507  208.287    138.392     88.753      138.392     
1 1 1 18 15 41 o 16 132.663 2.50287 307.835     16.3973  318.529     16.8536  106.154    240.468     31.3554     240.468     
1 1 1 18 15 42 o 18 110.876 2.59518 212.613     14.5878  225.404     14.1883  64.1887    252.885     22.4521     72.885      
1 1 1 18 15 43 o 8  96.7397 2.59947 174.698     12.6129  159.103     12.5285  66.0271    253.248     3.38123     253.248     
1 1 1 18 15 44 o 11 202.776 2.70474 729.158     28.1179  735.677     26.8313  138.348    343.105     4.3108      163.104     
1 1 1 18 15 45 o 13 127.898 2.59285 296.158     16.7134  287.039     16.4898  81.363     212.016     11.3979     32.0163     
1 1 1 18 15 46 o 1  163.059 2.64414 463.618     21.677   484.111     21.5254  126.275    140.712     29.0905     140.712     
1 1 1 18 15 47 o 18 24.6118 5.51666 10.329      7.70016  11.4324     7.57989  15.368     51.5971     55.5232     51.5971     
1 1 1 18 15 48 o 19 12.8281 4.22603 -7.78254    6.83889  -4.61492    6.4892   8.28494    333.15      20.3292     333.15      
1 1 1 18 15 49 o 2  41.8534 4.03934 30.3753     8.38411  33.882      8.06943  21.4903    236.653     7.68258     56.6535     
1 1 1 18 15 50 o 8  55.14   3.40681 49.6318     9.34286  60.5761     9.19673  32.5931    235.32      5.85045     55.3196     
1 1 1 18 15 51 o 2  41.0968 4.24024 27.1091     8.34819  35.517      8.48889  5.16301    8.77024     42.2037     188.77      
1 1 1 18 15 52 o 5  78.9066 2.86497 104.156     11.4461  119.696     11.0604  61.4887    322.96      18.8394     322.96      
1 1 1 18 15 53 o 17 112.838 2.53852 239.284     14.6364  216.773     14.0336  75.3365    44.4205     1.48332     224.42      
1 1 1 18 15 54 o 8  59.361  3.36722 65.2511     9.68707  62.5642     10.157   35.5307    140.333     5.97792     320.333     
1 1 1 18 15 55 o 10 49.6411 3.80916 44.684      8.83598  45.6449     9.79224  27.6467    114.928     7.74019     294.928     
1 1 1 18 15 56 o 3  66.9697 3.16591 76.2767     10.3881  86.1786     10.7272  41.2705    51.9859     5.05947     231.986     
1 1 1 18 15 57 o 13 17.4317 5.20557 2.40586     7.26007  -0.720378   8.48132  2.3841     174.823     16.3506     174.823     
1 1 1 18 15 58 o 2  21.5546 5.74815 -0.142106   7.69738  12.7368     10.0432  3.09738    108.819     5.69388     288.819     
1 1 1 18 15 59 o 12 35.0228 5.63183 23.1801     8.90631  24.5778     10.4174  13.373     349.832     15.3655     169.832     
1 1 1 18 15 60 o 6  79.7897 3.13599 121.872     12.1268  109.116     12.7736  57.9535    144.978     11.5814     144.978     
1 1 1 18 15 61 o 3  22.1062 5.62511 11.0724     7.59853  3.86726     9.00259  4.29867    187.69      34.1162     187.69      
1 1 1 18 15 62 o 16 95.0356 2.87028 164.473     13.344   162.607     13.9225  74.5607    76.7778     24.6893     76.7778     
1 1 1 18 15 63 o 9  66.628  3.5388  71.6039     11.5065  92.4528     11.8298  48.6179    50.7601     11.4505     50.7601     
1 1 1 18 15 64 o 15 24.8928 6.52897 8.32607     11.4322  12.8128     10.4711  4.4378     184.38      19.4595     4.38047     
1 1 1 18 15 65 o 7  33.3702 6.74155 25.0734     13.145   21.5786     10.5487  19.0985    338.937     0.0862819   338.937     
1 1 1 18 15 66 o 16 22.7103 6.56012 5.86751     12.5015  6.89772     11.1791  6.83543    154.414     7.76387     334.414     
1 1 1 18 15 67 o 19 43.0342 6.40613 33.3982     14.1049  43.5987     12.6387  26.4317    250.909     0.89317     250.909     
1 1 1 18 15 68 o 17 55.0249 5.29075 78.4273     13.7406  43.1418     13.5214  41.6517    330.19      15.8683     330.19      
1 1 1 18 15 69 o 8  26.6788 6.82639 16.2111     11.572   11.3806     12.0948  9.71021    45.7858     6.88067     225.786     
1 1 1 18 15 70 o 5  27.9552 6.85935 7.23779     11.7868  23.6909     12.8874  12.9828    24.4683     1.8989      24.4683     
1 1 1 18 15 71 f 0  34.5127 6.81378 29.843      12.1014  21.3039     12.7132  30.5281    350.441     0           0           
1 1 1 18 15 72 o 13 22.7327 6.56821 2.22667     11.7105  10.8285     12.3423  8.38995    110.417     1.20362     290.417     
1 1 1 18 15 73 o 13 15.9169 5.32309 -5.74547    11.0028  -15.6163    11.7787  0.267528   296.808     11.0821     116.808     
1 1 1 18 15 74 o 8  24.8136 6.6571  19.3709     12.1963  -0.215598   12.7978  10.4567    67.6046     2.43447     247.605     
1 1 1 18 15 75 o 19 20.7989 6.39909 0.394123    12.2118  5.47171     12.7907  4.62999    204.049     4.05238     24.0491     
1 1 1 18 15 76 o 12 19.9136 6.17317 9.28712     12.2138  -11.6955    13.2263  2.65392    343.621     5.11883     163.621     
1 1 1 18 15 77 o 8  23.2474 6.95246 8.30035     13.5054  8.70196     14.4051  4.28974    335.506     2.6798      155.506     
1 1 1 18 15 78 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 16 0  o 6  292.672 3.19917 1520.02     46.897   1520.02     46.897   301.056    360         168.917     360         
1 1 1 18 16 1  o 9  185.992 2.64904 608.364     24.6768  618.892     24.7046  140.147    274.657     15.6232     274.657     
1 1 1 18 16 2  o 2  188.762 2.65312 634.604     25.1181  629.474     25.077   90.3019    66.4679     91.5448     246.468     
1 1 1 18 16 3  o 10 194.276 2.68525 672.467     26.141   666.572     26.1455  166.057    352.257     56.7309     352.257     
1 1 1 18 16 4  o 16 247.25  2.93622 1080.15     36.382   1089.2      36.3812  188.252    89.1122     18.3964     89.1122     
1 1 1 18 16 5  o 17 114.04  2.61095 232.583     14.9568  229.265     14.847   32.703     0.275311    92.6132     180.275     
1 1 1 18 16 6  o 4  239.152 3.16197 1004.52     37.8802  1025.59     37.9091  213.03     112.749     82.4579     112.749     
1 1 1 18 16 7  o 15 186.58  2.92661 611.113     28.7402  624.264     25.8811  72.7815    97.4417     123.595     277.442     
1 1 1 18 16 8  o 16 311.598 3.55685 1706.27     54.2342  1741.64     56.8412  285.253    59.3328     117.86      59.3328     
1 1 1 18 16 9  o 13 237.363 2.99419 1002.27     35.6223  997.24      35.6109  192.555    255.661     43.2482     255.661     
1 1 1 18 16 10 o 9  173.05  2.79124 544.789     24.7804  517.956     23.6362  168.438    54.9545     101.292     54.9545     
1 1 1 18 16 11 o 8  318.383 3.49931 1781.88     55.8185  1817.75     55.8443  274.659    268.148     86.4426     268.148     
1 1 1 18 16 12 o 7  101.179 2.58638 184.739     12.8621  178.935     13.3094  35.1717    8.36818     65.7482     188.368     
1 1 1 18 16 13 o 11 324.004 3.42565 1866.95     55.6118  1860.6      55.6337  292.817    203.21      115.351     203.21      
1 1 1 18 16 14 o 13 285.418 3.2287  1463.5      47.1792  1428.61     45.1816  234.254    37.7799     55.2336     37.7799     
1 1 1 18 16 15 o 17 254.293 3.10994 1139.23     37.8094  1156.17     41.3978  187.72     16.2942     8.17596     16.2942     
1 1 1 18 16 16 o 2  313.223 3.48243 1753.36     57.0953  1730.8      52.1488  232.285    152.048     9.60423     152.048     
1 1 1 18 16 17 o 5  93.0887 2.71585 151.967     13.1095  156.052     12.1413  49.0682    88.0379     20.1356     268.038     
1 1 1 18 16 18 o 11 189.624 2.72623 635.115     26.4418  640.841     25.3552  136.777    315.825     4.19301     315.824     
1 1 1 18 16 19 o 11 41.954  4.22009 36.6987     8.34071  27.467      8.68513  15.7448    126.494     65.9282     126.494     
1 1 1 18 16 20 o 8  161.791 2.72155 456.823     21.4717  472.179     22.6603  138.962    263.056     54.5815     263.056     
1 1 1 18 16 21 o 7  231.322 3.28091 947.484     38.0107  952.838     38.057   133.577    311.178     65.6076     131.178     
1 1 1 18 16 22 o 15 181.911 3.12587 584.4       29.2162  591.019     27.7232  99.6178    81.3054     59.8147     261.305     
1 1 1 18 16 23 o 10 328.717 3.74492 1912.92     61.6777  1927.91     61.7049  283.779    332.848     93.3139     332.848     
1 1 1 18 16 24 o 15 167.56  2.9349  495.069     23.97    502.138     25.2891  167.198    27.472      106.198     27.472      
1 1 1 18 16 25 o 16 152.518 2.74273 418.794     20.332   407.341     21.5374  110.288    43.1206     7.41522     43.1206     
1 1 1 18 16 26 o 1  129.123 2.67781 291.483     17.3327  300.955     17.2811  103.559    244.446     31.2814     244.446     
1 1 1 18 16 27 f 0  171.427 2.89811 529.51      23.5368  514.581     26.1253  84.3816    178.878     0           0           
1 1 1 18 16 28 o 10 50.6741 3.53715 44.8274     8.37911  47.3828     9.34589  14.8355    334.192     16.4468     154.192     
1 1 1 18 16 29 o 18 85.8932 2.85893 129.449     11.3682  133.209     13.1331  66.7183    193.595     43.4585     193.595     
1 1 1 18 16 30 o 11 93.6874 2.69524 158.27      11.9838  154.007     13.2214  67.0276    265.062     10.9089     265.062     
1 1 1 18 16 31 o 4  42.0243 4.1984  31.2182     7.94629  32.9709     9.22337  9.58087    76.9864     66.9903     76.9864     
1 1 1 18 16 32 o 8  50.6366 3.67947 51.5703     8.62851  40.9972     9.51972  15.941     68.1101     21.4626     248.11      
1 1 1 18 16 33 o 9  209.161 2.80642 785.62      29.991   769.403     28.8406  163.389    125.421     30.8427     125.421     
1 1 1 18 16 34 o 16 146.721 2.57038 385.699     18.0164  379.48      19.711   119.792    168.213     36.1432     168.213     
1 1 1 18 16 35 o 3  113.656 2.48265 229.496     14.1543  229.934     14.0927  51.324     233.929     54.7756     53.9294     
1 1 1 18 16 36 o 6  87.2304 2.61927 132.099     11.3355  138.943     11.5107  43.0124    146.723     31.3502     326.723     
1 1 1 18 16 37 o 3  41.0806 4.07035 34.8316     8.06794  26.8791     8.10235  8.03917    11.7112     22.8397     191.711     
1 1 1 18 16 38 o 11 29.4393 5.06082 13.93       7.42219  18.4773     7.42664  4.76821    56.08       29.3749     56.08       
1 1 1 18 16 39 o 4  78.0433 2.72366 107.85      10.5357  109.465     10.7035  46.4397    229.926     9.52318     49.9256     
1 1 1 18 16 40 o 16 150.495 2.6908  386.593     19.9185  420.385     20.649   120.147    77.7555     32.2512     77.7555     
1 1 1 18 16 41 o 16 74.2083 3.11765 101.482     11.4292  95.7146     11.6391  26.1243    24.6803     46.4227     204.68      
1 1 1 18 16 42 o 17 53.6026 3.78229 45.5366     9.80125  58.7892     10.1456  21.7594    353.064     21.0154     173.064     
1 1 1 18 16 43 o 2  243.427 3.03786 1065.93     34.7978  1049.42     39.1526  179.367    136.954     18.9622     136.954     
1 1 1 18 16 44 o 14 73.6046 3.00686 97.4179     10.7935  96.6631     11.2864  56.0393    95.4323     18.9541     95.4323     
1 1 1 18 16 45 o 18 23.5255 5.30208 12.5024     7.19952  7.0101      7.15055  2.14265    279.405     15.1934     279.405     
1 1 1 18 16 46 o 8  56.2735 3.54871 54.292      9.87406  60.2426     9.9098   33.0148    346.715     6.14936     166.715     
1 1 1 18 16 47 o 5  38.522  4.43954 31.8167     8.04772  23.4328     8.33451  7.30261    103.767     34.0322     283.767     
1 1 1 18 16 48 o 13 28.1091 5.35386 17.1701     7.68977  12.6805     7.84145  8.0572     21.0332     9.51155     201.033     
1 1 1 18 16 49 o 14 32.5222 5.06424 18.9198     7.97096  21.1824     8.0949   8.52607    118.44      21.0471     298.44      
1 1 1 18 16 50 o 6  182.016 2.67554 611.419     23.8511  574.042     24.8952  133.752    29.1528     17.5475     29.1528     
1 1 1 18 16 51 o 14 49.4277 3.84861 46.7628     9.34441  42.6887     9.38483  17.732     191.859     28.9455     11.8589     
1 1 1 18 16 52 o 12 91.9891 2.81892 161.513     13.4106  142.851     12.5205  66.8557    200.98      10.1511     200.98      
1 1 1 18 16 53 o 15 71.9524 3.26105 99.9847     12.0189  87.5633     11.3694  51.7304    274.361     8.46986     274.361     
1 1 1 18 16 54 o 14 27.4296 5.36085 20.6286     8.18368  7.95737     7.86243  6.20842    280.72      17.7338     100.72      
1 1 1 18 16 55 o 12 81.855  2.96766 123.582     12.4762  118.186     11.7907  54.0115    219.481     0.872266    39.4808     
1 1 1 18 16 56 o 7  31.3181 5.20207 20.4354     8.21152  17.4346     7.85298  3.59561    174.406     30.9903     354.406     
1 1 1 18 16 57 o 15 83.3964 2.83722 117.897     12.0033  133.165     11.5752  55.9385    147.644     1.35277     147.644     
1 1 1 18 16 58 o 7  76.1566 3.09999 107.544     12.3949  102.691     11.1569  66.9025    179.111     34.702      179.111     
1 1 1 18 16 59 o 12 55.6569 4.41013 61.5402     11.5863  54.2463     12.4473  28.1153    186.512     16.1321     6.51166     
1 1 1 18 16 60 o 13 26.7838 6.15489 19.811      9.78415  5.76465     10.5784  12.232     75.9566     3.70955     255.957     
1 1 1 18 16 61 o 13 63.2172 4.05062 73.5502     12.297   75.2104     13.0834  39.7961    218.289     2.61885     38.289      
1 1 1 18 16 62 o 10 71.5303 4.01587 105.336     13.4187  85.7584     14.7842  53.7156    254.331     14.5226     254.331     
1 1 1 18 16 63 o 15 19.2978 5.7871  5.17189     8.49436  -3.79399    11.8001  4.21125    346.881     4.93631     166.881     
1 1 1 18 16 64 o 1  21.9024 6.35251 6.04904     10.4938  4.97159     11.8277  5.22611    236.975     0.26153     56.9754     
1 1 1 18 16 65 o 9  26.1437 6.2628  -2.47428    12.4057  22.7386     10.8573  12.3546    197.148     0.89782     197.148     
1 1 1 18 16 66 o 19 19.6921 5.97583 3.98693     10.5523  -0.497181   10.7348  0.464286   191.32      20.806      191.32      
1 1 1 18 16 67 o 9  34.6047 6.37154 33.8041     11.3479  16.7539     11.9624  17.0268    58.9087     6.02218     238.909     
1 1 1 18 16 68 o 8  30.4586 6.31567 7.22892     10.9519  31.0096     11.8075  16.2581    193.801     2.92472     193.801     
1 1 1 18 16 69 o 17 18.3573 5.8017  -3.20538    10.4972  -0.123669   11.3346  2.16176    281.972     8.28935     101.972     
1 1 1 18 16 70 o 11 26.492  6.45982 21.699      11.2642  3.94585     11.4275  13.2448    125.716     1.69384     125.716     
1 1 1 18 16 71 o 2  28.573  7.03185 7.3324      14.429   23.8943     12.3212  9.77745    127.195     12.9513     307.195     
1 1 1 18 16 72 o 2  30.4587 7.05553 24.8459     12.748   15.8569     12.4723  15.4137    3.2599      2.75857     183.26      
1 1 1 18 16 73 o 9  24.5772 6.81242 11.2357     12.1416  11.0005     12.3002  9.9775     70.6658     2.67861     250.666     
1 1 1 18 16 74 o 3  40.4903 6.8822  32.6714     13.5039  42.1362     14.1777  24.8012    250.487     3.13606     250.487     
1 1 1 18 16 75 o 8  23.1213 6.71583 19.7559     14.4878  -6.38088    12.5237  5.65375    52.203      2.98567     232.203     
1 1 1 18 16 76 o 10 19.05   6.09317 -9.46465    12.6517  5.4074      12.9291  0.675666   118.437     9.67099     298.437     
1 1 1 18 16 77 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 17 0  o 8  11.1556 5.04897 0.304302    6.34145  0.304302    6.34145  70.764     180         145.635     180         
1 1 1 18 17 1  o 15 96.5009 2.58603 165.906     12.4511  164.956     12.5157  61.4455    331.637     3.06284     331.637     
1 1 1 18 17 2  o 12 83.5215 2.65239 128.518     11.0677  119.566     11.0682  46.6355    347.779     11.3418     347.779     
1 1 1 18 17 3  o 12 92.7968 2.59314 153.695     12.0842  152.296     11.9869  10.4815    7.97319     105.682     187.973     
1 1 1 18 17 4  o 16 336.779 3.66781 2029.32     61.9065  1999.56     61.8975  240.691    202.606     12.9525     22.6056     
1 1 1 18 17 5  o 12 117.371 2.5173  239.054     14.7978  250.175     14.7747  41.2958    160.304     81.1843     340.304     
1 1 1 18 17 6  o 14 260.678 3.10905 1194.05     39.7217  1218.2      41.5046  177.129    214.75      25.9291     34.7498     
1 1 1 18 17 7  f 0  120.167 2.64346 266.254     16.6386  246.778     15.1656  138.884    217.534     0           0           
1 1 1 18 17 8  o 3  123.713 2.56311 271.566     15.5501  271.893     16.1907  55.1262    250.473     62.5174     70.4725     
1 1 1 18 17 9  o 15 273.148 3.10597 1326.38     42.5259  1322.23     42.5069  213.882    356.854     30.0868     356.854     
1 1 1 18 17 10 o 7  108.059 2.54551 203.254     13.7577  211.528     13.7693  56.8388    310.345     32.4856     130.345     
1 1 1 18 17 11 o 8  214.584 2.90724 811.418     31.2653  822.926     31.2607  168.551    96.135      28.2838     96.135      
1 1 1 18 17 12 o 18 131.141 2.61519 297.487     17.1675  313.328     17.1634  111.571    232.881     48.5052     232.881     
1 1 1 18 17 13 o 1  187.219 2.77032 619.36      25.9938  624.577     25.9899  151.745    210.886     37.137      210.886     
1 1 1 18 17 14 o 8  362.942 3.92835 2320.59     69.7038  2361.74     73.1817  269.329    138.038     7.6674      138.038     
1 1 1 18 17 15 o 6  101.892 2.84293 185.383     14.5101  183.693     14.4661  31.2517    272.82      77.2269     92.8202     
1 1 1 18 17 16 o 11 100.859 2.97537 177.919     14.4937  183.877     15.5143  76.828     241.682     44.2685     241.682     
1 1 1 18 17 17 o 14 182.639 2.65858 590.23      24.3426  593.616     24.3242  112.224    252.685     37.2297     72.6851     
1 1 1 18 17 18 o 1  122.309 2.54637 267.793     15.562   263.546     15.6183  59.6585    345.812     51.2692     165.812     
1 1 1 18 17 19 o 3  193.38  2.6882  663.235     26.0416  664.137     26.0615  151.519    265.933     26.8419     265.933     
1 1 1 18 17 20 o 12 131.947 2.56637 305.303     16.9118  313.106     16.9947  122.916    135.078     70.46       135.078     
1 1 1 18 17 21 o 12 245.921 3.00718 1062.78     36.2204  1085.24     37.8968  193.377    156.606     31.8642     156.606     
1 1 1 18 17 22 o 8  135.622 2.80256 322.82      19.0048  330.888     19.0483  99.0387    266.561     8.79766     266.561     
1 1 1 18 17 23 o 18 189.649 2.69575 634.871     25.6056  642.181     25.6352  177.235    186.903     85.7158     186.903     
1 1 1 18 17 24 o 15 124.827 2.58277 279.103     16.1298  274.584     16.1481  33.2634    309.454     110.704     129.454     
1 1 1 18 17 25 o 7  126.517 2.62773 285.257     16.1992  283.607     17.0714  113.49     190.712     54.2579     190.712     
1 1 1 18 17 26 o 2  186.619 2.96404 621.085     28.4308  616.447     26.9965  160.314    273.343     55.3297     273.343     
1 1 1 18 17 27 o 18 89.7132 2.88747 137.31      12.7758  149.41      13.1143  67.6252    266.986     18.7401     266.986     
1 1 1 18 17 28 f 0  38.6326 4.77652 24.4125     8.66585  30.5905     9.13779  25.9769    283.504     0           0           
1 1 1 18 17 29 o 7  44.6529 4.48751 36.6003     9.45317  35.9829     10.048   2.21765    51.0235     45.2324     231.023     
1 1 1 18 17 30 o 1  118.377 2.79527 237.265     16.3656  261.7       16.7391  95.1139    33.4404     27.9479     33.4404     
1 1 1 18 17 31 o 14 149.065 2.73083 400.023     20.3663  390.415     20.3967  122.03     101.456     35.4459     101.456     
1 1 1 18 17 32 o 13 87.9057 2.8247  141.091     12.3719  134.327     12.4427  64.5857    358.906     13.6695     358.906     
1 1 1 18 17 33 f 0  293.468 3.2342  1511.04     47.5423  1556.38     47.5804  205.848    1.56684     0           0           
1 1 1 18 17 34 o 16 136.722 2.71934 334.492     18.6084  330.966     18.6182  112.737    346.428     35.6776     346.428     
1 1 1 18 17 35 o 11 57.3124 3.3181  59.6346     9.44215  58.2468     9.45015  10.0671    234.339     96.5872     234.339     
1 1 1 18 17 36 o 15 113.525 2.80609 226.476     15.6929  232.942     16.1877  52.6584    320.816     52.7563     140.816     
1 1 1 18 17 37 o 6  131.921 2.74817 311.732     18.4471  308.497     17.8479  78.5623    65.4651     26.9673     245.465     
1 1 1 18 17 38 o 6  259.275 3.11366 1193.33     39.54    1204.89     41.3609  231.733    331.496     97.3376     331.496     
1 1 1 18 17 39 o 8  23.1424 4.94029 -3.47549    7.50193  18.341      7.8319   7.36752    130.985     25.1803     130.985     
1 1 1 18 17 40 o 8  152.798 2.99217 417.446     21.2646  416.37      24.3996  112.095    177.046     11.6763     177.046     
1 1 1 18 17 41 o 9  46.1739 3.83928 40.065      8.65681  37.4424     8.75726  14.0362    92.9099     26.5276     272.91      
1 1 1 18 17 42 o 3  176.221 2.74317 546.52      24.3355  561.275     24.1085  153.932    238.38      62.6723     238.38      
1 1 1 18 17 43 o 14 149.199 2.6546  400.049     19.0958  394.29      20.5432  110.48     287.402     13.6253     287.402     
1 1 1 18 17 44 o 18 41.884  4.30748 29.5838     9.02713  35.0914     8.39099  17.7795    222.284     16.1664     42.284      
1 1 1 18 17 45 o 8  57.9111 3.23957 59.7549     9.18332  61.1646     9.46727  45.3277    295.132     16.3404     295.132     
1 1 1 18 17 46 o 12 32.151  4.87243 20.4943     7.55059  18.5205     7.68038  14.183     355.396     4.20697     175.396     
1 1 1 18 17 47 o 6  58.9034 3.31828 60.0221     9.6609   65.4547     9.75635  33.8017    350.788     10.4402     170.788     
1 1 1 18 17 48 o 15 68.6021 3.04766 84.4614     10.4178  85.0598     10.4315  60.5536    209.003     31.7948     209.003     
1 1 1 18 17 49 o 9  51.9601 3.71886 58.5811     9.51265  40.7512     9.33096  33.6162    223.691     0.321371    223.69      
1 1 1 18 17 50 o 16 125.736 2.6264  267.776     16.4566  299.416     16.5723  94.4997    186.481     17.037      186.481     
1 1 1 18 17 51 o 2  165.779 2.73038 487.893     21.2467  497.966     24.057   119.026    355.847     10.6783     355.847     
1 1 1 18 17 52 o 15 89.2901 2.91335 140.199     12.7397  147.074     13.2644  69.6299    345.432     19.29       345.432     
1 1 1 18 17 53 o 1  56.7206 3.62554 50.2193     10.0259  68.004      10.1761  42.5907    71.9408     12.1363     71.9408     
1 1 1 18 17 54 o 5  21.7594 5.86463 1.30401     9.71894  10.3107     8.80444  2.56284    96.5179     2.89976     276.518     
1 1 1 18 17 55 o 5  49.0045 4.54593 48.5308     10.8193  41.4197     10.8922  22.2127    70.7193     19.1118     250.719     
1 1 1 18 17 56 o 4  90.8987 3.19388 148.409     14.5004  151.199     14.5057  50.7198    321.576     20.5002     141.576     
1 1 1 18 17 57 o 9  69.8821 3.69454 92.6844     12.8745  86.4909     12.8045  52.7753    43.805      13.6083     43.805      
1 1 1 18 17 58 o 1  39.1668 5.57747 42.1713     10.638   19.3596     10.5608  22.9025    23.8083     2.89184     203.808     
1 1 1 18 17 59 o 12 93.541  3.161   161.668     14.8404  157.118     14.709   69.379     349.186     14.4488     349.186     
1 1 1 18 17 60 o 13 52.4782 4.04768 46.4344     10.3393  56.9574     10.5166  31.1168    306.726     5.71352     126.726     
1 1 1 18 17 61 o 10 22.9844 5.99781 10.0599     8.39921  7.72194     10.009   8.54869    146.169     5.47689     326.169     
1 1 1 18 17 62 o 1  48.7881 4.43863 41.5131     10.1839  49.5936     11.0074  41.5531    104.307     23.1931     104.307     
1 1 1 18 17 63 o 7  32.1422 5.95304 17.6549     9.04906  25.1457     10.4446  19.265     159.57      2.18981     159.57      
1 1 1 18 17 64 o 4  33.3944 6.29028 24.657      10.7933  22.0561     10.6562  15.1119    21.1603     9.55196     201.16      
1 1 1 18 17 65 o 14 25.3458 6.90237 10.9452     12.1981  11.7802     12.5503  9.71628    164.731     0.271162    164.731     
1 1 1 18 17 66 o 4  21.4158 6.19715 2.40349     10.5325  8.46777     10.8271  3.5659     340.529     1.8782      160.529     
1 1 1 18 17 67 o 5  57.4325 4.63393 73.0007     13.0676  55.2371     12.8848  39.8535    241.976     7.65005     241.976     
1 1 1 18 17 68 o 3  31.162  6.50501 28.2088     11.4515  12.6806     11.3688  18.8443    173.509     5.31371     173.509     
1 1 1 18 17 69 o 15 20.9396 6.14131 -4.29596    10.8259  10.8085     11.4234  3.56388    232.637     14.6882     52.6374     
1 1 1 18 17 70 o 17 17.091  5.49329 3.28298     10.9513  -16.8744    10.8667  1.7657     149.993     10.1053     329.993     
1 1 1 18 17 71 o 3  38.0108 7.01489 34.4903     13.4596  30.3214     13.5953  23.7815    232.321     3.21216     232.321     
1 1 1 18 17 72 o 7  20.2417 6.23766 6.37461     11.8629  -3.00115    12.3925  4.56955    252.22      3.4544      72.2204     
1 1 1 18 17 73 o 17 26.0912 6.96908 20.0733     12.9136  8.22269     12.7762  10.2436    240.613     3.23725     60.6135     
1 1 1 18 17 74 o 10 20.5781 6.49519 2.72071     12.4466  1.025       14.8936  0.697007   156.833     0.75845     336.833     
1 1 1 18 17 75 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 17 76 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 18 18 0  o 4  283.35  4.49342 1426.15     63.7334  1426.15     63.7334  332.822    5.17579e-05 244.918     5.17579e-05 
1 1 1 18 18 1  o 1  330.092 3.63533 1934.6      60.1039  1934.6      60.1039  317.58     210         144.84      210         
1 1 1 18 18 2  o 11 25.0092 6.51304 14.8592     7.55098  14.8592     7.55098  9.00211    60          22.1023     60          
1 1 1 18 18 3  o 15 41.1205 4.23825 31.8585     8.19269  31.8585     8.19269  29.7494    270         108.471     270         
1 1 1 18 18 4  o 14 45.1202 3.86937 37.6853     8.4071   37.6853     8.4071   7.22694    300         58.8695     300         
1 1 1 18 18 5  o 5  160.436 2.60984 457.107     20.9584  457.107     20.9584  107.228    330         23.698      150         
1 1 1 18 18 6  o 18 123.009 2.57946 268.99      15.8694  268.99      15.8694  88.4905    360         5.43956     180         
1 1 1 18 18 7  o 9  166.56  2.734   492.725     22.793   492.725     22.793   190.006    210         168.004     210         
1 1 1 18 18 8  o 16 193.404 2.77565 664.118     26.8774  664.118     26.8774  150.207    60          13.6299     60          
1 1 1 18 18 9  o 3  241.331 2.93972 1033.81     35.5294  1033.81     35.5294  242.025    90          126.367     90          
1 1 1 18 18 10 o 19 244.746 2.95    1063.28     36.1588  1063.28     36.1588  210.369    300         58.185      300         
1 1 1 18 18 11 o 6  288.447 3.20414 1476.99     46.2909  1476.99     46.2909  206.228    330         14.5863     150         
1 1 1 18 18 12 o 18 42.6715 4.16803 34.1181     8.42903  34.1181     8.42903  10.9247    180         68.9855     180         
1 1 1 18 18 13 o 3  122.24  2.55334 265.654     15.6108  265.654     15.6108  125.759    210         72.722      210         
1 1 1 18 18 14 o 17 131.893 2.52316 309.138     16.6498  309.138     16.6498  43.0801    240         108.702     60          
1 1 1 18 18 15 o 16 400.697 4.12967 2852.78     82.8865  2852.78     82.8865  285.906    90          19.7117     270         
1 1 1 18 18 16 o 14 168.232 2.86335 502.869     24.1088  502.869     24.1088  111.385    120         25.3684     300         
1 1 1 18 18 17 o 14 38.1037 5.12504 28.4196     8.75783  28.4196     8.75783  1.03652    150         23.2366     150         
1 1 1 18 18 18 o 19 157.06  2.70509 438.29      21.2631  438.29      21.2631  117.144    180         3.06332     180         
1 1 1 18 18 19 o 16 194.135 2.85835 669.421     27.7815  669.421     27.7815  142.772    30          0.0287397   30.009      
1 1 1 18 18 20 o 18 42.8998 4.88718 35.1422     9.68961  35.1422     9.68961  2.3458     240         59.649      240         
1 1 1 18 18 21 o 17 11.5307 5.33214 -0.990706   7.60306  -0.990706   7.60306  0.0614138  89.9869     0.130278    89.9869     
1 1 1 18 18 22 o 3  303.767 3.37714 1639.2      51.3816  1639.2      51.3816  231.241    120         17.2489     120         
1 1 1 18 18 23 o 12 98.8822 2.82729 174.329     13.9582  174.329     13.9582  36.1988    330         72.3537     150         
1 1 1 18 18 24 o 5  13.5097 5.83801 2.78026     7.50667  2.78026     7.50667  46.7165    8.65315e-06 101.528     8.65315e-06 
1 1 1 18 18 25 o 11 154.126 2.67547 422.225     20.6369  422.225     20.6369  127.381    30          29.7363     30          
1 1 1 18 18 26 o 7  81.928  3.01561 120.105     12.3043  120.105     12.3043  35.1384    60          49.1267     240         
1 1 1 18 18 27 o 18 75.3114 2.96389 101.608     11.1064  101.608     11.1064  67.9339    270         39.4767     270         
1 1 1 18 18 28 o 9  44.7152 4.18205 37.3671     8.91513  37.3671     8.91513  12.2405    120         31.1711     300         
1 1 1 18 18 29 o 8  67.1982 3.28829 81.3512     10.9497  81.3512     10.9497  48.9422    150         3.22023     150         
1 1 1 18 18 30 o 7  47.5331 3.985   41.8393     9.14175  41.8393     9.14175  21.8368    180         1.38408     360         
1 1 1 18 18 31 o 11 105.632 2.92254 199.055     15.417   199.055     15.417   42.3788    210         68.04       30          
1 1 1 18 18 32 o 15 63.6375 3.64309 73.4181     11.4375  73.4181     11.4375  32.5204    60          26.2838     240         
1 1 1 18 18 33 o 11 81.9345 3.06882 120.282     12.5196  120.282     12.5196  61.2495    270         4.53231     270         
1 1 1 18 18 34 o 14 26.8239 7.14721 17.3971     8.98986  17.3971     8.98986  16.7502    300         62.4778     300         
1 1 1 18 18 35 o 18 12.4503 5.70419 -0.296946   8.42082  -0.296946   8.42082  18.0354    330         39.9817     330         
1 1 1 18 18 36 o 16 295.139 3.25353 1550.6      48.0953  1550.6      48.0953  205.305    180         12.3772     8.63789e-06 
1 1 1 18 18 37 o 3  246.777 2.96576 1083.71     36.6537  1083.71     36.6537  211.267    210         69.5701     210         
1 1 1 18 18 38 o 14 160.47  2.66228 458.345     21.3829  458.345     21.3829  136.853    60          44.6617     60          
1 1 1 18 18 39 o 12 165.297 2.73157 486.486     22.5997  486.486     22.5997  125.061    270         14.6905     270         
1 1 1 18 18 40 o 8  58.1442 3.46708 61.4925     9.93105  61.4925     9.93105  50.4204    300         20.9443     300         
1 1 1 18 18 41 o 7  101.278 2.69371 183.161     13.6279  183.161     13.6279  91.9315    150         40.2489     150         
1 1 1 18 18 42 o 14 23.5945 6.65865 13.8585     7.62248  13.8585     7.62248  3.00677    360         5.99046     180         
1 1 1 18 18 43 o 8  16.4436 6.404   6.84585     7.64506  6.84585     7.64506  3.36053    210         13.7897     210         
1 1 1 18 18 44 o 3  36.2366 5.34736 26.3999     8.55946  26.3999     8.55946  6.73961    60          37.323      240         
1 1 1 18 18 45 o 14 47.3349 4.0105  41.7682     9.15252  41.7682     9.15252  32.7835    90          0.697205    270         
1 1 1 18 18 46 o 19 46.2288 4.48191 40.4267     9.82982  40.4267     9.82982  42.1269    300         22.3298     300         
1 1 1 18 18 47 o 5  54.5492 3.85767 54.8512     10.2853  54.8512     10.2853  41.1533    150         6.11451     150         
1 1 1 18 18 48 o 11 77.3566 3.02419 107.764     11.6413  107.764     11.6413  51.8853    1.90061e-12 4.04948     180         
1 1 1 18 18 49 o 15 8.02633 4.05903 -11.3226    7.47361  -11.3226    7.47361  13.9765    210         31.4834     210         
1 1 1 18 18 50 o 3  70.8624 3.65226 91.3985     12.8083  91.3985     12.8083  48.4037    60          1.42762     240         
1 1 1 18 18 51 o 4  83.0222 3.45008 124.692     14.2398  124.692     14.2398  62.2819    90          9.79295     90          
1 1 1 18 18 52 o 16 41.8033 5.25479 34.4043     9.97175  34.4043     9.97175  18.911     120         19.7722     300         
1 1 1 18 18 53 o 5  85.5824 3.29875 132.303     14.0513  132.303     14.0513  61.123     330         4.61396     330         
1 1 1 18 18 54 o 13 54.9579 3.65376 55.6307     9.84664  55.6307     9.84664  58.4963    360         49.6235     360         
1 1 1 18 18 55 o 6  74.2746 3.07388 99.7515     11.3511  99.7515     11.3511  36.6023    210         28.2772     30          
1 1 1 18 18 56 o 1  13.5744 5.89779 3.05388     7.7558   3.05388     7.7558   1.87787    240         11.6672     240         
1 1 1 18 18 57 o 12 122.453 2.62023 268.772     16.0461  268.772     16.0461  92.1247    270         17.973      270         
1 1 1 18 18 58 o 1  63.5876 3.4207  74.0364     10.7518  74.0364     10.7518  28.1431    120         29.7838     300         
1 1 1 18 18 59 o 7  140.822 2.61646 355.767     18.436   355.767     18.436   114.3      150         38.6026     150         
1 1 1 18 18 60 o 14 14.8759 6.32337 4.7093      8.50596  4.7093      8.50596  3.06194    8.58719e-06 21.5934     8.58719e-06 
1 1 1 18 18 61 o 12 40.5862 5.33777 33.205      9.75423  33.205      9.75423  33.585     30          12.9712     30          
1 1 1 18 18 62 o 11 36.3902 5.98943 28.0856     9.49798  28.0856     9.49798  21.0697    240         6.39829     60          
1 1 1 18 18 63 o 18 17.578  7.24301 7.96841     10.5516  7.96841     10.5516  0.0799274  270         18.6847     270         
1 1 1 18 18 64 o 1  11.6883 5.65685 -5.424      10.4999  -5.424      10.4999  2.06037    120         7.00033     120         
1 1 1 18 18 65 f 0  60.3816 6.18359 72.8032     17.5698  72.8032     17.5698  24.9839    330         0           0           
1 1 1 18 18 66 o 7  13.1455 6.23082 -2.6784     11.4772  -2.6784     11.4772  0.796702   7.87915e-06 4.84305     7.87915e-06 
1 1 1 18 18 67 o 7  88.7333 3.75203 144.773     16.5466  144.773     16.5466  70.0417    30          23.6539     30          
1 1 1 18 18 68 o 4  22.8508 8.21839 15.5807     11.7914  15.5807     11.7914  10.9414    60          1.49324     60          
1 1 1 18 18 69 o 12 13.0142 6.20401 -3.21717    11.6851  -3.21717    11.6851  1.39237    270         10.4867     270         
1 1 1 18 18 70 f 0  19.3666 7.88259 10.848      12.2608  10.848      12.2608  25.9887    300         0           0           
1 1 1 18 18 71 o 9  17      7.39412 6.74775     12.2212  6.74775     12.2212  1.54735    330         7.74065     150         
1 1 1 18 18 72 o 8  18.9746 7.89433 10.5909     12.7388  10.5909     12.7388  0.428257   180         0.633236    2.23118e-05 
1 1 1 18 18 73 o 14 45.7093 7.3551  46.9767     14.6845  46.9767     14.6845  30.108     30          1.69803     30.0001     
1 1 1 18 18 74 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 0  0  o 4  1363.78 15.2309 33018.5     1040.37  33018.5     1040.37  1155.78    180         327.892     180         
1 1 1 19 0  1  o 9  475.098 3.84898 4001.47     91.6137  4001.47     91.6137  419.396    240         147.765     240         
1 1 1 19 0  2  o 14 46.2107 2.46693 38.4811     5.63625  38.4811     5.63625  34.3402    300         76.0419     300         
1 1 1 19 0  3  o 2  933.816 7.44772 15465.3     348.434  15465.3     348.434  688.095    2.54533e-06 18.2598     2.54533e-06 
1 1 1 19 0  4  o 16 138.126 2.24083 338.589     15.4927  338.589     15.4927  28.7858    240         34.521      60          
1 1 1 19 0  5  o 6  343.441 3.13269 2091.14     53.8973  2091.14     53.8973  363.6      120         234.765     120         
1 1 1 19 0  6  o 6  195.022 2.39947 674.532     23.4349  674.532     23.4349  91.0601    180         41.0288     180         
1 1 1 19 0  7  o 15 762.576 6.17397 10311.8     235.874  10311.8     235.874  556.279    60          4.86717     59.9999     
1 1 1 19 0  8  o 11 402.818 3.68194 2876.85     74.2989  2876.85     74.2989  314.126    120         43.3813     120         
1 1 1 19 0  9  o 14 109.848 2.11754 214.284     11.6374  214.284     11.6374  5.34163    360         67.5441     360         
1 1 1 19 0  10 o 14 132.112 2.20493 309.775     14.5797  309.775     14.5797  9.30129    60          181.095     60          
1 1 1 19 0  11 o 11 177.976 2.54758 561.959     22.7012  561.959     22.7012  20.4171    120         212.462     300         
1 1 1 19 0  12 o 10 773.073 6.26909 10598.3     242.805  10598.3     242.805  705.657    3.55653e-07 291.318     3.55653e-07 
1 1 1 19 0  13 o 12 64.4874 2.46369 74.3316     7.90855  74.3316     7.90855  8.50881    59.9999     21.8639     59.9999     
1 1 1 19 0  14 o 3  367.067 3.57687 2389.05     65.7692  2389.05     65.7692  179.173    300         172.681     120         
1 1 1 19 0  15 o 10 450.667 3.9686  3600.98     89.5986  3600.98     89.5986  394.677    1.76808e-06 137.908     1.76808e-06 
1 1 1 19 0  16 o 18 747.756 6.10762 9916.05     228.803  9916.05     228.803  608.049    240         136.129     240         
1 1 1 19 0  17 o 14 110.934 2.2135  218.579     12.2835  218.579     12.2835  4.51259    120         11.9767     300         
1 1 1 19 0  18 o 2  191.518 2.49181 650.606     23.8976  650.606     23.8976  5.18894    180         3.48199     180         
1 1 1 19 0  19 o 10 42.2    2.99009 32.4972     6.16669  32.4972     6.16669  12.06      240         27.3021     240         
1 1 1 19 0  20 o 14 194.908 2.58495 673.883     25.2288  673.883     25.2288  153.771    300         37.5884     300         
1 1 1 19 0  21 o 16 16.129  5.54378 6.78221     5.25484  6.78221     5.25484  57.4765    8.74069e-06 117.046     8.74069e-06 
1 1 1 19 0  22 o 11 368.045 3.68916 2402.13     68.0131  2402.13     68.0131  250.876    60          26.4696     240         
1 1 1 19 0  23 o 13 452.296 4.27897 3627.95     96.9498  3627.95     96.9498  357.898    120         67.4652     120         
1 1 1 19 0  24 o 13 707.897 6.23934 8890.73     221.267  8890.73     221.267  567.301    360         121.204     360         
1 1 1 19 0  25 o 6  197.503 2.55977 691.936     25.3166  691.936     25.3166  36.2591    240         29.4496     240         
1 1 1 19 0  26 o 7  99.5672 2.29856 176.235     11.4415  176.235     11.4415  11.0217    300         103.103     120         
1 1 1 19 0  27 o 2  297.919 2.99317 1573.91     44.6676  1573.91     44.6676  313.249    180         201.969     180         
1 1 1 19 0  28 o 5  40.8895 3.08905 30.6326     6.14795  30.6326     6.14795  44.3066    240         109.004     240         
1 1 1 19 0  29 o 15 299.876 3.09186 1594.8      46.4423  1594.8      46.4423  342.315    300         259.283     300         
1 1 1 19 0  30 o 12 166.201 2.41398 490.138     20.087   490.138     20.087   129.764    180         27.5956     180         
1 1 1 19 0  31 o 12 114.281 2.24112 231.975     12.8128  231.975     12.8128  59.3988    60          21.3977     240         
1 1 1 19 0  32 f 0  46.0974 2.96721 38.5899     6.71733  38.5899     6.71733  104.495    300         0           0           
1 1 1 19 0  33 o 18 348.784 3.71772 2158.07     64.9487  2158.07     64.9487  251.492    3.59262e-06 10.7064     3.59262e-06 
1 1 1 19 0  34 o 10 304.995 3.4263  1650.23     52.3397  1650.23     52.3397  165.491    60          98.6942     240         
1 1 1 19 0  35 o 10 509.152 5.4673  4602.35     139.43   4602.35     139.43   448.506    300         181.085     300         
1 1 1 19 0  36 o 9  206.567 3.03596 757.322     31.3974  757.322     31.3974  212.27     180         136.232     180         
1 1 1 19 0  37 o 18 158.56  3.0016  446.6       23.8123  446.6       23.8123  151.015    240         114.425     240         
1 1 1 19 0  38 o 18 322.9   3.71243 1850.1      60.0382  1850.1      60.0382  297.99     120         144.686     120         
1 1 1 19 0  39 o 4  239.417 3.29415 1017.35     39.4901  1017.35     39.4901  165.084    180         3.73749     8.65583e-06 
1 1 1 19 0  40 o 13 287.524 3.65526 1467.26     52.6304  1467.26     52.6304  167.05     60          66.0244     240         
1 1 1 19 0  41 o 18 394.257 4.05599 2758.44     80.0994  2758.44     80.0994  318.345    120         89.2623     120         
1 1 1 19 0  42 o 11 141.921 2.48926 357.661     17.6796  357.661     17.6796  70.5807    180         58.3481     180         
1 1 1 19 0  43 o 8  492.218 4.443   4300.18     109.556  4300.18     109.556  393.637    240         106.993     240         
1 1 1 19 0  44 o 3  109.742 2.34741 214.046     12.8831  214.046     12.8831  82.4774    120         44.8585     120         
1 1 1 19 0  45 o 3  216.47  2.55993 831.328     27.7532  831.328     27.7532  252.307    180         215.441     180         
1 1 1 19 0  46 o 14 91.3272 2.46546 148.489     11.2465  148.489     11.2465  54.4995    240         13.9286     240         
1 1 1 19 0  47 o 18 91.3511 2.54372 148.615     11.604   148.615     11.604   8.06226    120         108.16      300         
1 1 1 19 0  48 o 3  38.2975 3.78562 27.494      6.85909  27.494      6.85909  5.64319    9.60072e-06 18.7978     9.60072e-06 
1 1 1 19 0  49 o 1  106.562 2.47707 201.947     13.1957  201.947     13.1957  79.7726    60          21.0108     60          
1 1 1 19 0  50 o 1  32.3941 4.67066 20.7768     6.70729  20.7768     6.70729  17.055     300         47.2744     300         
1 1 1 19 0  51 o 5  205.011 2.78261 746.059     28.5647  746.059     28.5647  127.272    5.65101e-07 22.9682     180         
1 1 1 19 0  52 o 11 49.7369 3.80331 45.4113     9.19946  45.4113     9.19946  3.45655    60          7.48254     240         
1 1 1 19 0  53 o 6  185.826 2.71143 613.138     25.226   613.138     25.226   104.712    120         40.6755     300         
1 1 1 19 0  54 o 19 202.655 2.82979 729.276     28.7138  729.276     28.7138  170.796    2.76729e-07 69.6477     2.76729e-07 
1 1 1 19 0  55 f 0  69.2363 3.07547 86.0536     10.5734  86.0536     10.5734  43.3194    60          0           0           
1 1 1 19 0  56 o 3  334.561 3.4772  1988.45     58.2712  1988.45     58.2712  240.525    300         34.8212     300         
1 1 1 19 0  57 o 7  19.2183 6.10534 9.51971     6.28392  9.51971     6.28392  8.79729    2.25691e-05 21.2129     2.25691e-05 
1 1 1 19 0  58 o 9  83.6576 3.37148 125.495     14.0288  125.495     14.0288  59.9286    59.9999     44.739      59.9999     
1 1 1 19 0  59 o 10 32.2552 4.9633  20.9272     7.03032  20.9272     7.03032  1.58816    300         19.3694     300         
1 1 1 19 0  60 o 17 264.337 3.2998  1242.77     43.6818  1242.77     43.6818  180.096    360         12.118      360         
1 1 1 19 0  61 o 14 142.637 3.32223 362.841     23.6893  362.841     23.6893  96.8966    60          6.59839     60          
1 1 1 19 0  62 o 16 10.2384 4.76116 -1.09515    6.19025  -1.09515    6.19025  40.2734    120         85.103      120         
1 1 1 19 0  63 o 11 31.3937 5.6251  20.635      7.65169  20.635      7.65169  0.940279   180         17.1224     2.23118e-05 
1 1 1 19 0  64 o 19 96.8328 2.84957 167.528     13.7735  167.528     13.7735  60.3452    240         5.08113     60          
1 1 1 19 0  65 o 4  80.8441 2.98163 117.189     12.0044  117.189     12.0044  54.8957    120         5.16065     120         
1 1 1 19 0  66 o 6  22.5986 6.45776 12.7565     7.1409   12.7565     7.1409   10.5906    180         47.0555     180         
1 1 1 19 0  67 o 2  97.7047 3.06937 171.005     14.9612  171.005     14.9612  62.3567    60          0.819958    240         
1 1 1 19 0  68 o 5  66.3265 3.22951 79.5308     10.6157  79.5308     10.6157  61.3244    300         52.1721     300         
1 1 1 19 0  69 o 5  130.793 2.73091 305.392     17.8647  305.392     17.8647  86.0843    180         5.38069     180         
1 1 1 19 0  70 o 5  31.4966 5.50927 20.7729     7.5269   20.7729     7.5269   1.00656    60.0001     41.683      60          
1 1 1 19 0  71 o 2  9.78225 4.49514 -0.284253   5.2831   -0.284253   5.2831   0.685458   120         1.63007     120         
1 1 1 19 0  72 o 3  46.9436 3.48861 40.6766     7.98005  40.6766     7.98005  32.7054    180         6.56302     180         
1 1 1 19 0  73 o 10 58.9556 3.60142 63.6009     10.4502  63.6009     10.4502  32.8097    60          8.38943     240         
1 1 1 19 0  74 o 12 118.566 3.05734 252.179     18.1113  252.179     18.1113  73.0129    120         2.21086     300         
1 1 1 19 0  75 o 12 21.6361 7.34528 12.7912     9.18863  12.7912     9.18863  4.54916    180         35.1761     180         
1 1 1 19 0  76 o 12 35.9515 6.60055 27.8935     10.2756  27.8935     10.2756  15.9774    60          11.914      60          
1 1 1 19 0  77 o 19 52.0378 4.78743 51.6205     11.9018  51.6205     11.9018  31.0106    120         2.2291      300         
1 1 1 19 0  78 o 8  13.5279 6.09356 1.53945     9.1039   1.53945     9.1039   0.126547   0.000166223 0.710187    0.000166223 
1 1 1 19 0  79 f 0  10.3239 5.07606 -7.58675    9.30445  -7.58675    9.30445  13.6625    60          0           0           
1 1 1 19 0  80 o 7  97.9379 3.48408 174.362     17.0009  174.362     17.0009  80.0005    120         40.6414     120         
1 1 1 19 0  81 o 10 24.6574 7.92955 16.9138     10.6062  16.9138     10.6062  1.24827    360         26.1876     180         
1 1 1 19 0  82 o 2  16.9098 7.08016 6.79615     10.3624  6.79615     10.3624  0.0656221  60          2.62457     240         
1 1 1 19 0  83 o 15 14.8999 6.74508 1.94399     11.3251  1.94399     11.3251  7.48034    300         29.5523     300         
1 1 1 19 0  84 o 6  29.2295 8.78107 23.4985     13.05    23.4985     13.05    9.19559    360         16.245      180         
1 1 1 19 0  85 o 15 58.4053 5.80179 67.275      16.0198  67.275      16.0198  42.8032    60          16.0317     60          
1 1 1 19 0  86 o 12 19.8537 8.06452 11.1331     12.7948  11.1331     12.7948  1.9301     120         1.40519     300         
1 1 1 19 0  87 o 14 15.457  7.39956 -3.95197    16.9656  -3.95197    16.9656  1.85045    8.44656e-06 11.3781     8.44656e-06 
1 1 1 19 0  88 o 7  14.5823 7.08003 -6.80881    16.7468  -6.80881    16.7468  1.70544    240         6.83275     240         
1 1 1 19 0  89 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 1  0  o 19 86.5744 2.24939 133.344     9.72926  133.344     9.72926  137.857    360         378.348     360         
1 1 1 19 1  1  f 0  249.994 2.73132 1102.17     34.2235  1112.88     34.2132  158.439    342.74      0           0           
1 1 1 19 1  2  o 14 254.952 2.80313 1147.88     35.1424  1155.91     36.4789  77.1863    248.148     190.847     68.1477     
1 1 1 19 1  3  o 6  420.234 3.90722 3160.69     85.4196  3099.55     79.0838  343.073    137.126     103.195     137.126     
1 1 1 19 1  4  o 12 509.112 4.46385 4561.72     109.439  4627.53     118.229  325.417    116.939     73.041      296.939     
1 1 1 19 1  5  o 6  671.986 5.65672 8061.03     194.012  7952.92     186.956  449.473    98.8184     65.6677     278.818     
1 1 1 19 1  6  o 6  196.727 2.37537 696.215     23.4126  675.481     23.42    41.8844    311.905     169.595     131.905     
1 1 1 19 1  7  o 13 245.325 2.69007 1051.6      33.0596  1081.58     33.0805  112.942    303.049     99.3063     123.049     
1 1 1 19 1  8  o 12 1122.97 8.94149 22181.2     503.147  22594.9     503.218  848.867    357.428     74.1781     357.428     
1 1 1 19 1  9  f 0  818.749 6.45515 11844.7     269.355  11934.8     260.25   589.563    294.006     0           0           
1 1 1 19 1  10 f 0  204.805 2.52405 732.03      26.7876  754.675     24.9596  232.56     17.1711     0           0           
1 1 1 19 1  11 o 14 705.508 5.9827  8793.9      203.235  8860.85     219.556  463.589    157.232     85.7834     337.232     
1 1 1 19 1  12 o 8  614.429 5.21869 6715.08     163.64   6672.84     157.706  454.259    224.683     30.9405     224.683     
1 1 1 19 1  13 o 16 97.2801 2.33705 170.456     11.1477  165.348     11.5927  1.48841    73.1213     21.2587     73.1213     
1 1 1 19 1  14 o 17 661.855 5.80926 7834.7      196.514  7703.85     188.83   440.573    26.937      66.8668     206.937     
1 1 1 19 1  15 o 1  600.487 5.13027 6436.21     154.375  6352        154.389  500.246    181.708     145.747     181.708     
1 1 1 19 1  16 o 17 246.994 2.69627 1078.6      33.9711  1083.72     32.7633  155.671    11.1911     17.8437     191.191     
1 1 1 19 1  17 o 2  302.294 3.00997 1606.4      45.5776  1632.85     45.6177  181.16     225.803     55.3597     45.8032     
1 1 1 19 1  18 o 12 155.682 2.30587 433.354     17.9705  425.683     18.0082  78.2697    95.547      20.0297     275.547     
1 1 1 19 1  19 o 10 328.235 3.18923 1897.47     52.449   1921.86     52.4702  218.072    356.602     20.6428     176.602     
1 1 1 19 1  20 o 12 679.128 5.58133 8111.45     189.926  8252.79     189.973  435.306    202.131     100.14      22.1309     
1 1 1 19 1  21 o 1  189.848 2.4233  645.542     22.6286  632.009     23.4641  97.7095    153.453     53.0909     333.453     
1 1 1 19 1  22 o 1  642.802 5.65412 7283.02     185.714  7380.03     178.436  509.619    227.548     104.375     227.548     
1 1 1 19 1  23 f 0  286.873 3.08277 1448.9      45.1876  1468.7      43.4195  229.527    346.907     0           0           
1 1 1 19 1  24 o 7  207.698 2.71714 767.928     27.6367  761.307     28.9065  116.149    106.148     45.9714     286.148     
1 1 1 19 1  25 o 14 176.283 2.59515 540.926     22.4669  560.755     23.3873  67.2716    223.148     99.9957     43.148      
1 1 1 19 1  26 o 12 234.73  2.87769 981.459     34.5777  971.945     33.1154  139.45     78.9075     41.3558     258.907     
1 1 1 19 1  27 o 3  155.624 2.51539 431.02      20.0119  427.53      19.2178  78.2562    168.535     54.2469     168.535     
1 1 1 19 1  28 o 9  814.942 6.95456 11757.9     278.299  11850.5     289.677  623.147    164.74      90.3449     164.74      
1 1 1 19 1  29 o 12 119.649 2.27821 259.526     13.1046  248.38      14.1433  53.1399    49.4964     28.4103     229.496     
1 1 1 19 1  30 o 1  467.447 4.24905 3867.42     95.6394  3885.93     103.304  359.061    313.815     62.8788     313.815     
1 1 1 19 1  31 o 9  458.503 4.08129 3667.9      92.0368  3791.85     95.525   305.216    121.52      32.1431     301.52      
1 1 1 19 1  32 o 9  201.769 2.70572 724.712     26.7711  718.793     27.9292  113.589    39.7078     42.3548     219.708     
1 1 1 19 1  33 o 12 49.263  2.96429 43.3948     7.24765  43.2891     7.24976  8.96451    316.712     27.9726     316.712     
1 1 1 19 1  34 o 4  244.719 3.05034 1053.51     35.6991  1070.46     39.0681  154.627    200.906     24.0375     20.9061     
1 1 1 19 1  35 o 13 279.275 3.41792 1369.39     45.4161  1397.49     50.1812  220.912    61.0228     60.5115     61.0228     
1 1 1 19 1  36 o 15 352.959 4.23046 2215.81     72.6586  2206.46     76.9295  247.617    7.92192     6.34303     7.92194     
1 1 1 19 1  37 o 15 274.735 3.61352 1356.52     48.239   1321.84     51.1756  145.932    92.2504     87.124      272.25      
1 1 1 19 1  38 o 2  251.143 3.12305 1131.46     38.3684  1106.01     40.1979  174.283    239.699     5.29492     239.699     
1 1 1 19 1  39 o 14 186.025 2.91209 627.152     27.8942  600.433     26.4039  169.348    307.906     98.8281     307.906     
1 1 1 19 1  40 o 6  211.732 2.98737 793.627     30.0669  796.645     33.2551  72.9177    297.293     142.744     117.292     
1 1 1 19 1  41 o 3  191.479 2.79527 627.304     26.1859  673.594     27.4647  137.237    202.796     20.1438     202.796     
1 1 1 19 1  42 f 0  265.398 2.9853  1215.49     41.2295  1283.79     38.0042  162.742    104.641     0           0           
1 1 1 19 1  43 o 3  408.634 3.93279 2928.18     80.4849  3001.37     80.5808  319.194    66.8616     78.7678     66.8616     
1 1 1 19 1  44 o 13 438.248 4.11017 3344.92     90.1963  3477.46     90.3191  350.933    193.575     102.494     193.575     
1 1 1 19 1  45 o 7  303.485 3.47712 1623.99     54.0475  1645.46     51.6744  224.478    331.686     38.2285     331.686     
1 1 1 19 1  46 o 15 113.185 2.67641 228.932     14.2201  226.022     16.0316  23.5404    324.831     97.5692     144.831     
1 1 1 19 1  47 o 9  74.9075 2.81844 103.262     10.6544  96.4366     10.4269  25.3793    99.4546     5.13112     279.455     
1 1 1 19 1  48 o 7  252.945 3.05616 1087.03     38.6416  1184.71     38.7913  177.06     81.3875     15.8176     81.3875     
1 1 1 19 1  49 o 7  161.116 2.58382 455.71      20.8411  465.252     20.8822  132.183    113.778     60.6991     113.778     
1 1 1 19 1  50 o 3  176.011 2.69765 545.208     24.2668  554.14      23.3046  124.504    140.637     19.4966     140.637     
1 1 1 19 1  51 o 9  19.7215 5.10806 2.83632     6.88598  7.61571     6.59251  14.0097    37.484      31.558      37.484      
1 1 1 19 1  52 o 18 185.544 2.72202 623.412     25.8977  598.753     24.7252  130.365    19.1886     16.8206     19.1886     
1 1 1 19 1  53 o 9  191.559 2.79316 646.264     26.1582  656.686     27.4628  126.943    321.289     1.22513     321.289     
1 1 1 19 1  54 o 15 124.871 2.64759 293.835     16.1271  260.822     16.873   58.6348    87.561      44.1597     267.561     
1 1 1 19 1  55 o 18 72.6042 2.93264 102.792     10.1758  85.5305     10.9192  43.7749    206.127     15.7736     206.127     
1 1 1 19 1  56 o 7  139.99  2.4964  341.967     16.7021  354.332     18.2962  90.8247    207.716     1.19017     207.716     
1 1 1 19 1  57 o 11 230.437 2.69626 943.81      29.7734  943.432     32.442   168.822    314.164     34.9752     314.164     
1 1 1 19 1  58 o 9  110.706 2.78642 233.052     13.5639  203.811     16.8456  74.1303    149.021     9.08045     149.021     
1 1 1 19 1  59 o 4  48.6702 3.32249 32.7473     7.55528  53.7527     8.17572  13.248     174.221     23.6252     354.221     
1 1 1 19 1  60 o 3  96.7376 2.95588 177.739     13.7751  156.508     14.6956  48.0458    258.084     25.2502     78.0841     
1 1 1 19 1  61 o 6  83.2204 3.449   122.285     14.6614  125.862     13.9581  59.24      17.9023     21.2102     17.9023     
1 1 1 19 1  62 o 12 97.8207 2.98734 171.363     14.6893  170.472     14.5306  48.6758    176.539     25.2285     356.539     
1 1 1 19 1  63 o 6  123.068 2.79659 265.851     18.1029  274.667     16.2624  83.1504    138.976     10.0937     138.976     
1 1 1 19 1  64 o 9  163.771 2.84482 486.316     23.9217  470.735     22.7746  119.251    77.634      28.1551     77.634      
1 1 1 19 1  65 o 18 41.9058 4.07955 36.8641     8.36684  27.7873     8.18734  24.1329    166.516     7.81807     166.516     
1 1 1 19 1  66 o 11 39.4781 4.59968 27.461      9.35101  30.3945     8.09738  11.8586    138.361     21.3075     318.361     
1 1 1 19 1  67 o 5  36.0043 4.5054  21.8702     7.86491  26.5489     7.75806  1.32693    355.838     39.0935     175.838     
1 1 1 19 1  68 o 18 133     2.72318 315.404     18.5433  317.956     17.7056  108.748    111.898     49.8551     111.898     
1 1 1 19 1  69 o 11 12.5887 4.0971  -5.6001     5.92687  -3.22113    6.01693  18.4286    290.995     46.2464     290.995     
1 1 1 19 1  70 o 10 139.242 2.89267 340.458     20.6424  355.765     19.6402  93.1181    35.9036     10.9699     35.9036     
1 1 1 19 1  71 o 16 57.9857 3.3286  59.3153     9.55559  62.6551     9.61891  36.4541    303.108     3.77853     303.108     
1 1 1 19 1  72 o 4  110.469 2.82904 215.774     15.4758  222.955     15.7964  65.5099    359.879     6.52771     179.879     
1 1 1 19 1  73 o 12 36.5704 4.69387 25.293      9.20475  25.2523     7.28501  10.1812    304.882     21.6624     124.882     
1 1 1 19 1  74 o 14 24.1629 5.71662 9.03662     9.44351  11.604      7.12141  6.5834     257.983     8.28666     77.9834     
1 1 1 19 1  75 o 4  27.5023 5.70886 11.8453     9.58813  16.9114     7.60036  9.52053    100.054     9.21493     280.054     
1 1 1 19 1  76 o 18 45.5022 5.14403 39.2599     10.6525  40.3355     11.988   28.5275    234.694     4.64706     234.694     
1 1 1 19 1  77 o 18 26.2908 6.25935 11.1482     9.78403  15.0878     9.83951  1.67854    83.0781     32.5638     83.0781     
1 1 1 19 1  78 o 15 49.8913 4.92933 52.1794     11.7041  43.7284     12.1208  32.3855    287.469     7.13388     287.469     
1 1 1 19 1  79 o 7  48.451  5.15263 34.7878     11.7529  57.7605     11.874   23.5283    213.657     9.33673     33.6573     
1 1 1 19 1  80 o 15 44.7621 5.9184  31.9057     11.8458  49.6138     13.7498  27.4947    329.811     5.37328     329.811     
1 1 1 19 1  81 o 1  18.9405 5.81795 4.81576     9.83224  -7.69623    11.7699  0.200352   43.1908     13.2526     43.191      
1 1 1 19 1  82 o 19 27.1448 6.91492 6.01544     11.668   21.4306     13.3176  10.0876    219.18      0.899441    219.18      
1 1 1 19 1  83 o 4  20.1204 6.35685 -3.83698    11.1955  1.29357     14.7359  2.96809    313.458     10.433      133.458     
1 1 1 19 1  84 o 6  30.7051 7.20369 30.1857     13.2366  2.37783     17.2758  2.34098    165.472     29.1374     345.472     
1 1 1 19 1  85 o 12 27.8272 7.52229 14.9018     12.8191  15.1915     16.5839  11.3615    311.248     3.21523     131.248     
1 1 1 19 1  86 o 7  29.2674 8.10313 27.431      18.0164  4.90368     18.6041  11.2508    297.323     4.60884     117.323     
1 1 1 19 1  87 o 7  19.2595 6.45423 -11.8515    16.3755  -9.83161    16.9398  0.734241   171.734     8.42754     351.734     
1 1 1 19 1  88 o 14 25.4955 7.89348 4.25047     18.4832  13.2097     20.0276  4.39762    254.574     2.53059     74.5741     
1 1 1 19 1  89 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 2  0  o 4  488.17  4.39551 4225.47     107.493  4225.47     107.493  421.208    180         131.329     180         
1 1 1 19 2  1  o 18 330.867 3.22639 1951.06     52.4941  1929.29     54.4696  163.232    134.63      134.928     314.63      
1 1 1 19 2  2  o 8  124.77  2.24209 266.302     14.2585  285.789     13.7291  11.5978    287.452     81.0596     107.452     
1 1 1 19 2  3  o 11 419.599 3.75086 3133.98     78.8703  3107.31     78.8737  299.537    326.285     8.75906     326.285     
1 1 1 19 2  4  o 1  68.0937 2.44291 81.4673     8.48031  83.2944     8.12915  60.8898    247.468     160.103     247.468     
1 1 1 19 2  5  o 12 165.046 2.36219 476.147     19.16    489.328     19.9164  69.589     161.486     2.29123     161.486     
1 1 1 19 2  6  o 14 390.472 3.61223 2737.44     71.9945  2667.55     69.3755  229.426    123.286     91.3015     303.286     
1 1 1 19 2  7  o 14 217.369 2.53645 840.959     27.629   833.675     27.6311  109.832    11.0719     61.7507     191.072     
1 1 1 19 2  8  o 7  161.598 2.3193  470.655     18.7788  454.924     18.7821  67.3116    248.873     39.6538     68.8732     
1 1 1 19 2  9  o 4  390.657 3.5476  2712.15     69.4508  2697.81     69.4547  284.044    147.862     20.9265     147.862     
1 1 1 19 2  10 o 16 600.922 5.45842 6359.86     164.365  6447.69     164.387  310.066    194.993     243.38      14.9933     
1 1 1 19 2  11 o 3  435.121 4.09591 3361.6      87.5059  3350.93     91.0808  318.373    35.1528     22.1457     35.1528     
1 1 1 19 2  12 o 15 355.963 3.57462 2236.39     65.0079  2255.52     62.4892  293.098    311.281     94.5792     311.281     
1 1 1 19 2  13 o 6  248.482 2.75069 1105.47     33.6068  1083.07     34.8716  170.515    267.574     11.023      267.574     
1 1 1 19 2  14 o 9  378.793 3.75009 2559.66     71.2022  2527.33     71.1709  254.399    321.017     23.9887     141.017     
1 1 1 19 2  15 o 16 707.014 6.11462 8912.67     212.236  8824.34     220.928  483.819    5.85428     47.9761     185.854     
1 1 1 19 2  16 o 7  65.2218 2.44271 71.128      7.96647  80.2064     7.91914  56.0738    145.274     163.156     145.274     
1 1 1 19 2  17 o 3  486.453 4.44757 4172.65     101.721  4219.36     114.801  444.147    110.163     200.926     110.163     
1 1 1 19 2  18 o 7  571.002 4.88403 5799.91     137.121  5765.04     142.329  446.069    226.851     77.69       226.851     
1 1 1 19 2  19 o 3  452.094 4.06707 3654.99     90.3956  3593.01     93.8271  418.145    257.44      200.471     257.44      
1 1 1 19 2  20 o 18 620.209 5.2817  6892.34     161.043  6755.99     167.15   451.658    25.5328     17.5559     25.5329     
1 1 1 19 2  21 o 17 275.796 2.88709 1350.01     39.1201  1346.45     40.6692  224.48     7.49395     73.8445     7.49395     
1 1 1 19 2  22 o 19 855.807 7.04815 12998.3     296.604  13020.1     307.862  606.273    31.5687     12.5577     211.569     
1 1 1 19 2  23 o 2  134.808 2.29733 314.351     15.4739  329.909     15.5619  73.1249    355.658     3.73395     175.658     
1 1 1 19 2  24 o 18 307.799 3.10601 1684.95     46.9896  1674.11     48.8078  225.915    93.3247     24.1665     93.3247     
1 1 1 19 2  25 o 19 256.096 2.87327 1162.4      36.8492  1162.83     36.902   135.867    356.843     82.9751     176.843     
1 1 1 19 2  26 o 3  846.7   7.22154 12704.1     312.429  12785.1     300.252  586.601    221.602     33.1603     41.6023     
1 1 1 19 2  27 o 2  34.7247 3.66921 23.1581     6.08672  20.5898     6.26204  21.9906    245.432     50.9808     245.432     
1 1 1 19 2  28 o 8  296.599 3.24558 1563.06     47.1712  1556.67     49.2846  186.977    339.31      37.5823     159.31      
1 1 1 19 2  29 o 18 292.305 3.45445 1532.44     50.6071  1498.15     50.5939  201.209    170.522     1.23101     350.522     
1 1 1 19 2  30 o 5  194.38  2.86054 670.534     27.8721  669.248     27.8579  129.192    30.2456     2.11699     30.2456     
1 1 1 19 2  31 o 10 312.079 3.67964 1693.79     56.0027  1761.72     59.096   187.68     340.082     57.433      160.082     
1 1 1 19 2  32 o 2  37.8113 3.73153 18.8389     6.35738  33.9936     7.12322  35.8357    20.0623     87.8709     20.0623     
1 1 1 19 2  33 o 17 119.858 2.58261 248.627     14.3545  261.307     16.6014  33.9055    47.0634     83.6012     227.063     
1 1 1 19 2  34 o 16 302.266 3.51485 1625.64     53.2177  1615.76     53.2664  224.14     253.898     31.1537     253.898     
1 1 1 19 2  35 o 12 502.394 4.71891 4476.64     116.181  4487.07     121.384  340.31     208.04      22.4812     28.0402     
1 1 1 19 2  36 o 8  182.549 2.91196 597.8       24.4408  584.153     28.6222  97.0946    182.313     53.2215     2.31325     
1 1 1 19 2  37 o 9  432.438 4.32785 3324.39     91.5055  3315.79     96.014   273.63     335.18      55.1788     155.18      
1 1 1 19 2  38 o 14 309.074 3.46762 1712.57     53.7214  1677.24     53.6945  216.835    107.736     7.50834     107.736     
1 1 1 19 2  39 o 19 195.465 2.75575 672.01      26.3494  683.125     27.6328  171.706    47.1133     86.659      47.1133     
1 1 1 19 2  40 o 12 442.146 4.54945 3493.86     93.3326  3451.53     107.672  361.045    328.091     111.322     328.091     
1 1 1 19 2  41 o 4  93.8166 2.48446 144.4       10.7805  168.647     12.5573  27.9782    61.3208     57.5404     241.321     
1 1 1 19 2  42 o 17 233.816 2.96714 985.512     30.7446  954.177     38.2533  159.281    45.3485     2.72535     45.3484     
1 1 1 19 2  43 o 7  249.537 3.30268 1109.19     36.9996  1100.72     45.1641  195.211    240.524     54.4295     240.524     
1 1 1 19 2  44 f 0  226.201 2.94116 887.474     31.8277  928.173     34.8404  180.755    41.3434     0           0           
1 1 1 19 2  45 o 15 283.004 3.24164 1388.95     43.8404  1453.99     48.0896  233.435    143.225     85.6559     143.225     
1 1 1 19 2  46 o 9  199.034 2.84007 702.366     27.6239  703.158     29.0158  146.052    231.593     29.1147     231.593     
1 1 1 19 2  47 o 14 101.303 2.68618 185.65      13.2264  178.978     13.9714  32.4011    321.538     61.1033     141.537     
1 1 1 19 2  48 o 12 160.922 2.70061 452.761     22.1973  466.103     21.3363  103.973    236.334     1.39056     56.3338     
1 1 1 19 2  49 o 11 101.806 2.64945 191.707     13.005   176.704     13.9128  63.7677    54.1122     8.56769     54.1123     
1 1 1 19 2  50 o 6  138.084 2.72119 337.837     17.7479  339.408     19.8231  91.482     0.189986    5.88109     0.189987    
1 1 1 19 2  51 o 9  129.857 2.66369 292.526     17.2817  306.592     17.3447  95.9563    108.148     27.4993     108.148     
1 1 1 19 2  52 o 13 118.607 2.62831 242.442     15.165   257.534     16.0446  74.637     151.86      2.07406     331.86      
1 1 1 19 2  53 o 6  133.347 2.69845 304.505     17.8814  327.639     18.1368  77.9097    228.583     17.0808     48.583      
1 1 1 19 2  54 o 12 108.126 2.70494 207.091     14.2277  208.696     15.0322  59.5524    274.928     18.2106     94.9275     
1 1 1 19 2  55 o 16 184.028 2.67438 598.092     25.1438  605.05      24.1685  138.986    19.0935     37.0705     19.0935     
1 1 1 19 2  56 o 2  128.61  2.44405 289.666     15.5854  298.313     15.8913  104.969    55.3922     47.7106     55.3922     
1 1 1 19 2  57 o 1  85.3852 2.68251 129.987     11.5532  129.702     11.3456  65.8629    219.151     37.7704     219.151     
1 1 1 19 2  58 o 6  152.707 2.46051 409.809     18.3056  419.082     19.3491  92.3498    2.47636     13.6717     182.476     
1 1 1 19 2  59 o 14 17.0893 4.50663 0.476918    4.38288  7.33138     6.28389  23.5378    216.078     55.5791     216.078     
1 1 1 19 2  60 o 9  135.152 2.51124 330.928     18.2056  319.243     15.7423  106.075    176.515     40.5996     176.515     
1 1 1 19 2  61 o 16 40.5967 4.64448 27.5232     10.1717  33.2547     7.61902  8.13283    55.4965     8.4582      235.497     
1 1 1 19 2  62 o 13 100.353 2.74168 180.723     14.3101  178.699     13.1971  69.3508    98.2627     13.3817     98.2627     
1 1 1 19 2  63 o 14 91.4621 2.60982 155.114     12.5306  143.586     11.3476  41.5084    201.98      32.9314     21.9802     
1 1 1 19 2  64 o 5  175.093 2.81968 560.973     24.6701  533.499     24.7979  117.424    24.2915     8.84805     24.2916     
1 1 1 19 2  65 o 9  33.7454 5.39795 17.8177     9.18532  25.3902     8.73002  11.2348    60.4961     2.11814     60.4962     
1 1 1 19 2  66 o 13 92.1651 2.94016 155.225     13.3442  149.376     13.731   48.9842    234.092     18.4845     54.0925     
1 1 1 19 2  67 o 6  59.9876 3.50845 50.9507     10.0412  81.1072     10.4893  33.9278    38.9098     4.98143     218.91      
1 1 1 19 2  68 o 9  114.137 2.80822 229.791     16.6183  237.41      15.4099  73.3374    285.261     2.54558     285.261     
1 1 1 19 2  69 o 19 38.6479 4.46709 26.4995     7.86238  29.2821     8.84809  19.9197    11.8946     1.96527     191.895     
1 1 1 19 2  70 o 19 115.353 2.66819 232.569     15.1345  244.697     15.6742  72.6794    196.766     0.523423    196.765     
1 1 1 19 2  71 o 8  82.472  2.62056 120.185     10.5543  124         11.052   51.563     269.284     1.22938     269.284     
1 1 1 19 2  72 o 12 65.1308 3.72063 79.1207     11.8142  75.7312     12.2464  40.3962    186.852     1.78665     186.852     
1 1 1 19 2  73 o 9  21.1574 5.71732 5.25481     8.38407  7.26529     8.53756  0.918825   39.9544     17.1675     219.954     
1 1 1 19 2  74 o 6  45.6833 4.70467 40.9021     10.3326  37.8713     10.5498  20.8985    339.941     12.3795     159.941     
1 1 1 19 2  75 o 16 95.2167 3.07241 182.038     15.0211  147.821     14.1765  65.418     196.954     13.8329     196.954     
1 1 1 19 2  76 o 19 22.3354 5.5101  14.0921     8.90317  3.49471     6.79673  5.87655    142.528     8.04809     322.528     
1 1 1 19 2  77 o 10 53.8331 4.94754 56.986      11.9071  54.1319     13.9464  29.2248    123.555     5.43859     303.555     
1 1 1 19 2  78 o 12 25.976  6.12497 20.9421     9.79425  -1.79034    12.5443  9.41646    338.547     5.36154     158.547     
1 1 1 19 2  79 o 8  51.8916 5.22489 53.9996     12.0303  50.9609     14.1474  28.6176    22.6129     3.19097     202.613     
1 1 1 19 2  80 o 18 40.2158 6.14457 32.5201     11.2641  33.6409     12.7753  20.5959    99.1642     2.97938     279.164     
1 1 1 19 2  81 o 9  31.6628 6.69795 18.5162     11.9684  23.2825     11.128   14.3831    217.439     2.32032     37.4387     
1 1 1 19 2  82 o 8  20.4352 6.13018 0.62508     11.0293  4.69698     10.8891  3.54057    52.6819     3.56862     232.682     
1 1 1 19 2  83 o 7  22.9321 6.57092 11.1679     11.8956  1.32475     12.2122  7.15567    329.45      2.31304     149.45      
1 1 1 19 2  84 o 7  31.5986 7.33906 20.694      13.2131  22.6502     13.6586  12.0849    81.0044     9.14691     261.004     
1 1 1 19 2  85 o 12 21.4383 6.31528 13.2332     12.1904  -12.3339    13.1562  4.64415    99.2484     6.93881     279.248     
1 1 1 19 2  86 o 10 25.9618 7.4531  5.2819      17.9329  16.1023     13.7381  3.80892    232.785     0.549754    232.785     
1 1 1 19 2  87 o 14 20.4814 6.77823 -18.5678    17.0846  1.8368      18.1124  1.32832    310.658     5.54316     130.658     
1 1 1 19 2  88 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 3  0  o 5  72.4309 2.55371 93.6533     9.21666  93.6533     9.21666  44.9557    180         135.348     180         
1 1 1 19 3  1  o 16 262.369 2.78196 1236.96     35.8824  1203.04     37.2375  129.189    263.599     100.83      83.5985     
1 1 1 19 3  2  o 4  117.625 2.22545 250.614     13.3728  240.145     12.8417  23.6812    274.978     180.472     274.978     
1 1 1 19 3  3  f 0  571.977 4.92498 5813.48     138.52   5788.1      143.76   323.622    71.7557     0           0           
1 1 1 19 3  4  o 18 586.471 5.12952 6110.11     150.761  6087.72     150.757  408.109    30.3411     26.6547     210.341     
1 1 1 19 3  5  o 10 188.322 2.50742 614.515     25.0031  642.635     22.1675  104.848    276.316     20.2759     96.3163     
1 1 1 19 3  6  o 6  680.579 5.84505 8229.25     191.522  8201.74     206.866  445.37     301.815     91.2665     121.815     
1 1 1 19 3  7  o 14 632.889 5.28407 7108.99     164.454  7097.44     170.669  417.296    148.384     77.0577     328.384     
1 1 1 19 3  8  o 2  577.681 4.83431 5914.53     139.949  5919.98     139.957  424.187    41.1862     19.3186     41.1862     
1 1 1 19 3  9  o 7  391.638 3.57576 2710.43     70.1772  2727.11     70.1825  231.03     341.323     93.4696     161.323     
1 1 1 19 3  10 o 1  619.357 5.34427 6860.63     165.877  6746.32     165.871  432.369    149.89      26.0753     329.889     
1 1 1 19 3  11 o 18 587.585 4.93163 6151.17     145.215  6093.96     145.22   370.438    186.329     103.935     6.32904     
1 1 1 19 3  12 o 18 319.207 3.22863 1806.77     49.6088  1805.29     53.6072  236.658    155.671     29.7163     155.671     
1 1 1 19 3  13 o 2  670.061 5.76849 7882.83     193.682  8047.89     193.709  521.913    261.152     80.2709     261.152     
1 1 1 19 3  14 o 19 973.032 8.70697 16509.7     450.788  17144       395.364  712.351    88.8991     19.2738     88.8991     
1 1 1 19 3  15 o 12 232.325 2.72502 966.286     31.7075  947.001     31.7431  203.634    98.6394     115.143     98.6394     
1 1 1 19 3  16 o 6  830.126 6.9753  12033.6     290.135  12438.2     290.165  684.084    201.937     173.426     201.937     
1 1 1 19 3  17 o 17 133.093 2.18035 325.824     14.5233  302.233     14.5455  1.80422    243.135     175.305     243.135     
1 1 1 19 3  18 o 18 138.69  2.19404 337.05      15.5037  344.733     14.9831  32.7028    84.9854     110.466     264.985     
1 1 1 19 3  19 o 6  606.209 5.04775 6511.46     153.335  6527.19     153.362  571.296    350.04      278.356     350.04      
1 1 1 19 3  20 o 3  256.4   2.66975 1155.71     34.2765  1174.78     34.3308  239.227    146.242     140.457     146.242     
1 1 1 19 3  21 o 8  314.851 3.08941 1753.86     47.8181  1760.79     49.6605  206.671    154.57      27.8396     334.57      
1 1 1 19 3  22 o 6  404.036 3.69423 2865.86     73.3888  2923.6      76.2084  240.185    232.702     92.6986     52.7024     
1 1 1 19 3  23 o 14 367.134 3.44229 2394.39     62.129   2385.38     64.5107  338.879    261.934     165.338     261.934     
1 1 1 19 3  24 o 8  189.98  2.44449 631.106     22.8127  648.415     23.7337  161.501    40.6327     115.452     40.6327     
1 1 1 19 3  25 o 4  54.7731 2.6666  53.7406     7.20748  53.1266     7.34067  21.9997    56.6236     72.8972     56.6236     
1 1 1 19 3  26 o 7  136.67  2.442   332.427     16.6598  330.18      16.7636  42.0957    64.2588     91.555      244.259     
1 1 1 19 3  27 o 10 177.687 2.51393 558.685     22.3499  560.658     22.4213  114.535    337.717     2.67383     157.717     
1 1 1 19 3  28 o 12 241.309 3.08914 1019.05     38.1826  1046.05     36.485   138.388    151.274     54.5678     331.274     
1 1 1 19 3  29 o 18 194.45  2.85533 663.608     27.1468  677.209     28.4973  111.253    340.183     37.7174     160.183     
1 1 1 19 3  30 o 14 39.2066 3.56963 26.3956     6.98118  29.0678     6.6835   31.8586    211.836     79.2302     211.836     
1 1 1 19 3  31 o 15 111.986 2.52693 225.175     14.6435  219.945     13.6761  57.4114    334.432     13.2289     334.432     
1 1 1 19 3  32 o 6  291.079 3.24104 1506.15     48.2465  1499.18     46.293   265.544    199.738     133.09      199.738     
1 1 1 19 3  33 o 7  241.47  3.02204 1036        34.8468  1032.02     38.2089  109.473    62.4327     115.052     242.433     
1 1 1 19 3  34 o 14 232.274 2.89135 964.331     32.8755  949.137     34.405   209.554    26.071      105.724     26.071      
1 1 1 19 3  35 o 10 296.058 3.3878  1583.09     51.4332  1526.94     49.0969  208.958    132.813     7.33629     132.813     
1 1 1 19 3  36 o 8  167.188 2.58298 492.608     20.6483  498.642     22.6018  117.424    342.396     12.8159     342.396     
1 1 1 19 3  37 f 0  114.854 2.45685 234.21      12.8279  233.996     15.3098  157.642    135.761     0           0           
1 1 1 19 3  38 o 3  180.036 2.70728 589.829     23.2408  559.964     25.4885  92.5535    343.05      58.0302     163.05      
1 1 1 19 3  39 o 11 240.071 3.10647 1000.35     34.5739  1044.7      40.0764  213.038    208.496     102.934     208.496     
1 1 1 19 3  40 o 8  116.507 2.79619 247.438     13.9449  234.698     18.245   81.9428    184.479     46.5478     184.479     
1 1 1 19 3  41 o 1  140.509 2.66197 349.728     17.323   350.838     20.0471  97.8392    131.672     17.3246     131.672     
1 1 1 19 3  42 o 9  251.303 3.36693 1155.95     38.7629  1086.05     45.5276  220.307    176.672     102.958     176.672     
1 1 1 19 3  43 f 0  28.3876 4.77327 10.9868     6.34904  19.1153     7.18957  23.5028    163.068     0           0           
1 1 1 19 3  44 o 8  158.817 2.84495 458.085     20.852   437.255     24.1951  73.2218    164.545     63.698      344.545     
1 1 1 19 3  45 o 19 69.3856 2.85645 86.1049     9.51156  85.2915     10.249   13.3446    164.838     44.2817     344.838     
1 1 1 19 3  46 o 14 43.0803 3.81319 36.5767     7.27735  30.5144     8.55765  28.2832    249.674     94.851      249.674     
1 1 1 19 3  47 o 19 273.705 3.32826 1283.66     40.016   1377.01     50.968   235.958    312.732     104.944     312.732     
1 1 1 19 3  48 o 13 193.413 2.72155 644.936     24.6862  682.819     28.0445  136.27     341.86      16.4239     341.86      
1 1 1 19 3  49 o 6  212.671 2.71011 769.655     27.1476  836.263     30.6225  160.641    262.83      38.4848     262.83      
1 1 1 19 3  50 o 12 190.743 2.79867 635.359     24.6936  656.341     28.7188  154.583    229.251     57.7632     229.251     
1 1 1 19 3  51 o 16 119.912 2.57942 259.684     14.3603  251.217     16.4908  60.1079    183.374     35.2819     3.37393     
1 1 1 19 3  52 o 9  141.316 2.44989 350.667     17.3402  358.237     17.3585  120.567    52.8138     61.0009     52.8138     
1 1 1 19 3  53 o 11 220.235 2.8993  889.013     32.8589  834.83      31.1468  138.052    126.882     17.0426     306.882     
1 1 1 19 3  54 o 19 120.05  2.50762 264.492     15.0809  247.922     15.0476  86.589     155.357     20.6818     155.357     
1 1 1 19 3  55 o 6  22.3079 5.22372 11.8047     7.18657  4.58997     6.86466  20.293     25.0075     52.7219     25.0075     
1 1 1 19 3  56 o 13 143.538 2.52705 376.798     18.5899  355.738     17.7547  95.7763    293.471     5.25212     293.471     
1 1 1 19 3  57 f 0  188.697 2.68844 609.595     26.3351  657.135     24.3707  90.4732    315.139     0           0           
1 1 1 19 3  58 o 14 67.5183 3.03644 83.811      10.2252  79.2431     10.2105  19.0863    256.273     44.1893     76.2731     
1 1 1 19 3  59 f 0  86.4706 2.72387 132.062     12.3004  134.659     11.2091  67.8438    101.501     0           0           
1 1 1 19 3  60 o 15 143.053 2.71834 353.027     21.3973  376.33      17.1593  122.118    241.409     62.6377     241.409     
1 1 1 19 3  61 o 8  116.037 3.12588 241.396     21.3274  239.888     14.2531  88.7543    307.047     31.1299     307.047     
1 1 1 19 3  62 o 1  75.8559 3.0461  102.589     12.217   103.509     10.7925  49.151     278.716     5.27276     278.716     
1 1 1 19 3  63 o 10 119.877 2.64724 258.566     17.2198  254.383     14.4444  60.6451    222.016     33.2704     42.0164     
1 1 1 19 3  64 o 15 24.4812 5.11938 8.7353      7.32341  13.0593     6.3727   1.2687     253.916     16.1125     73.9165     
1 1 1 19 3  65 o 16 71.5376 3.24544 84.7382     11.4583  99.7769     11.6409  44.1964    302.172     0.396204    122.171     
1 1 1 19 3  66 o 19 127.101 2.80948 283.834     18.0789  294.805     17.6513  78.9025    25.2463     4.4843      205.246     
1 1 1 19 3  67 o 7  102.736 2.85777 184.756     14.0125  194.015     15.3515  60.7715    225.555     8.48285     45.5546     
1 1 1 19 3  68 o 14 23.611  5.59908 3.08921     8.4256   14.8839     8.31465  2.39585    145.325     3.45453     325.325     
1 1 1 19 3  69 o 14 74.7371 3.41508 114.042     11.589   88.9465     13.3766  45.1735    154.003     2.14517     334.003     
1 1 1 19 3  70 o 8  146.382 2.87884 376.847     19.9367  393.175     22.2363  109.717    78.2063     34.8408     78.2063     
1 1 1 19 3  71 o 2  83.0837 3.24509 116.683     13.2465  133.296     13.6485  65.6083    106.079     29.3368     106.079     
1 1 1 19 3  72 o 12 46.8587 4.58956 40.2652     10.2019  41.8779     10.7751  25.8732    171.971     3.38614     351.971     
1 1 1 19 3  73 o 6  41.9647 4.8387  34.1676     10.1234  32.6382     9.5281   23.5973    12.8504     1.37185     192.85      
1 1 1 19 3  74 o 18 38.5965 5.19289 21.3584     9.80999  36.9195     9.34876  14.4303    51.8244     16.2288     231.824     
1 1 1 19 3  75 o 16 24.4639 5.5757  2.63915     8.94254  17.5551     8.34209  9.04085    16.0709     0.475611    196.071     
1 1 1 19 3  76 o 18 26.1321 5.94998 16.6224     9.24729  9.7258      8.72922  11.0457    299.774     0.330616    119.774     
1 1 1 19 3  77 o 8  25.424  6.29372 14.0761     9.67556  9.85162     10.3089  8.99504    310.408     5.40736     130.408     
1 1 1 19 3  78 o 9  58.4736 4.42393 64.8783     12.5608  64.7747     12.959   33.1625    190.396     3.10512     10.3955     
1 1 1 19 3  79 o 2  22.9046 6.22581 5.27853     9.96921  11.0994     10.3492  3.7907     13.9676     12.7735     193.968     
1 1 1 19 3  80 o 14 22.2395 6.19686 4.28328     10.0578  9.82963     10.4421  2.75214    309.061     13.2528     129.061     
1 1 1 19 3  81 o 16 41.2887 6.41604 30.8282     12.9309  39.97       12.9496  23.4252    104.989     1.36943     104.989     
1 1 1 19 3  82 o 14 16.7211 5.42533 -1.47176    10.3964  -10.6283    10.6105  0.645911   175.163     1.95        355.163     
1 1 1 19 3  83 o 19 31.0378 8.00495 21.6172     18.6797  19.2389     13.8341  15.3515    353.828     0.487529    353.828     
1 1 1 19 3  84 o 3  24.5787 6.67605 -2.39682    12.1702  19.6976     13.0867  8.94222    315.996     1.53875     135.996     
1 1 1 19 3  85 o 17 36.9457 8.11554 24.9584     20.0207  39.1457     15.3274  21.4973    105.781     11.3827     105.781     
1 1 1 19 3  86 o 13 26.5069 7.6387  10.6457     18.9462  14.9718     13.7671  7.80099    236.519     2.48359     56.5188     
1 1 1 19 3  87 o 16 21.8379 6.92423 4.98528     17.9933  -0.118785   13.0447  1.97146    135.695     8.15642     315.695     
1 1 1 19 3  88 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 4  0  o 12 187.317 2.40801 622.362     22.5876  622.362     22.5876  148.766    6.98898e-06 42.9647     6.98898e-06 
1 1 1 19 4  1  o 6  320.226 3.12927 1802.24     51.1302  1832.85     49.2705  249.861    266.354     55.3148     266.354     
1 1 1 19 4  2  o 17 281.775 2.90775 1405.4      41.0645  1408.96     41.0556  132.643    331.364     129.014     151.363     
1 1 1 19 4  3  o 14 121.522 2.20875 258.635     13.661   264.961     13.2184  27.9612    246.197     11.9051     66.1973     
1 1 1 19 4  4  o 17 72.4334 2.32548 101.351     8.38632  85.3327     8.40264  26.5528    3.20406     94.54       3.20406     
1 1 1 19 4  5  f 0  852.375 7.01998 12861.8     305.347  12930       294.251  539.049    42.8076     0           0           
1 1 1 19 4  6  o 5  838.162 6.89803 12428       284.339  12510       295.081  620.304    255.828     25.6849     255.828     
1 1 1 19 4  7  f 0  508.004 4.34337 4531.82     110.559  4619.79     110.583  387.818    242.903     0           0           
1 1 1 19 4  8  o 2  488.632 4.24913 4243.13     104.046  4223.51     104.053  427.189    204.995     156.985     204.995     
1 1 1 19 4  9  o 7  407.7   3.74628 2956.52     77.949   2936.9      75.1184  290.674    273.5       0.932159    273.5       
1 1 1 19 4  10 o 1  605.402 5.1591  6514.68     153.589  6486.98     159.39   535.756    232.929     201.733     232.929     
1 1 1 19 4  11 o 9  87.1356 2.20875 137.59      9.62345  131.893     9.63188  6.04313    346.03      82.0602     346.03      
1 1 1 19 4  12 o 7  674.925 5.77967 8068.95     195.478  8096.07     195.497  486.049    323.183     1.51636     143.183     
1 1 1 19 4  13 o 16 250.214 2.7541  1100.45     33.8813  1118.88     35.1842  170.733    198.842     1.34206     18.8421     
1 1 1 19 4  14 f 0  659.531 5.83521 7787.89     192.862  7650.47     192.855  542.036    284.258     0           0           
1 1 1 19 4  15 o 10 353.364 3.49234 2254.62     63.0802  2173.09     60.6134  252.706    80.4116     6.29832     80.4115     
1 1 1 19 4  16 o 10 431.368 3.94365 3310.32     83.6491  3288.66     86.8152  363.756    59.4323     115.22      59.4323     
1 1 1 19 4  17 o 11 268.167 2.8293  1309.63     37.2942  1240.23     38.6798  101.383    200.637     174.371     20.6366     
1 1 1 19 4  18 o 6  331.194 3.16676 1944.11     52.5488  1944.97     52.5721  198.599    46.625      70.9533     226.625     
1 1 1 19 4  19 o 18 392.244 3.61189 2713.57     69.6744  2742.52     72.3114  327.31     202.749     100.2       202.749     
1 1 1 19 4  20 o 2  185.302 2.33766 627.017     21.6807  590.412     21.7196  124.639    11.081      4.70902     11.081      
1 1 1 19 4  21 o 10 120.305 2.19972 262.189     13.2121  251.245     13.2836  61.342     70.4465     10.294      70.4465     
1 1 1 19 4  22 o 5  408.496 3.72353 2955.01     77.6113  2963.58     74.8111  346.588    126.732     116.175     126.732     
1 1 1 19 4  23 o 11 459.237 4.32828 3732.92     99.6031  3750.19     99.6208  366.518    202.142     81.5743     202.142     
1 1 1 19 4  24 o 15 508.168 4.7067  4528.28     119.84   4637.65     119.874  392.401    17.4151     62.6369     17.4151     
1 1 1 19 4  25 o 13 389.029 3.84104 2612.9      74.8465  2757.13     74.8824  305.957    60.0412     64.3058     60.0412     
1 1 1 19 4  26 f 0  184.716 2.67915 608.122     24.7403  601.664     24.8596  101.82     330.61      0           0           
1 1 1 19 4  27 o 12 303.202 3.45547 1615.06     53.7123  1645.95     51.241   243.895    330.151     68.1959     330.151     
1 1 1 19 4  28 o 15 233.772 2.91003 979.065     33.2804  958.959     34.8655  173.067    10.5068     28.7877     10.5068     
1 1 1 19 4  29 o 17 399.626 3.83504 2838.16     75.2224  2828.48     78.3483  334.429    173.343     108.673     173.343     
1 1 1 19 4  30 o 12 256.585 2.89476 1177.1      37.9436  1157.72     36.4972  144.473    214.01      66.9306     34.0096     
1 1 1 19 4  31 o 4  161.562 2.47751 473.393     20.4209  452.24      19.6999  88.7689    291.242     37.6712     111.242     
1 1 1 19 4  32 o 3  474.618 4.4244  3955.91     105.189  4042.4      105.273  362.323    274.932     56.5764     274.932     
1 1 1 19 4  33 o 13 173.372 2.59008 528.28      22.4385  537.619     22.5684  61.4562    304.821     114.694     124.821     
1 1 1 19 4  34 o 13 27.3371 4.39873 11.1222     5.80083  16.6135     6.04429  26.3558    218.396     62.46       218.396     
1 1 1 19 4  35 o 2  31.6773 4.04346 19.7342     5.97082  17.0181     6.35956  58.173     339.49      141.782     339.49      
1 1 1 19 4  36 o 8  357.467 3.74439 2235.21     60.6171  2300.67     73.1211  228.358    208.7       41.5396     28.6999     
1 1 1 19 4  37 o 9  149.085 2.64026 387.731     19.263   400.876     20.1736  97.9035    244.267     0.651072    244.267     
1 1 1 19 4  38 o 1  24.6274 4.97806 7.37116     6.04176  14.7961     7.12758  60.3344    261.568     135.607     261.568     
1 1 1 19 4  39 o 16 216.317 2.93465 803.139     30.134   857.368     33.4879  177.746    36.0228     64.8577     36.0228     
1 1 1 19 4  40 o 10 132.903 3.04304 338.874     17.9664  289.465     21.9085  77.1754    314.076     16.5535     134.076     
1 1 1 19 4  41 o 7  182.267 2.83007 600.085     25.7772  578.595     25.9142  94.824     251.276     55.462      71.2755     
1 1 1 19 4  42 o 19 307.314 3.56545 1662.24     54.8363  1690.77     54.9834  236.818    66.5181     53.6031     66.5181     
1 1 1 19 4  43 o 18 236.407 3.20397 1009.06     36.8983  974.65      38.9467  147.481    128.64      25.5661     308.64      
1 1 1 19 4  44 o 11 90.7601 2.68149 152.429     10.8751  140.436     13.2314  43.393     330.093     16.287      150.093     
1 1 1 19 4  45 o 1  214.3   2.7771  797.598     27.7941  832.08      31.7951  141.716    342.417     4.37377     162.417     
1 1 1 19 4  46 o 19 321.563 3.39023 1796.17     49.963   1876.01     59.0979  303.797    54.0123     173.428     54.0123     
1 1 1 19 4  47 o 1  75.5389 2.76687 103.961     9.51519  99.1128     11.2396  31.0316    37.5024     7.24252     37.5024     
1 1 1 19 4  48 o 10 59.9014 3.06006 65.0912     8.72432  62.9847     9.4906   16.3365    139.549     8.94136     319.549     
1 1 1 19 4  49 o 8  245.216 2.93738 1040.02     33.0233  1095.47     39.0551  192.556    353.8       55.9312     353.8       
1 1 1 19 4  50 f 0  224.961 2.79562 856.789     30.165   941.137     32.8859  111.771    75.6965     0           0           
1 1 1 19 4  51 f 0  50.0773 3.50309 49.7186     8.23425  40.5618     8.93545  38.7348    118.814     0           0           
1 1 1 19 4  52 o 1  17.5775 4.96223 0.756809    6.41113  4.45847     6.89437  23.7327    281.791     54.2017     281.791     
1 1 1 19 4  53 o 6  156.844 2.58472 419.74      20.8401  454.406     19.7072  103.565    299.035     1.04527     299.036     
1 1 1 19 4  54 o 2  27.8119 5.32837 10.7478     7.90903  17.7055     7.59513  7.79071    325.468     27.5662     325.468     
1 1 1 19 4  55 o 10 32.4471 5.04311 19.8149     8.14443  19.3595     7.80848  8.94645    109.585     43.7508     109.585     
1 1 1 19 4  56 o 7  181.008 2.70749 559.175     25.5284  606.553     23.4288  137.049    67.8779     36.5549     67.8779     
1 1 1 19 4  57 o 19 27.9125 5.09921 11.4997     7.27242  17.5451     7.25894  5.43568    189.51      24.4613     189.51      
1 1 1 19 4  58 o 5  77.1849 2.75588 106.355     10.6121  106.291     10.6386  53.7111    305.987     17.8591     305.987     
1 1 1 19 4  59 o 12 58.0369 3.15867 62.4854     9.18743  58.4202     9.04114  13.8462    296.178     41.0186     116.178     
1 1 1 19 4  60 o 9  44.244  3.49935 30.375      6.97704  40.8611     8.28318  15.4127    137.355     11.1373     317.355     
1 1 1 19 4  61 o 17 23.2744 5.41519 9.29787     7.85366  9.55313     6.79588  1.31015    171.458     7.64059     171.458     
1 1 1 19 4  62 o 9  115.178 2.5677  251.838     15.5459  221.965     14.0711  65.5703    272.866     17.5315     92.8659     
1 1 1 19 4  63 o 2  98.724  2.69258 175.881     14.0823  172.507     12.4748  59.7771    52.0797     6.74089     232.08      
1 1 1 19 4  64 o 2  122.215 2.63374 280.389     17.0221  253.788     15.2112  89.326     235.727     22.0284     235.727     
1 1 1 19 4  65 o 3  41.935  4.04309 37.2041     8.33335  27.7861     8.09168  9.1639     72.3454     31.7726     252.345     
1 1 1 19 4  66 o 17 49.8262 3.50427 43.6249     9.08958  46.6543     8.09292  37.2287    177.524     21.2343     177.524     
1 1 1 19 4  67 o 3  93.0423 2.80969 164.63      13.9282  146.426     12.2233  54.3677    49.8489     8.80539     229.849     
1 1 1 19 4  68 o 3  129.078 3.36805 280.205     23.6607  321.795     19.1743  100.309    174.564     37.1411     174.564     
1 1 1 19 4  69 o 15 22.8125 4.93438 18.7332     7.75311  -10.9403    9.37801  2.70878    68.5713     12.5155     248.571     
1 1 1 19 4  70 o 3  91.3993 3.14703 153.808     14.1344  147.871     14.5901  68.309     266.81      23.0017     266.81      
1 1 1 19 4  71 o 14 45.1153 4.34752 36.3798     9.03349  39.4477     10.1139  20.1585    17.1911     13.3219     197.191     
1 1 1 19 4  72 o 8  25.2716 5.98928 13.7374     8.07382  8.71803     10.2969  8.01178    100.673     7.41951     280.673     
1 1 1 19 4  73 o 5  58.9312 3.90522 69.4663     10.6105  58.9104     11.9295  39.5817    169.922     7.97081     169.922     
1 1 1 19 4  74 o 17 53.4219 4.34641 43.7297     10.1355  64.2745     12.7407  42.6202    35.635      23.0476     35.635      
1 1 1 19 4  75 o 16 52.0051 4.84079 58.5947     10.4637  44.8928     13.2139  26.1652    42.6211     10.1131     222.621     
1 1 1 19 4  76 o 10 35.3113 6.22087 23.0003     10.024   28.031      11.9279  14.4009    239.097     11.113      59.0965     
1 1 1 19 4  77 o 14 70.7452 4.10153 87.7888     13.5732  99.9896     15.2684  48.0509    217.117     10.9442     217.117     
1 1 1 19 4  78 o 1  39.6439 6.17517 41.8129     11.251   22.9587     12.9597  24.9106    41.0581     7.47728     41.0581     
1 1 1 19 4  79 o 6  19.1049 5.75899 5.91867     9.3558   -5.6997     11.088   1.86377    30.5869     19.7885     30.5869     
1 1 1 19 4  80 o 9  32.0113 6.76574 29.9655     11.8363  11.3797     13.5575  10.4838    62.2988     13.4228     242.299     
1 1 1 19 4  81 o 13 61.2565 5.25448 71.0725     14.776   75.6471     16.7941  38.6885    327.797     5.42454     327.797     
1 1 1 19 4  82 o 12 41.8591 6.88222 44.928      13.8298  29.9874     14.8162  20.4864    188.077     6.36381     8.07705     
1 1 1 19 4  83 o 12 28.5797 7.21476 16.6268     12.4614  17.2287     13.6536  5.68055    226.201     19.2776     46.2006     
1 1 1 19 4  84 o 5  25.6401 7.15942 -1.8786     16.5596  19.0296     13.4269  9.06374    350.604     3.33401     170.604     
1 1 1 19 4  85 o 2  25.3213 7.48194 10.9334     18.1366  10.0995     13.676   7.13542    4.5865      5.24235     184.587     
1 1 1 19 4  86 o 3  23.0567 7.23876 -2.33873    18.5163  8.09259     15.6349  2.65761    47.9014     2.66481     227.901     
1 1 1 19 4  87 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 5  0  o 18 140.815 2.3464  351.953     16.5374  351.953     16.5374  19.2431    3.4185e-06  164.932     180         
1 1 1 19 5  1  o 15 348.191 3.23845 2128.5      57.5326  2169.61     55.4413  230.993    97.9645     32.539      277.965     
1 1 1 19 5  2  o 4  409.037 3.69576 2936.56     75.7546  2995.8      75.755   381.29     59.1887     183.925     59.1887     
1 1 1 19 5  3  o 14 273.67  2.82645 1326.68     38.7713  1328.2      38.7569  169.164    289.939     43.9512     109.939     
1 1 1 19 5  4  o 3  501.142 4.28028 4410.57     107.486  4496.05     107.499  358.278    179.322     5.12066     359.322     
1 1 1 19 5  5  o 1  667.367 5.77511 8006.15     185.463  7799.49     200.321  494.777    139.57      23.0853     139.57      
1 1 1 19 5  6  f 0  368.862 3.46252 2421.87     65.1854  2402.05     62.8121  290.858    46.9406     0           0           
1 1 1 19 5  7  o 16 505.782 4.44173 4520.24     110.481  4552.75     114.661  336.786    0.0205949   55.2504     180.021     
1 1 1 19 5  8  o 14 491.845 4.26926 4309.96     105.226  4269.52     105.233  366.147    39.6486     25.2763     39.6486     
1 1 1 19 5  9  o 8  228.218 2.62437 915.241     31.1348  931.012     28.8292  83.4404    38.0024     151.108     218.002     
1 1 1 19 5  10 o 14 297.311 2.99507 1566.7      43.7831  1566.97     45.4517  155.534    63.0377     109.425     243.038     
1 1 1 19 5  11 o 7  196.596 2.33532 681.797     23.0031  688.173     23.0128  42.4842    166.994     186.894     346.994     
1 1 1 19 5  12 f 0  430.378 3.7643  3273.22     81.1783  3295.09     81.1979  399.304    170.968     0           0           
1 1 1 19 5  13 o 18 678.792 5.57879 8199.63     189.77   8154.07     189.778  580.404    7.13829     181.663     7.13829     
1 1 1 19 5  14 o 8  110.46  2.36265 216.271     13.0691  216.624     13.0582  11.0373    69.9469     111.681     249.947     
1 1 1 19 5  15 o 15 389.051 3.70404 2695.34     72.2045  2672.4      72.2296  263.585    333.012     27.7379     153.012     
1 1 1 19 5  16 o 17 579.688 5.07062 5977.91     147.298  5947.64     147.31   433.912    148.531     33.9739     148.531     
1 1 1 19 5  17 o 18 486.391 4.28159 4194.11     102.413  4198.44     106.281  364.161    96.9323     31.4567     96.9323     
1 1 1 19 5  18 f 0  125.363 2.26011 281.686     13.8923  275.609     14.4788  40.1297    186.542     0           0           
1 1 1 19 5  19 o 19 519.861 4.78035 4745.49     124.526  4845.93     124.543  444.966    15.3838     146.788     15.3838     
1 1 1 19 5  20 o 19 329.832 3.35151 1934.42     55.3975  1923.62     55.398   222.907    178.366     20.1188     358.366     
1 1 1 19 5  21 o 4  375.541 3.6948  2507.16     69.5317  2495.33     69.5397  307.307    315.706     84.1077     315.706     
1 1 1 19 5  22 o 9  118.648 2.40144 250.413     14.5591  249.06      13.9644  14.9441    148.501     121.634     328.501     
1 1 1 19 5  23 o 1  223.285 2.87318 873.925     32.1764  893.976     32.1201  36.3678    52.4266     239.609     232.427     
1 1 1 19 5  24 o 1  237.652 3.02033 978.606     36.7515  1024.53     35.121   157.461    270.923     11.9893     90.9232     
1 1 1 19 5  25 o 16 378.239 3.64234 2517.6      67.6235  2557.83     70.4487  267.364    338.65      0.890915    338.65      
1 1 1 19 5  26 o 6  331.78  3.32298 1929.16     55.2221  1975.48     55.2743  243.719    272.615     22.3157     272.615     
1 1 1 19 5  27 o 5  292.262 3.05784 1517.82     44.7667  1511.59     44.8062  257.757    182.238     112.037     182.238     
1 1 1 19 5  28 o 16 35.8263 3.57603 22.1831     6.09812  24.2764     6.38585  53.9906    23.6232     130.976     23.6232     
1 1 1 19 5  29 o 15 262.822 2.98525 1191.73     40.0139  1258.59     38.5484  210.554    6.86248     57.8937     6.86249     
1 1 1 19 5  30 o 8  396.965 3.75234 2743.51     73.0947  2848.94     76.2066  341.217    120.669     124.302     120.669     
1 1 1 19 5  31 o 13 163.73  2.39157 470.319     18.7676  480.227     20.4585  125.93     300.626     35.0921     300.626     
1 1 1 19 5  32 o 3  98.8267 2.37837 170.923     10.9069  175.803     12.5787  58.0709    65.2149     4.25038     65.2149     
1 1 1 19 5  33 f 0  126.087 2.63755 271.812     15.5755  292.68      17.713   93.1235    210.94      0           0           
1 1 1 19 5  34 o 5  215.878 2.89229 815.504     31.2833  837.626     31.2932  132.611    280.436     31.9282     100.436     
1 1 1 19 5  35 o 9  137.971 2.61028 347.591     17.602   328.158     18.4178  115.944    116.369     78.5238     116.369     
1 1 1 19 5  36 o 19 251.747 3.33381 1140.83     42.0512  1108.3      42.0613  170.635    67.9613     5.78432     247.961     
1 1 1 19 5  37 o 18 180.837 2.66922 572.268     24.177   587.705     24.1996  130.442    161.76      18.8445     161.76      
1 1 1 19 5  38 o 5  156.816 2.48611 431.789     19.5245  440.387     19.5496  117.078    146.421     29.8054     146.421     
1 1 1 19 5  39 o 7  51.0066 3.10113 44.2282     7.70596  48.8267     7.9905   2.88803    221.72      32.8495     221.72      
1 1 1 19 5  40 o 3  283.583 3.04753 1390.3      40.5621  1463.8      46.0049  174.91     346.749     40.4197     166.749     
1 1 1 19 5  41 o 5  101.781 2.47778 189.691     12.1203  178.266     13.0616  58.3421    112.124     1.42765     292.124     
1 1 1 19 5  42 o 17 187.955 2.66338 625.039     24.3549  628.197     25.8016  121.672    256.25      8.55736     76.2498     
1 1 1 19 5  43 o 15 170.55  2.86113 522.609     21.6318  509.892     26.8944  153.664    358.428     89.856      358.428     
1 1 1 19 5  44 f 0  381.514 4.13735 2533.43     74.9838  2640.1      83.1533  252.66     127.494     0           0           
1 1 1 19 5  45 o 9  378.76  4.07109 2457.15     73.2755  2643.69     81.2805  319.362    205.714     121.067     205.714     
1 1 1 19 5  46 o 8  100.865 2.71259 184.134     12.935   177.462     14.3687  50.8374    266.363     23.5815     86.3626     
1 1 1 19 5  47 o 6  80.2538 2.9183  119.09      10.992   110.257     12.2987  25.7605    247.636     45.9396     67.6359     
1 1 1 19 5  48 o 7  21.5711 5.217   11.2209     6.61009  1.38812     8.1356   5.34139    122.799     12.8448     122.799     
1 1 1 19 5  49 o 18 291.774 3.3222  1465.7      48.5158  1560.54     48.6053  175.723    152.56      44.3058     332.56      
1 1 1 19 5  50 o 4  246.516 2.94047 1056.41     35.5007  1102.8      37.1562  164.347    278.028     3.51547     98.0277     
1 1 1 19 5  51 o 4  180.932 2.75636 557.143     24.4058  606.335     25.5819  101.184    151.01      39.2278     331.01      
1 1 1 19 5  52 o 6  135.701 2.63712 322.753     17.4935  331.959     18.3396  112.767    211.164     51.151      211.164     
1 1 1 19 5  53 o 1  97.319  2.70299 158.596     12.5324  178.823     13.7915  81.9224    173.909     52.4395     173.909     
1 1 1 19 5  54 o 13 43.4993 4.24004 29.4605     8.80408  39.7634     9.0459   7.73847    150.711     23.5714     330.711     
1 1 1 19 5  55 o 6  156.329 2.67175 416.187     20.0595  453.332     21.8125  119.275    68.0248     34.024      68.0248     
1 1 1 19 5  56 o 4  254.204 3.03654 1124.43     37.9038  1177.65     39.4674  172.77     194.236     7.78475     194.236     
1 1 1 19 5  57 o 4  146.639 2.53972 366.175     17.9438  399.263     19.3918  62.4947    51.4566     67.4383     231.457     
1 1 1 19 5  58 o 16 180.968 2.56414 553.735     22.8473  612.798     23.6504  127.995    11.8637     19.0391     11.8637     
1 1 1 19 5  59 o 17 48.6832 3.41152 42.0294     8.10643  43.4963     8.32161  18.5965    111.337     14.7635     291.337     
1 1 1 19 5  60 o 19 100.311 2.53137 171.706     11.9927  187.347     13.4206  61.9322    69.6224     4.36128     249.622     
1 1 1 19 5  61 o 2  81.4542 2.96528 124.811     12.6854  112.912     11.4492  64.1194    169.547     26.6496     169.547     
1 1 1 19 5  62 o 5  42.9958 4.09714 32.0753     9.07256  35.703      7.99397  20.3099    224.008     8.86189     44.0075     
1 1 1 19 5  63 o 16 20.8356 5.2103  5.30175     6.85309  8.51742     6.84577  8.45271    20.4014     36.1386     20.4014     
1 1 1 19 5  64 o 2  122.906 2.47333 278.895     15.571   260.962     14.8689  83.8372    21.3853     9.64072     21.3853     
1 1 1 19 5  65 o 1  35.9746 4.35415 27.1483     7.92089  21.2654     7.21078  11.0973    231.234     18.5818     51.2343     
1 1 1 19 5  66 o 1  82.8041 2.6922  129.926     11.7155  116.261     10.5764  32.9929    67.0759     39.1363     247.076     
1 1 1 19 5  67 o 4  88.3028 2.5562  144.907     11.8785  134.698     10.6976  48.2325    288.718     15.2017     108.718     
1 1 1 19 5  68 o 1  54.9011 4.12946 78.22       11.2893  36.4615     10.0923  27.8769    276.402     11.1447     96.4018     
1 1 1 19 5  69 o 2  37.5327 4.6618  30.8268     9.65547  22.5919     7.29048  1.51936    205.869     41.8075     25.8692     
1 1 1 19 5  70 o 11 27.6164 5.33143 17.5982     8.98922  12.0415     6.21517  7.69573    73.0828     12.9593     253.083     
1 1 1 19 5  71 o 18 56.9234 3.96594 52.538      11.2857  67.266      10.8032  29.4926    282.537     10.6787     102.537     
1 1 1 19 5  72 o 17 120.081 3.03568 272.481     18.8454  249.628     17.6385  85.5633    3.50166     20.5754     3.50166     
1 1 1 19 5  73 o 8  21.0107 5.628   8.27787     7.84837  4.51421     8.63226  3.32106    229.271     12.546      49.2711     
1 1 1 19 5  74 o 3  78.9153 3.35082 109.365     13.0278  118.75      13.3473  54.7012    214.719     12.3391     214.719     
1 1 1 19 5  75 f 0  36.1243 5.54224 25.8833     9.51928  26.0318     9.96906  20.2544    206.433     0           0           
1 1 1 19 5  76 o 9  37.431  5.39172 30.6557     9.3974   25.0053     10.1161  20.1731    62.5422     1.66679     242.542     
1 1 1 19 5  77 f 0  17.2851 5.40148 2.13795     8.98838  -6.66278    9.93779  3.5017     351.826     0           0           
1 1 1 19 5  78 o 6  72.5779 4.05737 100.831     14.2533  97.0564     14.9866  47.2403    261.333     7.46879     261.333     
1 1 1 19 5  79 o 6  40.49   7.05422 41.1084     16.0287  29.4853     12.4741  23.1262    129.764     2.13652     129.764     
1 1 1 19 5  80 o 14 37.3923 7.43659 35.3317     16.1608  25.9181     12.9128  24.0834    117.825     11.3793     117.825     
1 1 1 19 5  81 o 6  63.6581 5.19328 72.0962     15.5345  86.7345     16.9843  37.9833    100.932     0.582795    100.932     
1 1 1 19 5  82 o 14 36.3231 7.1521  31.6314     12.7581  26.0846     14.5244  21.4604    46.6097     4.6234      46.6098     
1 1 1 19 5  83 o 7  22.0876 6.55453 8.46579     11.4951  0.956964    13.557   5.59889    333.626     2.10624     153.626     
1 1 1 19 5  84 o 15 48.5324 8.16095 48.2901     20.3322  64.6177     19.1506  30.007     210.626     6.58339     210.626     
1 1 1 19 5  85 o 17 20.2662 6.61771 -10.688     17.0811  0.432938    14.9191  1.29457    347.168     3.79388     167.168     
1 1 1 19 5  86 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 6  0  o 15 625.012 5.63397 6930.12     176.402  6930.12     176.402  365.286    4.7437e-06  183.235     180         
1 1 1 19 6  1  o 3  523.424 4.60876 4836.72     120.893  4881.96     120.889  460.755    234.781     167.238     234.781     
1 1 1 19 6  2  o 9  154.918 2.3145  416.947     17.9533  433.812     17.9796  78.041     211.345     41.5635     31.3453     
1 1 1 19 6  3  o 1  270.979 2.85505 1285.21     38.7744  1318.01     38.7636  210.768    94.3616     45.0613     94.3616     
1 1 1 19 6  4  o 5  618.578 5.16912 6759.45     160.235  6817.92     160.243  370.971    256.63      156.062     76.6295     
1 1 1 19 6  5  o 3  210.269 2.52098 791.628     26.5599  775.656     26.5676  103.376    284.162     83.3101     104.162     
1 1 1 19 6  6  o 7  184.888 2.48328 615.694     23.4227  596.102     22.5966  125.809    184.655     9.67216     184.655     
1 1 1 19 6  7  o 16 103.628 2.25921 193.997     11.9187  187.039     11.5195  29.0663    217.601     15.8383     37.6012     
1 1 1 19 6  8  o 18 265.459 2.87039 1258.34     37.4543  1239.91     38.891   166.822    216.582     39.0819     36.5824     
1 1 1 19 6  9  o 19 390.37  3.64395 2698.97     72.5911  2704.99     69.9553  314.333    17.7223     71.3038     17.7222     
1 1 1 19 6  10 o 2  554.994 4.77786 5467.03     130.397  5461.79     135.328  395.838    227.995     10.4803     47.9955     
1 1 1 19 6  11 o 11 79.5773 2.30249 110.26      9.15862  114.605     9.1645   1.57598    116.507     70.9712     116.507     
1 1 1 19 6  12 o 16 448.223 3.97451 3559.36     89.2689  3566.49     89.2844  285.615    316.407     73.9729     136.407     
1 1 1 19 6  13 o 10 194.009 2.39677 670.541     23.2903  663.725     23.3149  153.656    189.881     52.0045     189.881     
1 1 1 19 6  14 o 6  256.366 3.05307 1155.45     38.3684  1174.94     40.0745  79.5534    204.296     204.544     24.2959     
1 1 1 19 6  15 f 0  420.148 4.05411 3140.78     88.8415  3121.26     81.7539  364.057    12.3322     0           0           
1 1 1 19 6  16 o 2  433.45  4.28397 3340.53     93.0535  3325.42     93.0588  266.284    292.576     89.5149     112.576     
1 1 1 19 6  17 o 1  532.242 5.06838 5115.71     135.18   4941.48     135.166  397.929    219.514     30.7914     219.514     
1 1 1 19 6  18 f 0  271.635 3.14087 1323.53     42.7504  1293.1      42.7568  268.917    98.8171     0           0           
1 1 1 19 6  19 o 18 235.459 3.00519 955.882     34.6459  1010.44     36.2816  169.964    206.114     15.5934     206.114     
1 1 1 19 6  20 o 6  481.43  4.68738 4085.2      113.08   4142.26     113.095  369.175    325.059     49.9897     325.059     
1 1 1 19 6  21 f 0  182.956 2.64254 599.679     23.0043  587.175     25.3682  176.937    135.63      0           0           
1 1 1 19 6  22 o 11 222.725 2.59558 902.47      28.9295  856.684     28.9961  208.686    4.87218     127.776     4.87218     
1 1 1 19 6  23 o 18 345.57  3.42641 2114.84     59.3233  2121.22     59.3534  272.205    288.1       57.7218     288.1       
1 1 1 19 6  24 o 18 99.7512 2.27589 179.923     11.3098  173.238     11.4093  3.03317    281.569     130.623     281.569     
1 1 1 19 6  25 o 10 262.399 2.83553 1213.33     36.571   1228.39     37.997   145.862    93.1507     75.8814     273.151     
1 1 1 19 6  26 o 14 91.615  2.30696 153.31      10.3032  144.705     10.8182  30.3163    340.174     37.2131     160.174     
1 1 1 19 6  27 o 18 426.171 3.80166 3215.51     81.1669  3229.57     81.2187  280.684    191.614     43.8729     11.6141     
1 1 1 19 6  28 o 18 408.124 3.68693 2936.64     75.3869  2973.99     75.4273  317.718    118.378     57.6362     118.378     
1 1 1 19 6  29 o 14 217.319 2.58898 833.799     27.6281  840.958     28.757   156.812    59.4406     13.1288     59.4406     
1 1 1 19 6  30 o 9  348.709 3.54351 2130.02     61.9055  2185.08     61.9347  271.51     40.735      51.8147     40.735      
1 1 1 19 6  31 f 0  113.259 2.4119  228.398     13.3413  226.874     13.9964  124.347    109.419     0           0           
1 1 1 19 6  32 o 10 513.799 4.79999 4590.61     120.903  4790.7      126.297  387.764    193.299     49.2614     193.299     
1 1 1 19 6  33 o 16 244.775 3.06971 1053.41     38.5067  1072.23     36.7657  178.433    255.296     18.0553     255.296     
1 1 1 19 6  34 o 12 149.129 2.51069 384.716     18.3276  404.123     19.2025  60.4935    59.9052     80.4482     239.905     
1 1 1 19 6  35 o 19 98.6784 2.79024 172.761     12.7141  173.199     14.7519  46.4109    225.134     26.4106     45.1337     
1 1 1 19 6  36 o 17 237.953 2.8939  993.587     33.654   1015.22     35.3588  187.808    208.794     49.6991     208.794     
1 1 1 19 6  37 o 12 218.74  2.72311 830.659     28.4835  866.822     31.2035  141.567    0.374907    16.391      180.375     
1 1 1 19 6  38 o 11 117.375 2.46079 239.716     13.6908  249.388     15.2122  48.5183    237.299     54.7508     57.2994     
1 1 1 19 6  39 o 16 233.22  2.92714 912.352     34.0504  1019.01     34.3073  147.483    132.477     24.4456     312.477     
1 1 1 19 6  40 f 0  45.0663 3.79024 34.7991     7.96998  38.385      8.82036  33.7906    204.923     0           0           
1 1 1 19 6  41 o 6  271.37  3.17364 1298.23     43.0397  1315.56     43.2798  199.721    337.781     27.7344     337.781     
1 1 1 19 6  42 o 9  243.264 3.01542 1019.79     36.5525  1080.87     36.9566  140.555    146.894     51.5915     326.894     
1 1 1 19 6  43 o 12 274.177 3.16341 1312.01     44.288   1356.73     42.5889  177.948    224.009     19.3744     44.0093     
1 1 1 19 6  44 o 6  193.817 2.74859 659.691     27.1271  673.423     26.2484  149.744    344.546     40.4815     344.546     
1 1 1 19 6  45 o 16 138.121 2.61116 341.35      17.5425  336.132     18.5501  103.994    49.8878     30.0482     49.8879     
1 1 1 19 6  46 o 4  154.424 2.74577 441.57      21.099   405.591     21.3392  96.9202    139.84      11.3682     319.84      
1 1 1 19 6  47 o 8  227.683 3.00301 941.406     33.3381  899.922     35.1148  101.272    13.7497     107.162     193.75      
1 1 1 19 6  48 o 6  96.9463 2.97869 167.791     12.688   166.688     15.9797  62.3651    324.431     48.3769     324.431     
1 1 1 19 6  49 o 13 303.318 3.61562 1642.15     52.088   1631.08     57.6669  243.576    310.05      75.9299     310.05      
1 1 1 19 6  50 o 15 218.866 2.8799  844.68      30.0352  857.575     33.0872  181.711    2.08181     70.1977     2.08181     
1 1 1 19 6  51 o 6  299.095 3.37565 1606.17     47.1234  1577.34     53.7839  273.762    1.26249     144.995     1.26249     
1 1 1 19 6  52 o 11 180.863 2.68597 572.528     23.231   590.153     25.438   138.633    49.1374     37.1569     49.1374     
1 1 1 19 6  53 o 7  36.0064 4.79874 30.6543     7.57931  17.791      8.80225  1.60312    161.428     15.0128     341.428     
1 1 1 19 6  54 o 1  131.496 2.57054 320.58      16.1084  294.964     17.6171  63.3914    312.811     46.3705     132.811     
1 1 1 19 6  55 o 16 125.5   2.56801 284.148     16.2429  276.58      16.0252  81.8356    276.414     0.417408    276.414     
1 1 1 19 6  56 o 19 87.4123 2.64287 142.619     11.9875  129.993     11.119   35.4725    48.7631     40.4085     228.763     
1 1 1 19 6  57 o 1  122.181 2.58049 257.219     15.2671  274.853     16.3023  87.754     197.238     18.4009     197.238     
1 1 1 19 6  58 o 8  78.3564 2.72448 101.701     10.3163  117.903     11.0108  32.6326    158.763     33.4658     338.763     
1 1 1 19 6  59 o 15 137.982 2.41459 336.728     16.0997  341.411     17.2654  80.5021    307.953     19.3473     127.953     
1 1 1 19 6  60 f 0  68.8895 2.88699 83.1918     9.67103  86.845      10.1743  23.8086    253.363     0           0           
1 1 1 19 6  61 o 18 76.6264 2.82342 96.2419     10.8959  114.433     10.6221  31.8419    81.9554     34.5742     261.955     
1 1 1 19 6  62 o 2  51.7458 3.31208 58.3529     8.36152  39.3681     8.3426   17.6965    294.027     28.6798     114.027     
1 1 1 19 6  63 o 4  15.8017 4.64685 -3.79508    6.31829  4.1894      6.42885  5.53189    43.6653     18.528      43.6653     
1 1 1 19 6  64 o 5  62.6675 3.06778 70.2596     9.99878  71.3103     9.12085  39.5506    251.408     1.62881     251.408     
1 1 1 19 6  65 o 4  102.151 2.73025 192.622     15.0072  181.718     12.8642  64.1891    307.013     2.22279     127.013     
1 1 1 19 6  66 o 8  65.2219 3.05113 76.497      10.3413  77.0234     9.467    23.86      132.387     34.3182     312.387     
1 1 1 19 6  67 o 17 89.837  2.58476 150.431     12.1481  139.197     11.0806  50.2257    88.0606     13.4196     268.061     
1 1 1 19 6  68 o 6  26.3569 5.05104 18.0976     7.26621  8.40806     6.88833  0.570781   113.718     29.9028     113.718     
1 1 1 19 6  69 o 6  85.4774 2.83162 135.631     13.2921  127.62      10.8341  60.9464    183.902     14.9137     183.902     
1 1 1 19 6  70 o 9  26.6182 5.6361  13.9401     9.69619  13.023      6.63908  4.68336    165.852     19.4044     345.852     
1 1 1 19 6  71 f 0  22.5988 5.51584 5.01258     9.34039  11.2895     6.66307  24.9778    123.487     0           0           
1 1 1 19 6  72 o 2  26.8239 5.63151 6.99656     10.3963  18.6516     7.41837  6.01697    73.8636     17.4213     253.864     
1 1 1 19 6  73 o 7  82.7406 3.80772 130.878     17.3424  122.042     13.9599  45.564     27.4404     11.7621     207.44      
1 1 1 19 6  74 o 15 42.1568 5.66964 38.9906     12.675   31.6896     10.4319  31.8035    291.005     18.2203     291.005     
1 1 1 19 6  75 o 14 59.4808 4.5193  68.9299     14.3701  65.5287     12.0714  38.081     44.2829     4.47963     44.2829     
1 1 1 19 6  76 o 14 29.1466 6.1878  23.3772     10.2764  10.8828     10.0469  14.1123    343.838     2.8466      343.838     
1 1 1 19 6  77 o 14 27.6848 6.62745 22.0359     11.3237  6.47763     12.1834  10.946     33.5065     0.8955      33.5065     
1 1 1 19 6  78 o 4  99.0886 3.69834 168.481     17.1901  197.13      19.4324  57.0346    72.7302     6.80458     252.73      
1 1 1 19 6  79 o 4  35.5236 6.78438 20.8538     10.996   33.3156     13.8856  22.0745    224.297     10.6916     224.298     
1 1 1 19 6  80 o 18 32.3955 7.03398 23.3991     10.984   20.8937     14.4519  16.9388    234.449     0.0946166   54.4497     
1 1 1 19 6  81 o 8  17.1523 5.57189 -4.81983    9.07679  -4.14706    12.5116  1.34896    341.648     7.95829     161.648     
1 1 1 19 6  82 o 16 24.5543 6.62615 -2.94294    12.8543  19.3228     12.4028  9.15713    311.619     0.125709    131.619     
1 1 1 19 6  83 o 13 24.0747 7.1902  13.4886     17.1693  3.31963     12.4205  1.11847    139.741     0.0952883   139.741     
1 1 1 19 6  84 f 0  20.8453 6.73342 1.79248     16.7611  -5.28496    14.4832  2.55695    166.159     0           0           
1 1 1 19 6  85 o 2  31.8559 8.30181 18.108      18.9902  31.9583     17.2421  12.8091    234.864     1.75469     54.8645     
1 1 1 19 6  86 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 7  0  o 2  130.284 2.59704 301.518     16.9257  301.518     16.9257  79.766     180         19.5782     8.63035e-06 
1 1 1 19 7  1  o 18 442.548 3.94932 3479.15     89.1968  3467.3      85.954   265.353    110.592     109.68      290.592     
1 1 1 19 7  2  o 9  305.25  3.07165 1655.8      47.8515  1647.87     46.1125  186.935    274.99      61.772      94.9899     
1 1 1 19 7  3  o 14 277.873 2.86891 1375.39     39.9527  1362.1      39.9478  244.218    267.371     101.235     267.371     
1 1 1 19 7  4  o 19 543.895 4.62254 5252.57     125.994  5243.53     125.998  344.546    93.8092     100.579     273.809     
1 1 1 19 7  5  o 1  58.5627 2.62414 63.4159     7.77194  58.6992     7.54979  30.5025    268.652     105.077     268.652     
1 1 1 19 7  6  o 16 200.442 2.55069 724.036     25.6048  700.341     25.6326  107.145    332.228     63.0026     152.228     
1 1 1 19 7  7  o 11 615.323 5.15437 6730.67     158.939  6708.34     158.945  508.885    150.365     125.117     150.365     
1 1 1 19 7  8  o 12 592.498 5.08796 6237.12     153.846  6223.2      148.256  474.374    13.5611     89.7813     13.5611     
1 1 1 19 7  9  o 10 130.896 2.47285 308.89      16.5566  298.981     15.8575  75.2363    325.144     3.5904      145.144     
1 1 1 19 7  10 o 2  124.41  2.36638 277.033     14.4524  272.049     15.0166  53.9252    97.6731     45.2006     277.673     
1 1 1 19 7  11 o 6  395.175 3.9918  2769.8      80.7413  2769.97     77.3277  229.63     157.739     109.675     337.739     
1 1 1 19 7  12 o 11 471.774 4.75765 3903.66     109.794  3996.04     115.159  401.945    105.749     125.332     105.749     
1 1 1 19 7  13 o 8  338.541 3.78938 2050.79     60.9632  2014.79     67.3935  276.182    329.189     71.624      329.189     
1 1 1 19 7  14 o 19 85.1536 2.69292 122.514     11.5665  135.246     11.3235  3.22026    205.715     99.79       205.715     
1 1 1 19 7  15 o 13 166.364 2.67689 501.158     22.8943  480.253     21.7434  55.7591    155.746     115.461     335.746     
1 1 1 19 7  16 o 2  229.883 2.96412 956.936     34.9608  917.225     33.3386  168.489    62.9236     19.9741     62.9236     
1 1 1 19 7  17 o 19 280.166 3.17518 1396.33     43.6253  1387.42     45.5093  203.269    15.5603     12.8378     15.5603     
1 1 1 19 7  18 o 3  246.009 3.03774 1088.09     37.4714  1058.26     37.4255  173.429    158.845     4.76123     158.845     
1 1 1 19 7  19 o 2  79.2584 2.32146 113.484     8.98775  109.622     9.39965  7.6684     291.648     46.7752     111.648     
1 1 1 19 7  20 o 15 32.3576 3.7648  19.806      5.89207  18.332      5.88803  65.5118    6.46454     148.762     6.46454     
1 1 1 19 7  21 f 0  344.959 3.33324 2115.78     56.5288  2105.22     58.6907  164.24     191.018     0           0           
1 1 1 19 7  22 o 7  225.638 2.68563 897.285     30.3281  908.063     30.4079  219.989    213.676     142.887     213.676     
1 1 1 19 7  23 o 11 365.769 3.47492 2359.05     62.4857  2387.31     64.8962  272.488    80.224      25.4148     80.2239     
1 1 1 19 7  24 o 5  261.863 2.77813 1223.96     35.7266  1207.82     37.1634  124.728    238.268     120.261     58.2679     
1 1 1 19 7  25 o 4  204.303 2.59082 734.756     25.4364  745.344     27.5864  165.664    302.553     52.5957     302.553     
1 1 1 19 7  26 o 4  196.996 2.73329 659.784     26.3943  717.059     27.5745  139.739    8.66797     8.24354     8.66796     
1 1 1 19 7  27 f 0  626.556 5.63299 6884.67     172.991  7074.94     180.749  460.913    338.438     0           0           
1 1 1 19 7  28 o 19 268.722 3.18532 1253.92     42.8847  1308.19     42.8933  188.053    284.299     1.6978      104.299     
1 1 1 19 7  29 o 6  320.726 3.4941  1828.59     56.1584  1821.71     56.1621  294.379    232.153     138.773     232.153     
1 1 1 19 7  30 o 6  101.031 2.44148 185.439     12.6443  176.992     12.0438  57.36      291.722     6.01669     111.722     
1 1 1 19 7  31 o 5  461.219 4.53574 3701.5      104.801  3856.55     104.841  364.621    6.74509     76.5465     6.74509     
1 1 1 19 7  32 o 18 66.0463 2.70968 82.0871     9.03858  73.2803     8.81083  12.1588    355.64      35.1609     175.64      
1 1 1 19 7  33 o 12 345.439 3.55563 2073.04     60.1312  2163.03     62.9811  239.213    173.787     6.69555     353.787     
1 1 1 19 7  34 f 0  256.095 3.10522 1148.07     38.8838  1179.17     40.818   210.798    237.604     0           0           
1 1 1 19 7  35 o 9  194.055 2.63886 653.949     25.5064  681.937     25.816   141.774    329.772     19.9816     329.772     
1 1 1 19 7  36 o 2  457.602 4.26297 3647.79     97.6841  3792.85     97.8103  310.141    345.69      21.9947     165.69      
1 1 1 19 7  37 o 10 137.374 2.53415 327.55      16.8818  342.363     17.981   102.418    119.298     29.9888     119.298     
1 1 1 19 7  38 o 18 362.332 3.46748 2298.98     64.1141  2362.07     61.7476  242.05     4.32162     20.6526     184.322     
1 1 1 19 7  39 o 3  92.9151 2.57617 153.799     12.3826  152.92      11.5495  53.6587    67.5927     16.5614     67.5927     
1 1 1 19 7  40 o 2  185.157 2.62681 593.879     24.7346  622.529     23.9797  92.6837    157.838     66.459      337.838     
1 1 1 19 7  41 o 11 109.493 2.56713 207.374     14.1701  218.486     13.9493  68.5691    305.185     2.41684     305.185     
1 1 1 19 7  42 o 4  323.372 3.45892 1829.89     54.8351  1884.07     57.2721  238.248    286.974     30.9312     286.974     
1 1 1 19 7  43 o 2  51.2478 3.29864 42.2735     8.35395  52.0211     8.32063  3.44974    116.578     29.7144     296.578     
1 1 1 19 7  44 o 6  29.2    4.86664 14.0986     6.83417  17.5457     7.19906  11.7834    121.982     33.1555     121.982     
1 1 1 19 7  45 o 16 99.65   2.54069 167.09      12.4587  186.048     12.8665  65.7017    10.186      7.79474     10.186      
1 1 1 19 7  46 o 15 124.792 2.41811 269.774     14.9144  283.402     15.3022  81.6672    58.2034     0.499029    238.203     
1 1 1 19 7  47 o 8  131.334 2.69717 318.734     16.606   294.51      18.6925  98.8926    145.645     26.062      145.645     
1 1 1 19 7  48 o 10 109.456 2.54604 217.929     13.3165  208.014     14.5164  70.4114    116.946     0.513427    296.946     
1 1 1 19 7  49 o 2  342.213 3.57056 2085.58     59.6515  2082.86     62.7739  278.02     125.081     90.4696     125.081     
1 1 1 19 7  50 o 11 360.113 3.56598 2314.66     60.3635  2303.29     68.0893  299.842    197.736     110.749     197.736     
1 1 1 19 7  51 o 19 179.064 2.55616 569.106     22.3924  570.287     23.472   123.588    249.252     7.80636     249.252     
1 1 1 19 7  52 o 7  77.748  2.79998 105.713     10.5798  109.861     11.1676  36.7327    230.867     23.7303     50.867      
1 1 1 19 7  53 o 13 149.529 2.58126 400.502     19.2635  394.616     19.4196  139.557    67.6383     85.039      67.6383     
1 1 1 19 7  54 o 5  86.6232 2.71029 134.483     11.3647  133.088     12.0921  53.5069    116.309     1.6579      296.308     
1 1 1 19 7  55 o 12 117.228 2.65352 241.893     14.982   247.848     16.1458  78.7971    193.203     5.77566     193.203     
1 1 1 19 7  56 o 6  174.175 2.66697 539.185     23.8427  541.297     22.6986  138.978    263.053     48.8884     263.053     
1 1 1 19 7  57 o 4  175.191 2.70634 537.621     23.2832  556.195     24.2392  155.176    210.813     80.7569     210.813     
1 1 1 19 7  58 o 11 113.708 2.51824 237.861     14.7316  223.307     13.936   71.7466    144.965     4.47108     324.965     
1 1 1 19 7  59 o 2  106.962 2.48911 201.123     13.3379  207.057     13.3078  87.8696    127.938     37.6122     127.938     
1 1 1 19 7  60 o 6  119.085 2.50401 243.019     14.96    263.36      14.8715  93.353     25.0501     31.9326     25.0501     
1 1 1 19 7  61 o 7  41.7702 4.39093 33.8582     9.19699  30.6267     8.63023  21.3289    121.82      4.99954     301.82      
1 1 1 19 7  62 o 1  100.277 2.59991 168.038     12.9655  192.144     13.0833  67.3268    325.016     5.40281     325.016     
1 1 1 19 7  63 o 7  52.6601 3.60617 48.4805     9.41668  52.4386     9.36272  29.2999    129.016     5.66831     309.016     
1 1 1 19 7  64 o 6  87.0272 2.82423 132.938     12.7829  139.143     11.7313  66.5444    165.774     22.8542     165.774     
1 1 1 19 7  65 o 3  115.809 2.55893 236.218     15.5339  244.314     14.0645  89.6992    350.154     31.0209     350.154     
1 1 1 19 7  66 o 19 19.2081 5.13143 5.67905     6.89137  4.6635      6.62534  0.131442   287.936     1.62733     107.936     
1 1 1 19 7  67 o 17 16.494  4.80447 3.06223     6.34854  0.337053    6.56327  0.858464   215.068     5.66601     215.068     
1 1 1 19 7  68 o 13 31.8433 4.94072 15.2565     7.86239  23.7837     7.55571  1.64368    88.9995     34.0326     269         
1 1 1 19 7  69 o 16 79.3925 3.06621 118.948     13.3265  109.254     10.9411  56.9479    301.8       14.5346     301.8       
1 1 1 19 7  70 o 3  28.6277 5.76904 9.82824     10.8675  20.4296     7.74307  11.8572    247.333     6.61983     67.3331     
1 1 1 19 7  71 o 5  29.7576 5.99001 18.4111     11.1191  16.5896     7.71267  12.0294    250.701     8.51878     70.701      
1 1 1 19 7  72 o 18 39.2456 5.18691 39.5743     11.7379  21.7427     8.07204  27.4651    320.208     11.2707     320.208     
1 1 1 19 7  73 o 19 44.9948 5.60045 45.2555     12.4267  34.8961     11.8586  26.6138    292.97      0.0340067   292.967     
1 1 1 19 7  74 o 10 20.893  6.0354  2.39823     9.97085  6.92019     10.1739  0.117834   111.172     21.2302     111.172     
1 1 1 19 7  75 o 14 77.0324 4.08835 104.053     14.5726  118.79      16.7768  46.5487    252.363     1.46582     72.3625     
1 1 1 19 7  76 o 10 52.8479 4.968   48.3452     12.3827  60.4513     13.2199  26.583     173.634     9.90604     353.634     
1 1 1 19 7  77 o 3  59.439  4.77687 68.1718     12.0232  68.0535     15.5635  32.5312    146.77      5.98544     326.77      
1 1 1 19 7  78 o 11 82.5755 3.99274 122.593     15.4438  133.397     17.4007  51.3516    235.507     2.40776     235.507     
1 1 1 19 7  79 o 1  23.8265 6.46067 12.4499     10.0996  4.94829     12.2339  7.57772    37.2128     7.32031     217.213     
1 1 1 19 7  80 o 6  21.4575 6.30505 4.02797     9.36507  6.46807     12.8846  1.97406    1.5958      0.0173996   1.59579     
1 1 1 19 7  81 o 18 35.865  6.92309 25.4774     10.9751  31.1443     14.6487  14.1236    210.415     11.998      30.4149     
1 1 1 19 7  82 o 3  35.6882 7.23273 35.7333     13.3968  21.9951     14.8017  21.5676    282.245     8.22768     282.245     
1 1 1 19 7  83 o 11 22.6638 6.55976 -7.61082    12.8411  17.0684     13.27    1.89508    288.108     0.687357    108.108     
1 1 1 19 7  84 o 8  26.6565 7.32574 6.1031      14.9597  22.0953     14.4746  6.62215    169.156     0.860254    349.156     
1 1 1 19 7  85 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 8  0  o 11 238.529 2.69036 1009.11     32.1413  1009.11     32.1413  185.505    9.91739e-07 21.4802     9.91739e-07 
1 1 1 19 8  1  f 0  77.6131 2.45548 105.372     9.31299  108.616     9.7399   50.3385    326.143     0           0           
1 1 1 19 8  2  o 16 381.443 3.87376 2595.57     75.6541  2565.8      72.4266  227.324    135.979     96.3771     315.979     
1 1 1 19 8  3  o 4  322.036 3.33551 1869.61     53.834   1808.49     53.8156  212.241    317.009     37.0588     137.009     
1 1 1 19 8  4  o 12 40.8342 3.45737 26.8872     6.74342  33.2692     7.0896   84.2194    88.3213     202.603     88.3213     
1 1 1 19 8  5  o 9  122.362 2.49178 272.554     15.64    258.774     14.8903  55.7043    214.684     37.506      34.6839     
1 1 1 19 8  6  o 4  311.954 3.54517 1734.04     56.7064  1717.59     54.1202  336.289    359.328     244.104     359.328     
1 1 1 19 8  7  o 11 244.89  3.0387  1074.55     38.1694  1052.09     36.4098  188.179    350.711     34.7244     350.711     
1 1 1 19 8  8  o 19 495.659 5.21986 4366.08     133.049  4357.49     126.184  432.395    223.12      148.633     223.12      
1 1 1 19 8  9  o 12 523.72  5.31682 4811.69     139.539  4929.09     139.534  407.939    51.3429     57.3019     51.3429     
1 1 1 19 8  10 o 14 488.969 5.15345 4216.96     122.943  4273.03     129.573  356.643    332.943     5.86665     332.943     
1 1 1 19 8  11 f 0  284.16  3.42441 1440.57     48.7828  1423.47     48.7465  144.335    282.446     0           0           
1 1 1 19 8  12 o 13 576.284 5.67734 5906.46     163.965  5892.68     163.958  406.681    218.834     21.9809     38.8337     
1 1 1 19 8  13 o 6  117.439 2.34529 254.559     13.5301  234.98      14.0077  30.4675    338.114     14.3247     338.114     
1 1 1 19 8  14 o 15 130.05  2.43012 306.08      15.4559  294.024     16.1648  76.34      62.8057     1.12554     242.806     
1 1 1 19 8  15 o 6  335.904 3.57475 1985.62     61.4503  2017.16     58.8495  330.073    249.167     188.37      249.167     
1 1 1 19 8  16 o 11 205.465 2.73671 768.73      27.475   728.494     28.8158  156.19     210.025     33.7497     210.025     
1 1 1 19 8  17 o 13 265.764 3.19183 1273.33     44.4112  1232.01     40.5779  163.619    282.369     48.1186     102.369     
1 1 1 19 8  18 o 8  398.157 3.93894 2833.18     75.1996  2792.55     81.7997  298.963    142.366     27.789      142.366     
1 1 1 19 8  19 o 10 196.139 2.66186 674.023     25.05    690.17      27.2554  154.366    100.13      43.4904     100.13      
1 1 1 19 8  20 f 0  92.9587 2.42359 155.125     10.9461  151.688     11.5787  89.1256    3.06914     0           0           
1 1 1 19 8  21 o 6  257.667 3.14669 1196.08     40.5978  1159.04     40.6585  155.165    14.3243     53.8883     194.324     
1 1 1 19 8  22 o 3  205.138 2.93487 737.601     30.1546  754.95      30.1854  91.5753    72.0455     104.766     252.045     
1 1 1 19 8  23 f 0  307.098 3.46185 1669.95     51.9795  1676.19     54.5496  286.812    160.833     0           0           
1 1 1 19 8  24 o 19 588.721 5.50135 6225.7      162.296  6096.65     162.306  442.136    40.6555     38.6966     40.6555     
1 1 1 19 8  25 o 2  154.04  2.56962 429.852     19.3293  411.699     20.3034  73.5763    243.068     64.8776     63.0679     
1 1 1 19 8  26 o 1  162.865 2.7491  470.139     22.4192  470.628     22.4564  142.171    163.38      69.2289     163.38      
1 1 1 19 8  27 o 13 176.432 2.66982 538.643     23.5735  565.523     23.6291  141.016    350.305     42.6165     350.305     
1 1 1 19 8  28 o 17 155.05  2.61698 437.441     19.7906  415.58      20.8114  64.7354    111.193     83.664      291.193     
1 1 1 19 8  29 o 10 252.673 2.94546 1139.39     37.2428  1125.49     37.3492  192.448    256.619     31.5645     256.619     
1 1 1 19 8  30 f 0  184.932 2.49024 591.037     23.0014  622.059     23.1485  112.203    157.573     0           0           
1 1 1 19 8  31 o 6  365.386 3.80107 2365.99     72.6183  2374.16     66.4353  284.447    203.917     53.3388     203.917     
1 1 1 19 8  32 f 0  54.0742 3.2228  52.5292     8.46389  51.9701     8.83361  54.8212    14.6376     0           0           
1 1 1 19 8  33 o 18 86.4037 2.55945 136.216     10.9116  129.094     11.1888  36.4306    9.96901     25.8605     189.969     
1 1 1 19 8  34 o 9  224.68  2.75362 914.495     30.9652  876.551     31.0324  165.544    129.501     21.3439     129.501     
1 1 1 19 8  35 o 16 104.375 2.41981 185.009     12.7584  201.981     12.4898  55.1364    45.8597     18.7425     225.86      
1 1 1 19 8  36 o 9  44.3352 3.34338 32.7736     7.42384  37.8856     7.13952  23.0583    318.543     83.246      318.543     
1 1 1 19 8  37 o 4  292.236 2.99347 1497.31     44.5818  1533.43     43.0619  200.513    32.4251     5.31326     212.425     
1 1 1 19 8  38 o 11 284.831 3.0054  1411.55     42.8191  1467.9      42.9702  226.499    196.958     59.0598     196.958     
1 1 1 19 8  39 f 0  142.857 2.41147 367.316     17.1018  356.638     17.4174  89.3446    246.296     0           0           
1 1 1 19 8  40 o 9  174.339 2.5165  525.208     21.3406  553.266     22.6353  124.177    105.338     14.0425     105.338     
1 1 1 19 8  41 f 0  232.463 2.7729  928.628     30.9228  989.691     33.6884  173.466    175.357     0           0           
1 1 1 19 8  42 o 13 201.456 2.55841 696.609     25.6975  743.944     25.9474  132.297    12.5868     10.0276     192.587     
1 1 1 19 8  43 o 5  50.2244 3.45257 52.0448     8.42123  38.9174     8.55332  6.64545    327.143     27.3068     147.143     
1 1 1 19 8  44 o 15 73.1533 2.80079 92.1681     10.2478  98.4442     10.2005  35.5303    293.204     14.4076     113.204     
1 1 1 19 8  45 o 11 177.326 2.55543 543.537     22.9794  572.919     22.4079  172.119    252.661     109.296     252.661     
1 1 1 19 8  46 o 8  147.773 2.45628 380.753     17.9634  394.554     18.4177  111.254    96.7087     25.8085     96.7087     
1 1 1 19 8  47 o 14 337.814 3.45136 1959.37     58.2371  2102.05     58.5779  247.664    200.22      32.4441     200.22      
1 1 1 19 8  48 o 10 326.362 3.33063 1833.12     53.2707  1957.66     55.6851  265.156    287.88      84.7823     287.88      
1 1 1 19 8  49 o 10 167.793 2.71186 500.232     21.9705  500.427     23.607   92.7799    255.576     40.4215     75.5763     
1 1 1 19 8  50 o 19 172.158 2.62741 527.098     22.3554  526.425     22.9762  117.755    25.1761     4.61196     25.1761     
1 1 1 19 8  51 o 7  163.935 2.64886 494.55      21.4261  461.399     22.0509  112.501    14.4518     5.93009     14.4518     
1 1 1 19 8  52 o 9  97.2736 2.53673 169.229     12.18    167.721     12.5057  61.2708    34.7697     2.52382     214.77      
1 1 1 19 8  53 o 18 51.9025 3.33397 41.3386     8.46976  56.1193     8.51565  16.3233    21.2727     26.1997     201.273     
1 1 1 19 8  54 o 13 26.8911 5.09237 12.8201     7.03209  14.1491     6.97765  4.87646    45.4513     21.9328     45.4513     
1 1 1 19 8  55 o 9  125.016 2.45198 267.738     14.9333  289.161     15.7644  95.2688    29.0516     28.2888     29.0516     
1 1 1 19 8  56 o 10 167.495 2.65252 492.699     22.216   507.035     22.3115  123.503    86.4817     25.4085     86.4817     
1 1 1 19 8  57 o 11 175.884 2.61023 531.961     23.8839  571.04      22.0016  123.887    49.7547     14.5941     49.7548     
1 1 1 19 8  58 o 1  57.0237 3.39951 55.2215     9.57417  62.1596     9.65004  39.23      241.202     9.04039     241.202     
1 1 1 19 8  59 o 13 55.3603 3.52521 49.671      9.54857  61.5101     9.72447  38.8641    195.372     11.0991     195.372     
1 1 1 19 8  60 o 1  54.8715 3.38709 57.032      8.64543  51.9152     9.68618  18.2636    187.613     32.7097     7.61273     
1 1 1 19 8  61 o 17 68.6367 3.15137 71.2854     10.5642  99.5977     10.7902  49.552     30.8164     13.0828     30.8164     
1 1 1 19 8  62 o 7  37.8909 4.54992 26.1582     7.94902  27.4998     8.71058  20.4924    115.003     0.271687    115.002     
1 1 1 19 8  63 o 16 112.69  2.57532 222.727     14.9825  232.186     14.0245  84.0252    339.994     22.5279     339.994     
1 1 1 19 8  64 o 1  38.4082 4.47266 29.8965     8.27773  25.3667     8.30253  23.7504    40.3399     10.0215     40.3399     
1 1 1 19 8  65 o 2  131.14  2.62919 307.272     16.8427  309.519     17.6728  76.692     165.259     16.1412     345.259     
1 1 1 19 8  66 o 5  76.7688 3.06729 103.143     12.0221  109.757     11.4462  54.2673    310.603     11.9213     310.603     
1 1 1 19 8  67 o 18 39.5821 4.62994 30.6082     9.18085  28.4352     8.54854  21.4444    209.423     2.9367      29.4232     
1 1 1 19 8  68 o 18 61.5977 3.30767 74.4814     10.7596  63.8136     9.52123  31.6987    261.005     13.6647     81.0048     
1 1 1 19 8  69 f 0  43.8027 4.98187 39.2439     11.6424  34.0193     9.48425  35.0356    216.43      0           0           
1 1 1 19 8  70 o 8  50.2637 4.79643 59.8543     13.9026  37.4021     9.76895  34.4766    4.72258     8.36919     4.72258     
1 1 1 19 8  71 o 6  30.5888 5.9832  16.9953     10.4935  20.2662     8.66568  11.242     119.253     12.1302     299.253     
1 1 1 19 8  72 o 6  36.4167 5.5962  28.1786     10.7422  24.7146     9.10583  19.7102    245.471     2.32584     65.4706     
1 1 1 19 8  73 o 7  38.859  6.15787 26.1721     11.339   35.7462     12.1256  27.801     16.0602     17.2666     16.0602     
1 1 1 19 8  74 o 19 49.5839 5.04242 48.4104     12.6003  47.2573     11.7279  26.9753    150.515     5.47249     330.515     
1 1 1 19 8  75 o 16 22.1909 6.10512 3.18996     9.96904  10.9654     9.98528  4.07383    214.345     1.79657     34.3448     
1 1 1 19 8  76 o 17 84.3933 3.6806  138.751     15.355   126.469     15.5834  64.5605    15.5363     26.4537     15.5363     
1 1 1 19 8  77 o 1  53.446  5.82671 57.2923     14.2246  57.48       15.9163  31.1351    42.1986     1.06548     222.199     
1 1 1 19 8  78 o 12 24.4367 6.76732 3.26073     11.8876  14.9634     12.8333  3.34131    63.2159     19.1552     243.216     
1 1 1 19 8  79 o 12 23.8532 6.87175 6.87217     13.0654  9.04619     12.8309  8.67684    101.697     2.23886     281.697     
1 1 1 19 8  80 o 2  19.2824 6.11821 -3.13979    12.0181  -0.231803   12.5354  2.29256    200.146     1.53245     20.1463     
1 1 1 19 8  81 o 16 33.1641 6.93651 39.8753     13.9843  5.99391     15.2276  15.702     125.766     3.81368     305.766     
1 1 1 19 8  82 o 15 24.9359 7.0712  11.8792     13.8647  11.114      13.0379  6.69653    124.793     0.935591    304.793     
1 1 1 19 8  83 o 10 28.367  7.44159 9.32147     16.6854  24.5198     13.5867  9.48376    14.9181     0.272358    14.9181     
1 1 1 19 8  84 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 9  0  o 16 17.1197 6.01075 7.64877     6.22997  7.64877     6.22997  91.6636    180         189.465     180         
1 1 1 19 9  1  o 6  119.292 2.6859  254.513     16.8093  250.583     15.2361  62.9952    91.6701     19.4138     91.6701     
1 1 1 19 9  2  o 16 93.1899 2.79106 152.546     13.2975  155.951     12.6975  27.7026    235.217     24.4236     55.2166     
1 1 1 19 9  3  o 16 137.924 2.71344 350.692     20.2244  324.595     17.2238  73.0669    141.403     30.5455     321.403     
1 1 1 19 9  4  o 14 284.81  3.53713 1439.16     51.8263  1438.29     49.1088  202.682    166.58      0.0469974   346.586     
1 1 1 19 9  5  o 9  72.9284 2.70275 99.6252     10.136   89.6085     9.55225  0.46965    234.451     56.8729     234.451     
1 1 1 19 9  6  o 16 88.4157 2.72451 138.388     12.0632  139.328     12.0224  39.9872    114.817     192.084     114.817     
1 1 1 19 9  7  o 1  380.677 4.15053 2577.37     79.191   2565.39     79.1705  260.745    118.974     27.7692     298.975     
1 1 1 19 9  8  f 0  335.128 3.60081 1999.58     60.4981  1984.74     60.4504  231.822    25.229      0           0           
1 1 1 19 9  9  o 11 405.447 4.23736 2936.21     88.1568  2898.23     84.0118  269.207    220.206     47.4278     40.2059     
1 1 1 19 9  10 o 15 144.324 2.52432 376.652     17.8278  362.194     18.6404  69.0411    155.975     51.9851     335.975     
1 1 1 19 9  11 o 10 420.69  3.91607 3145.46     82.5474  3134.68     82.5736  354.692    83.0027     103.717     83.0027     
1 1 1 19 9  12 o 14 182.375 2.5469  590.043     23.7186  589.274     22.8285  158.225    223.052     82.6508     223.052     
1 1 1 19 9  13 o 15 320.395 3.30894 1823.93     52.0523  1817.38     54.1811  268.593    0.11714     81.2621     0.11714     
1 1 1 19 9  14 o 13 70.2946 2.57951 92.6986     9.14042  83.1144     8.95951  4.90985    269.12      28.6463     89.1201     
1 1 1 19 9  15 o 17 448.479 4.29007 3559.64     96.4205  3580.3      96.419   409.875    323.786     174.547     323.786     
1 1 1 19 9  16 o 17 273.061 3.08703 1358        42.2025  1287.11     42.2602  206.31     140.834     25.6933     140.834     
1 1 1 19 9  17 f 0  296.343 3.37239 1579.22     50.0788  1536.41     50.0808  207.511    298.468     0           0           
1 1 1 19 9  18 o 10 514.588 5.23    4696.12     141.441  4713.42     127.936  362.813    310.659     18.0787     130.659     
1 1 1 19 9  19 o 1  322.976 3.80652 1823.98     60.0165  1878.24     63.2013  245.142    9.02483     28.641      9.02484     
1 1 1 19 9  20 o 17 508.02  5.05815 4586.43     125.651  4584.05     131.823  361.383    173.718     10.3576     353.718     
1 1 1 19 9  21 o 7  142.294 2.7306  347.732     19.4153  371.065     19.4786  35.0021    128.44      127.64      308.44      
1 1 1 19 9  22 o 4  179.768 2.74819 572.112     24.121   574.038     25.3814  121.332    316.925     6.99472     136.925     
1 1 1 19 9  23 f 0  199.517 2.69678 703.323     26.3428  708.481     27.5755  148.862    123.53      0           0           
1 1 1 19 9  24 o 4  108.851 2.49629 211.326     12.8906  209.3       14.2655  66.2641    246.499     4.0386      66.4986     
1 1 1 19 9  25 f 0  146.748 2.43675 383.827     17.445   379.852     18.3781  137.514    191.419     0           0           
1 1 1 19 9  26 o 5  319.93  3.44    1837.89     52.7183  1794.73     57.4258  318.846    304.329     187.283     304.329     
1 1 1 19 9  27 o 12 63.9406 2.63808 70.9617     8.13689  74.5613     8.69685  2.10112    130.637     74.3072     130.637     
1 1 1 19 9  28 o 1  86.0426 2.50367 137.853     10.1317  125.306     11.3044  35.2319    304.086     29.346      124.086     
1 1 1 19 9  29 o 6  29.699  4.29124 19.0971     5.94219  13.4964     6.38024  32.2467    281.762     79.4218     281.762     
1 1 1 19 9  30 o 7  419.41  3.86781 3126.03     81.2412  3120.55     81.3486  296.846    136.572     2.09865     316.571     
1 1 1 19 9  31 o 8  164.659 2.47958 482.283     19.9066  479.343     20.9972  111.426    119.367     0.372199    299.367     
1 1 1 19 9  32 o 2  52.4645 3.20698 51.3844     7.75198  47.0796     8.83886  0.329669   310.301     24.8522     130.301     
1 1 1 19 9  33 o 7  239.411 2.81791 1027.25     34.4247  1006.4      33.192   210.423    155.131     90.917      155.131     
1 1 1 19 9  34 o 1  76.2749 2.63953 109.395     9.74171  97.6537     10.309   17.2348    334.305     53.5977     154.305     
1 1 1 19 9  35 o 8  465.268 4.328   3847.83     102.865  3846.35     98.9242  365.195    208.499     74.7189     208.499     
1 1 1 19 9  36 o 1  124.023 2.43412 276.598     14.9515  269.453     15.2691  81.6612    68.6028     3.74253     68.6028     
1 1 1 19 9  37 o 3  115.245 2.52986 241.256     14.7972  230.428     14.3901  26.6504    333.362     100.252     153.362     
1 1 1 19 9  38 o 2  153.469 2.44127 417.851     18.6408  417.679     18.9097  145.13     39.2332     100.188     39.2332     
1 1 1 19 9  39 o 9  68.6583 2.91819 78.6325     9.98116  89.4674     9.97389  22.856     325.256     0.636905    145.256     
1 1 1 19 9  40 o 1  378.224 3.83578 2484.26     67.8011  2601.43     77.4777  300.379    285.336     74.0229     285.336     
1 1 1 19 9  41 o 3  57.2755 3.11441 56.2745     8.6834   60.9635     9.05822  4.92293    130.189     76.8618     130.189     
1 1 1 19 9  42 o 14 160.714 2.43042 459.918     19.4193  456.707     19.7275  142.684    183.166     71.6849     183.166     
1 1 1 19 9  43 o 5  39.7362 4.34186 30.8447     7.93962  26.7559     8.68964  2.03108    147.829     34.7643     147.829     
1 1 1 19 9  44 o 19 104.872 2.54626 180.393     12.7215  211.15      14.0111  44.2961    183.39      50.2825     3.39024     
1 1 1 19 9  45 o 5  93.3109 2.58386 150.983     11.94    158.752     12.1776  42.4089    347.731     36.5652     167.731     
1 1 1 19 9  46 o 19 119.484 2.58523 253.308     15.344   254.272     15.579   98.9135    338.283     43.4919     338.283     
1 1 1 19 9  47 o 5  356.456 3.44241 2193.25     61.3246  2331.17     61.6281  269.111    44.7647     48.757      44.7646     
1 1 1 19 9  48 o 9  129.463 2.53452 288.515     16.1233  307.665     16.7338  97.6331    124.23      24.3702     124.23      
1 1 1 19 9  49 o 3  92.0815 2.67641 151.087     11.5605  150.904     13.0407  71.2545    336.792     28.1762     336.792     
1 1 1 19 9  50 o 11 110.894 2.4328  211.729     13.5667  225.935     13.4245  67.4196    105.474     11.039      285.474     
1 1 1 19 9  51 o 1  65.7871 2.91293 76.2004     9.38631  78.5287     9.72483  21.8755    147.789     38.3327     327.789     
1 1 1 19 9  52 o 4  29.873  4.9018  21.2966     7.15001  12.2037     7.44489  5.58522    128.895     32.5706     128.895     
1 1 1 19 9  53 o 13 86.8107 2.66214 135.87      11.5539  133.022     11.553   64.9947    206.82      22.6709     206.82      
1 1 1 19 9  54 o 5  53.2305 3.26573 52.0381     8.38392  49.9314     8.84579  5.78459    6.34415     53.5518     186.344     
1 1 1 19 9  55 f 0  155.538 2.49365 407.779     19.8826  454.498     18.8803  103.127    236.141     0           0           
1 1 1 19 9  56 o 14 22.3836 5.296   11.9513     6.70712  3.41496     8.21931  4.75621    197.146     25.1097     197.146     
1 1 1 19 9  57 o 2  35.1604 4.42014 21.6995     7.30207  24.2391     7.70582  9.82917    219.788     20.3902     39.7881     
1 1 1 19 9  58 o 1  95.8533 2.69757 170.915     12.8616  157.868     12.9816  75.2903    73.4951     26.1707     73.4951     
1 1 1 19 9  59 o 14 140.521 2.53392 349.429     17.5934  356.102     18.0657  98.5866    221.922     11.9133     221.922     
1 1 1 19 9  60 o 2  95.2792 2.74929 160.888     13.2875  164.503     12.9035  71.7188    259.417     20.1242     259.417     
1 1 1 19 9  61 o 9  60.1228 3.37728 63.9035     10.0621  67.0525     10.1186  32.6276    238.774     10.5699     58.7738     
1 1 1 19 9  62 o 15 29.4735 5.17656 22.4614     7.54245  10.6017     8.26152  7.80488    209.847     15.5547     29.8468     
1 1 1 19 9  63 o 6  23.9077 5.53901 14.4636     7.7744   4.89533     8.40734  2.46182    71.6202     17.2174     251.62      
1 1 1 19 9  64 o 1  98.4152 2.90564 168.43      13.7554  180.28      14.8464  72.4337    40.082      18.4629     40.082      
1 1 1 19 9  65 o 12 103.898 2.94728 198.117     15.2573  190.84      15.3654  76.2066    24.0849     19.0526     24.0849     
1 1 1 19 9  66 o 16 111.274 2.7531  221.111     15.2355  224.35      15.422   78.2565    86.6826     13.5873     86.6826     
1 1 1 19 9  67 f 0  31.9468 5.18461 26.7503     8.15599  13.0811     8.47405  27.6083    348.075     0           0           
1 1 1 19 9  68 o 4  21.6686 5.408   5.44314     6.95924  10.5646     7.83017  2.06324    279.489     0.210839    99.4886     
1 1 1 19 9  69 o 14 17.8291 5.40974 1.3853      9.28112  -0.0265875  8.02098  1.22354    156.908     18.6627     156.908     
1 1 1 19 9  70 o 2  35.4252 5.57641 23.4076     10.5364  26.2902     8.766    21.1462    245.328     2.22203     245.328     
1 1 1 19 9  71 o 8  24.6598 5.36681 23.4809     9.87884  -3.06073    7.84111  8.84763    113.85      6.97819     293.85      
1 1 1 19 9  72 o 4  34.4236 6.11554 30.3093     12.0106  18.8809     9.18968  7.58264    90.7831     25.5298     270.783     
1 1 1 19 9  73 o 13 20.8607 6.06256 7.77855     9.94093  0.11848     10.9189  0.248102   45.9199     20.2229     225.92      
1 1 1 19 9  74 o 19 51.1785 5.06997 51.4497     12.024   50.8344     13.2142  38.9138    18.0727     18.5315     18.0727     
1 1 1 19 9  75 o 5  35.1996 6.30859 14.0182     11.6296  38.3944     12.1365  20.6592    246.09      10.0654     246.09      
1 1 1 19 9  76 o 14 52.5893 5.70118 54.1211     14.3333  56.6697     14.7614  32.7525    205.227     3.17179     205.227     
1 1 1 19 9  77 o 5  19.6533 6.06968 -3.61843    11.5292  3.75615     11.3697  1.87114    154.292     0.919841    334.292     
1 1 1 19 9  78 o 17 27.927  7.08957 21.4433     13.2597  9.25164     12.7009  13.238     244.517     4.88745     244.517     
1 1 1 19 9  79 o 5  22.1038 6.32579 -14.6684    12.3063  17.1984     12.9744  5.47702    304.958     9.62932     124.958     
1 1 1 19 9  80 o 14 20.7483 6.3686  10.5856     13.534   -10.0788    12.3521  2.24892    0.51228     0.816351    180.512     
1 1 1 19 9  81 o 18 34.6697 7.80944 35.9496     16.3239  22.6369     14.5991  19.2326    340.383     8.55185     340.383     
1 1 1 19 9  82 o 5  31.6286 7.06066 2.80391     16.5637  38.3465     14.1492  14.1196    191.601     1.3214      11.6007     
1 1 1 19 9  83 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 10 0  o 1  733.75  7.4481  9569.59     273.749  9569.59     273.749  571.344    2.99174e-06 64.717      2.99174e-06 
1 1 1 19 10 1  o 4  83.3357 2.91442 129.239     11.5636  117.787     12.6097  5.63365    309.241     79.714      129.241     
1 1 1 19 10 2  f 0  91.5565 2.68171 138.531     11.7689  159.595     12.7915  65.1372    85.8987     0           0           
1 1 1 19 10 3  o 19 399.699 4.32758 2842.48     82.2753  2828.64     90.857   397.317    266.39      220.362     266.39      
1 1 1 19 10 4  o 10 43.3456 3.34947 36.2265     7.08369  31.3081     7.18565  6.36306    182.401     18.0679     182.401     
1 1 1 19 10 5  o 11 284.899 3.1868  1465.37     43.5583  1413.86     47.2862  188.61     158.042     30.9802     338.042     
1 1 1 19 10 6  o 6  439.144 4.23831 3425.19     89.3212  3420.18     97.0593  386.824    65.2147     137.834     65.2147     
1 1 1 19 10 7  o 11 317.519 3.46088 1782.72     51.3741  1793.98     58.5533  234.651    12.6767     13.0705     12.6766     
1 1 1 19 10 8  o 10 71.5788 2.64629 99.0303     9.02002  83.4802     9.76378  13.3438    47.8235     105.022     47.8235     
1 1 1 19 10 9  o 6  223.181 3.02242 907.927     31.2625  859.039     36.0261  136.421    108.894     42.9195     288.894     
1 1 1 19 10 10 f 0  118.501 2.49853 250.704     14.5034  247.66      15.1279  73.2517    34.626      0           0           
1 1 1 19 10 11 o 13 396.052 4.27953 2754.71     80.6421  2814.01     89.1073  265.87     245.587     42.0131     65.5873     
1 1 1 19 10 12 o 14 232.038 3.21562 956.549     36.4486  953.373     38.3097  180.619    290.056     34.3098     290.056     
1 1 1 19 10 13 o 2  240.053 3.41608 1045.6      39.9076  999.128     42.1843  196.498    120.683     54.3926     120.683     
1 1 1 19 10 14 o 13 270.432 3.55583 1288.73     45.4859  1306.27     50.7824  206.417    271.377     26.9913     271.377     
1 1 1 19 10 15 o 12 36.3481 4.34398 24.1406     7.42018  24.058      7.83659  24.718     238.617     67.5386     238.617     
1 1 1 19 10 16 o 14 130.983 3.01783 320.27      18.5213  289.33      20.8189  27.4965    106.233     126.29      286.233     
1 1 1 19 10 17 o 5  173.021 3.09178 558.889     25.8869  504.148     27.5359  118.716    191.521     3.2722      11.5214     
1 1 1 19 10 18 o 18 259.322 3.69573 1185.84     50.8803  1200.89     44.9535  150.638    167.242     70.2171     347.242     
1 1 1 19 10 19 o 14 256.909 2.99265 1155.84     36.6802  1185.56     40.334   175.132    319.23      16.396      139.23      
1 1 1 19 10 20 o 17 446.39  4.45256 3537.87     94.9704  3540.02     104.036  285.905    17.2193     73.0406     197.219     
1 1 1 19 10 21 o 2  219.323 2.77938 859.805     29.1547  846.392     31.8596  160.154    168.434     11.0885     168.434     
1 1 1 19 10 22 o 18 287.881 3.07683 1473.72     43.4275  1466.53     45.3254  191.229    160.122     28.7287     340.122     
1 1 1 19 10 23 o 9  136.016 2.37016 334.84      15.71    321.494     16.5534  64.242     116.812     57.0631     296.812     
1 1 1 19 10 24 o 5  200.343 2.63198 732.005     25.7834  691.887     27.0025  121.481    67.7185     38.1968     247.719     
1 1 1 19 10 25 o 11 166.758 2.55122 503.95      20.2739  482.453     22.2689  79.7919    219.551     72.2064     39.5505     
1 1 1 19 10 26 o 4  151.872 2.37246 410.418     17.9352  407.562     18.1764  70.1829    341.478     68.7783     161.478     
1 1 1 19 10 27 o 9  84.7719 2.48614 131.976     10.4543  123.411     10.6084  35.9934    318.149     25.0503     138.149     
1 1 1 19 10 28 o 11 190.824 2.50032 642.243     23.8221  649.298     23.999   147.871    53.4741     33.117      53.4741     
1 1 1 19 10 29 o 14 66.268  2.73884 79.5365     8.93359  76.7954     9.17008  5.26092    157.848     61.631      337.848     
1 1 1 19 10 30 o 9  27.9488 4.67968 20.2503     6.812    8.94966     6.46808  12.8772    70.6146     31.4274     70.6146     
1 1 1 19 10 31 o 1  153.823 2.4714  421.907     18.4704  417.369     19.6085  81.8811    145.391     46.0623     325.391     
1 1 1 19 10 32 o 10 303.398 3.13539 1640.27     48.5579  1626.8      46.7767  246.358    276.373     66.4501     276.373     
1 1 1 19 10 33 o 1  541.725 4.64516 5189.55     123.708  5246.67     128.484  464.855    309.34      161.479     309.34      
1 1 1 19 10 34 o 17 168.732 2.48699 509.467     21.316   500.496     20.7433  121.216    120.257     13.5096     120.257     
1 1 1 19 10 35 o 10 282.277 2.91658 1410.89     40.4073  1416.95     42.0952  193.506    74.7492     8.21866     254.749     
1 1 1 19 10 36 o 17 134.859 2.37512 326.087     15.5901  319.293     16.4759  113.47     223.66      56.0592     223.66      
1 1 1 19 10 37 o 14 258.494 2.88152 1186.09     36.4506  1185.61     38.1844  163.751    67.4593     32.8711     247.459     
1 1 1 19 10 38 o 11 198.4   2.53922 708.941     25.0878  687.902     25.3953  147.623    15.5366     22.8513     15.5366     
1 1 1 19 10 39 o 14 191.232 2.64439 644.541     24.5465  653.463     26.1234  93.1718    294.28      77.9848     114.28      
1 1 1 19 10 40 f 0  281.157 3.00979 1404.11     40.5904  1403.42     44.1492  178.926    88.9534     0           0           
1 1 1 19 10 41 o 16 111.005 2.47611 222.007     13.2862  215.812     14.1976  87.715     120.281     32.5759     120.281     
1 1 1 19 10 42 f 0  148.396 2.39862 391.121     17.2951  390.543     18.3638  128.928    343.886     0           0           
1 1 1 19 10 43 o 13 197.825 2.51619 695.778     24.289   693.855     25.5824  117.586    78.0521     36.9174     258.052     
1 1 1 19 10 44 o 14 152.365 2.60599 411.793     18.3355  413.106     21.3316  88.2693    118.109     30.5597     298.109     
1 1 1 19 10 45 o 16 161.516 2.57338 452.512     19.2405  474.407     22.3657  102.024    173.432     15.4207     353.432     
1 1 1 19 10 46 o 13 230.646 2.91907 938.965     30.5192  952.927     36.7171  203.993    295.801     93.2922     295.801     
1 1 1 19 10 47 o 17 157.817 2.57936 440.944     18.7931  444.353     21.8986  110.045    128.443     6.93001     128.443     
1 1 1 19 10 48 o 9  18.5044 5.04844 8.15368     6.7491   -6.06815    8.4027   5.11018    224.575     12.8027     224.575     
1 1 1 19 10 49 o 7  80.8629 2.95116 123.178     11.2886  110.45      12.4269  38.1123    246.766     27.9156     66.7665     
1 1 1 19 10 50 o 8  310.162 3.31433 1677.8      51.3126  1754.98     51.7085  246.376    203.747     70.0082     203.747     
1 1 1 19 10 51 o 15 95.3501 2.53855 160.526     11.7394  163.528     12.4724  65.5863    282.903     8.56788     282.903     
1 1 1 19 10 52 o 3  78.1711 2.72473 105.746     10.3751  112.555     10.9095  44.8151    221.623     8.77747     41.6229     
1 1 1 19 10 53 o 15 119.64  2.47846 244.686     14.1089  265.658     15.5841  84.671     84.3974     11.6563     84.3974     
1 1 1 19 10 54 o 8  33.1624 4.71044 24.2684     7.41161  16.9972     7.67579  4.60641    207.888     22.9714     27.8877     
1 1 1 19 10 55 o 11 133.13  2.67646 306.484     17.0928  326.438     18.5863  93.1823    62.6779     9.03871     62.6779     
1 1 1 19 10 56 o 2  86.4547 2.80418 132.315     11.1118  135.243     13.0602  49.3904    252.148     14.7422     72.148      
1 1 1 19 10 57 o 19 21.1536 5.13971 12.8307     7.45444  -0.262857   7.13305  2.40296    255.557     21.2446     255.557     
1 1 1 19 10 58 o 13 28.3193 5.10357 14.0173     7.05837  16.4481     7.48211  6.27935    117.445     15.6671     297.445     
1 1 1 19 10 59 o 19 114.202 2.61332 219.955     14.6679  247.338     15.1927  70.3948    53.5086     9.55242     233.509     
1 1 1 19 10 60 o 7  62.1199 3.39985 66.5337     10.8733  73.3805     10.0428  19.0465    201.503     41.9142     21.5032     
1 1 1 19 10 61 o 10 53.3268 4.1785  55.507      11.828   49.2262     10.1353  28.9812    58.3868     8.56723     238.387     
1 1 1 19 10 62 o 3  31.0402 5.37014 18.2986     8.02945  18.7922     8.53949  3.18946    8.04165     29.7421     188.042     
1 1 1 19 10 63 o 2  52.4648 3.86081 58.0356     9.9823   43.4609     9.84497  30.6576    103.655     3.62628     283.655     
1 1 1 19 10 64 o 7  22.3145 5.44271 12.2164     7.2857   3.2452      8.42968  3.67153    310.557     8.94014     130.557     
1 1 1 19 10 65 o 18 23.8597 5.6269  10.3438     7.67534  10.2829     8.10353  6.56007    236.338     5.83424     56.3381     
1 1 1 19 10 66 o 16 18.1152 5.02965 7.67555     7.00982  -2.73521    7.38058  1.02437    297.891     3.18751     117.891     
1 1 1 19 10 67 o 5  59.6586 3.64849 55.059      10.5354  76.6143     10.86    42.7967    74.8235     11.2202     74.8235     
1 1 1 19 10 68 o 13 37.7285 5.02158 22.314      8.7927   33.229      9.47284  26.4084    63.9875     10.5929     63.9875     
1 1 1 19 10 69 o 16 14.6338 4.81873 -7.09342    8.87964  -6.25696    8.32795  6.22264    29.2128     25.7117     29.2128     
1 1 1 19 10 70 o 5  34.6304 5.75742 27.6143     10.5918  20.8718     9.09728  22.8708    260.238     8.98446     260.238     
1 1 1 19 10 71 o 5  68.5572 3.72658 94.9778     13.7259  80.1515     11.7058  48.5807    331.589     11.9937     331.589     
1 1 1 19 10 72 o 16 27.6406 6.60184 16.74       10.8483  13.7908     10.9234  8.01729    169.186     13.9476     349.186     
1 1 1 19 10 73 o 3  17.4751 5.54282 -6.89485    10.2217  0.832316    10.1899  0.129734   12.4387     12.0382     12.4387     
1 1 1 19 10 74 o 5  22.3073 6.27843 4.3925      10.7666  9.47795     10.4908  4.67791    119.252     7.23253     299.252     
1 1 1 19 10 75 o 12 22.8331 6.31381 -0.810437   11.8289  13.4473     10.6238  6.47183    237.656     3.79335     57.6562     
1 1 1 19 10 76 o 3  22.7686 6.22069 16.7818     11.4061  -8.75795    11.9897  2.60027    240.212     18.642      60.2118     
1 1 1 19 10 77 o 15 17.4532 5.74092 -7.15615    13.0609  -7.17247    11.1744  1.82378    282.929     3.39994     102.929     
1 1 1 19 10 78 o 1  25.1053 7.07641 6.84408     14.7016  13.3919     12.5862  9.44956    108.748     1.92408     108.748     
1 1 1 19 10 79 o 15 23.3568 7.02117 9.63032     16.2387  4.12271     12.3199  5.65112    222.234     10.8019     42.2341     
1 1 1 19 10 80 o 17 37.6955 7.85948 36.4422     17.8252  32.7751     14.0243  21.5699    302.843     3.47599     302.843     
1 1 1 19 10 81 o 9  24.7273 7.13298 7.48876     15.1212  14.1917     13.2829  5.26978    78.2106     1.45117     258.211     
1 1 1 19 10 82 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 11 0  o 12 50.6032 3.17358 46.4545     7.89568  46.4545     7.89568  57.2122    180         178.31      180         
1 1 1 19 11 1  o 11 410.325 4.27413 3009.69     85.7463  2967.87     89.949   331.695    19.9371     66.4143     19.9371     
1 1 1 19 11 2  o 10 287.651 3.55797 1449.05     49.9284  1487        52.6432  231.1      143.019     48.7459     143.019     
1 1 1 19 11 3  o 10 318.44  3.99468 1799        61.8382  1800.32     65.6044  207.652    124.999     46.1863     304.999     
1 1 1 19 11 4  o 9  208.16  3.1222  777.275     32.5686  759.793     32.5682  148.683    224.119     3.23678     224.119     
1 1 1 19 11 5  o 9  55.1943 3.51338 54.6625     9.66085  54.302      9.56744  30.4987    116.638     119.507     116.638     
1 1 1 19 11 6  o 7  119.138 2.96271 249.921     16.6657  254.153     18.6177  74.6633    148.256     2.64876     328.256     
1 1 1 19 11 7  f 0  267.601 3.60472 1276.71     46.9444  1264.39     49.685   130.448    34.8543     0           0           
1 1 1 19 11 8  o 19 214.212 3.57627 810.436     38.5002  817.861     38.2808  193.442    117.003     87.3892     117.003     
1 1 1 19 11 9  o 6  151.673 3.04342 411.427     21.7057  405.261     24.4113  125.338    259.492     48.8185     259.492     
1 1 1 19 11 10 o 8  108.885 2.9586  210.117     15.2246  211.037     16.9595  72.1631    17.8883     11.1107     17.8883     
1 1 1 19 11 11 o 2  168.865 3.20778 496.156     23.772   516.025     30.2151  113.854    120.375     8.26081     300.375     
1 1 1 19 11 12 o 12 198.749 3.07745 709.492     29.0229  691.843     32.1571  135.474    219.781     11.0502     39.7812     
1 1 1 19 11 13 o 5  215.976 3.10649 831.309     30.9706  823.488     36.0571  172.113    306.288     38.0752     306.288     
1 1 1 19 11 14 f 0  295.712 3.20566 1568.89     47.523   1533.7      47.4846  221.601    78.0601     0           0           
1 1 1 19 11 15 o 8  88.0837 2.58146 140.201     11.4656  135.45      11.2753  44.4517    34.7988     13.2059     214.799     
1 1 1 19 11 16 o 12 110.458 2.50958 228.425     14.1934  205.021     13.5508  64.7453    102.009     43.977      102.009     
1 1 1 19 11 17 o 14 240.995 2.96507 1052.16     36.5927  1008.4      35.0313  206.067    54.0772     70.41       54.0772     
1 1 1 19 11 18 o 19 297.318 3.45335 1541.64     50.2588  1595.78     52.6517  275.94     79.0902     127.501     79.0902     
1 1 1 19 11 19 o 3  122.714 2.69357 273.57      17.4976  261.135     15.5732  80.9699    224.581     0.927849    224.581     
1 1 1 19 11 20 o 4  310.967 3.37977 1733.04     49.0956  1698.92     55.9474  201.922    227.045     43.0951     47.0455     
1 1 1 19 11 21 o 1  101.794 2.54141 187.142     12.6693  180.85      13.2013  38.2599    33.691      56.3658     213.691     
1 1 1 19 11 22 o 11 200.807 2.68464 722.326     25.8604  708.029     28.1008  141.478    247.06      1.20909     247.06      
1 1 1 19 11 23 o 10 104.904 2.51865 193.993     12.6717  196.776     13.7565  51.2171    138.521     32.6347     318.521     
1 1 1 19 11 24 o 2  382.963 3.88793 2581.77     69.6151  2626.78     79.3766  284.101    54.605      18.7302     54.6051     
1 1 1 19 11 25 o 7  346.659 3.66665 2120.84     59.4177  2146.08     67.7528  257.29     347.363     18.8813     347.363     
1 1 1 19 11 26 o 6  241.163 2.97617 1041.33     33.5262  1022.4      38.2127  195.144    203.324     51.2562     203.324     
1 1 1 19 11 27 o 9  121.266 2.53592 273.954     14.5819  248.436     16.0685  55.3939    66.2702     51.4689     246.27      
1 1 1 19 11 28 o 6  66.1358 2.94335 81.5577     9.23851  74.3464     10.0941  15.5173    229.065     29.4805     49.0648     
1 1 1 19 11 29 o 18 212.529 2.8512  814.995     29.4961  787.813     31.18    107.13     348.805     84.5408     168.805     
1 1 1 19 11 30 o 19 238.62  3.02871 1009.23     32.6517  1011.53     39.4689  180.653    234.022     26.9943     234.022     
1 1 1 19 11 31 o 7  286.996 3.41944 1472.8      44.3908  1451.74     53.4782  244.7      257.599     85.8552     257.599     
1 1 1 19 11 32 o 4  204.164 2.73489 746.895     26.6643  732.156     29.2137  147.254    119.259     11.1685     119.259     
1 1 1 19 11 33 o 9  102.934 2.65647 198.955     12.2813  177.785     14.785   71.0945    90.9543     19.4875     90.9543     
1 1 1 19 11 34 o 8  308.469 3.27221 1692.8      48.3059  1686        52.7543  266.622    275.268     100.266     275.268     
1 1 1 19 11 35 o 4  266.653 2.99209 1266.64     37.3523  1257.62     42.4335  209.518    37.3057     46.0508     37.3057     
1 1 1 19 11 36 o 18 255.404 2.91979 1154.87     35.621   1160.98     39.0514  167.38     198.634     22.8363     18.6341     
1 1 1 19 11 37 o 11 307.589 3.34265 1686.43     50.268   1675.1      52.7439  246.554    226.008     62.0154     226.008     
1 1 1 19 11 38 o 11 142.54  2.63431 352.089     17.2861  369.535     20.2725  93.4936    108.79      6.77116     288.79      
1 1 1 19 11 39 o 16 259.761 3.04497 1197.63     37.7341  1199.46     41.4573  169.762    204.753     23.377      24.753      
1 1 1 19 11 40 o 9  169.817 2.59302 520.137     20.415   503.846     23.5524  91.1381    261.858     52.1626     81.8581     
1 1 1 19 11 41 o 10 33.64   4.87667 21.6774     7.3003   20.1542     8.56475  7.74982    20.5822     39.4782     20.5822     
1 1 1 19 11 42 o 5  67.1506 3.09739 91.6536     9.35834  70.0793     10.9342  39.6541    94.8921     15.7104     94.8921     
1 1 1 19 11 43 o 9  54.6962 3.44931 55.8702     8.56978  51.5042     9.99838  8.68356    271.833     47.8619     91.8325     
1 1 1 19 11 44 o 17 28.6161 5.03825 6.35272     7.08538  24.6144     8.3904   3.26605    284.587     14.3508     284.587     
1 1 1 19 11 45 o 4  156.994 2.63109 443.996     19.5768  432.476     21.7177  114.557    228.162     16.0005     228.162     
1 1 1 19 11 46 o 15 68.1628 2.98316 82.6843     9.27681  83.3193     10.9371  32.0582    281.314     20.7321     101.314     
1 1 1 19 11 47 o 1  130.833 2.47031 308.241     15.3466  300.635     16.9647  76.916     273.507     22.6619     93.5073     
1 1 1 19 11 48 o 8  150.834 2.55187 399.721     17.8271  409.977     20.6611  90.6848    39.1254     22.9188     219.125     
1 1 1 19 11 49 o 8  93.187  2.71841 151.849     11.5847  157.946     13.6978  56.5946    114.421     8.23523     294.421     
1 1 1 19 11 50 o 10 148.397 2.72111 383.308     18.4933  401.661     21.883   120.607    14.8457     43.0058     14.8457     
1 1 1 19 11 51 o 13 132.573 2.66695 316.162     16.681   310.591     18.6449  102.378    74.8326     28.5765     74.8326     
1 1 1 19 11 52 o 12 127.276 2.63975 280.588     15.7924  297.414     17.8316  86.3397    20.7089     2.7805      20.709      
1 1 1 19 11 53 o 18 120.412 2.56742 241.641     14.1471  276.271     16.8137  90.917     334.91      21.5688     334.91      
1 1 1 19 11 54 o 7  142.665 2.56258 347.91      16.7886  378.587     19.8121  96.9568    26.1027     2.29951     26.1027     
1 1 1 19 11 55 o 16 57.3552 3.49272 56.5196     9.29954  62.5092     10.5868  30.1547    244.379     12.867      64.3787     
1 1 1 19 11 56 o 5  91.392  2.69174 150.768     12.3554  148.271     12.2471  57.5988    51.6633     5.27376     231.663     
1 1 1 19 11 57 o 4  57.4324 3.69459 56.2657     9.80653  63.7314     11.2376  14.8376    328.155     44.6395     148.155     
1 1 1 19 11 58 o 3  38.8773 4.56045 32.0658     8.42446  24.6106     8.60703  23.8657    153.463     10.3345     153.463     
1 1 1 19 11 59 o 1  72.7239 3.01903 87.2701     10.7759  103.696     11.0938  41.1981    270.489     11.8536     90.4893     
1 1 1 19 11 60 o 7  78.6148 2.94095 117.679     11.2104  105.102     11.8057  54.7784    71.4413     8.00142     71.4413     
1 1 1 19 11 61 o 10 48.8451 4.10527 52.2472     9.88467  36.4702     9.57122  18.5702    189.06      24.2786     9.06036     
1 1 1 19 11 62 o 11 120.843 2.62681 262.016     16.418   262.121     15.3401  96.7235    261.244     35.7634     261.244     
1 1 1 19 11 63 o 15 18.0483 5.15778 0.327215    7.00656  5.33819     7.61333  0.0736832  44.6104     9.00466     44.611      
1 1 1 19 11 64 o 18 21.0313 5.47087 10.0202     8.10594  3.39625     7.37157  2.40469    181.335     26.6756     181.335     
1 1 1 19 11 65 o 8  56.5801 3.46593 49.3539     9.52585  68.5614     9.73889  21.5309    235.3       28.9834     55.2999     
1 1 1 19 11 66 o 9  25.8649 5.73704 15.3519     8.53928  10.2553     8.16524  5.63177    70.1123     2.3097      70.1123     
1 1 1 19 11 67 o 13 37.2461 4.66694 16.0644     7.72172  39.3422     8.80714  19.6051    215.298     5.27986     35.2983     
1 1 1 19 11 68 o 2  99.6794 2.89773 176.832     15.1099  184.214     13.7041  70.504     274.483     13.4248     274.483     
1 1 1 19 11 69 o 5  16.5446 5.23515 -0.0225094  9.8965   -4.22495    7.81503  0.83131    187.634     7.8524      7.63361     
1 1 1 19 11 70 o 9  22.0121 5.95813 12.4742     10.4862  2.69245     8.21647  2.22261    272.415     18.4473     92.4146     
1 1 1 19 11 71 o 1  30.0472 6.62094 23.0771     11.5293  14.3625     10.8638  15.314     198.006     0.157648    198.006     
1 1 1 19 11 72 o 5  29.2557 6.97785 14.5537     11.0236  21.1106     13.2692  13.9402    279.49      1.7004      279.49      
1 1 1 19 11 73 o 4  26.0239 6.70738 10.7476     12.2168  14.669      10.7429  6.2791     213.383     1.13063     213.383     
1 1 1 19 11 74 o 8  25.5829 6.35232 -0.672046   12.0966  20.8848     10.9631  7.84289    90.2562     10.2526     270.256     
1 1 1 19 11 75 f 0  34.6788 7.29729 24.8458     15.5322  27.3008     12.0803  20.8472    99.9478     0           0           
1 1 1 19 11 76 o 4  22.028  6.62386 -9.0855     15.6552  10.1762     12.1435  6.13903    348.348     7.89727     168.348     
1 1 1 19 11 77 o 14 25.215  7.10364 3.30183     15.6459  15.4036     12.6819  10.3269    122.704     1.27369     122.704     
1 1 1 19 11 78 o 12 25.8005 6.95978 19.9744     13.2871  4.20688     12.9578  10.578     62.443      0.4138      242.443     
1 1 1 19 11 79 o 16 23.7327 6.98826 11.0209     13.8307  6.33701     13.8067  6.65604    122.707     4.40477     302.707     
1 1 1 19 11 80 o 11 26.9445 7.40028 15.3434     14.8868  16.446      13.7941  8.87514    153.974     4.98478     333.974     
1 1 1 19 11 81 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 12 0  o 13 55.1419 3.59097 55.2713     9.71932  55.2713     9.71932  9.87384    360         86.8594     360         
1 1 1 19 12 1  o 1  531.521 6.04789 4957.34     150.799  5097.52     171.009  398.744    266.623     17.974      266.623     
1 1 1 19 12 2  o 12 219.001 3.21484 850.526     33.2926  851.114     37.1679  155.968    286.368     2.13607     106.367     
1 1 1 19 12 3  o 9  50.8287 3.68292 42.9794     8.66911  49.8011     9.84015  14.3355    90.7673     78.0609     90.7673     
1 1 1 19 12 4  o 18 132.207 3.10585 310.352     19.9106  310.419     21.1682  44.1471    198.395     96.6808     18.3948     
1 1 1 19 12 5  o 16 133.666 2.98138 310.357     18.6397  324.144     21.2172  107.325    310.728     38.4513     310.728     
1 1 1 19 12 6  o 19 176.043 2.99003 561.812     24.8153  538.061     27.7602  143.232    243.107     40.7301     243.107     
1 1 1 19 12 7  o 2  158.809 2.98072 454.24      22.9548  441.105     24.4001  97.0988    76.5281     28.5803     256.528     
1 1 1 19 12 8  o 12 173.828 3.06143 545.968     27.4291  526.434     25.8853  111.908    25.9741     21.6246     205.974     
1 1 1 19 12 9  f 0  246.621 3.39325 1088.68     39.4936  1069.71     44.205   186.905    202.637     0           0           
1 1 1 19 12 10 o 5  135.92  2.65574 338.32      17.5773  317.578     18.5114  120.987    295.282     73.3446     295.282     
1 1 1 19 12 11 o 14 206.244 3.04132 770.687     32.2321  738.57      30.6395  162.724    324.06      33.107      324.06      
1 1 1 19 12 12 o 4  16.5613 4.72609 2.0802      5.81303  2.08873     6.28524  13.4914    344.51      28.6431     344.51      
1 1 1 19 12 13 o 17 159.078 2.56665 446.627     19.1013  450.874     21.7478  75.739     66.4484     72.5928     246.448     
1 1 1 19 12 14 o 14 128.298 2.53897 303.272     15.1879  281.181     17.2647  73.8412    167.453     26.4056     347.453     
1 1 1 19 12 15 o 5  109.639 2.62307 215.276     13.4325  211.577     15.2734  58.7535    164.661     26.2477     344.661     
1 1 1 19 12 16 o 3  113.914 2.50921 230.761     13.6573  229.912     14.9255  56.9654    55.616      37.8253     235.616     
1 1 1 19 12 17 o 3  246.945 3.06712 1110.01     33.5377  1054.12     41.7032  138.664    248.642     77.3229     68.6419     
1 1 1 19 12 18 o 16 31.2344 4.36903 15.047      6.15895  21.0586     7.05762  31.3171    190.091     79.9845     190.091     
1 1 1 19 12 19 o 16 217.93  2.96606 862.674     29.3141  822.667     35.0652  131.335    352.478     47.6702     172.478     
1 1 1 19 12 20 o 17 60.3733 3.02327 68.3699     8.37559  61.6984     9.66026  15.1407    358.781     100.318     358.781     
1 1 1 19 12 21 o 13 385.164 3.79717 2645.2      68.7661  2623.07     77.5194  334.769    193.838     115         193.838     
1 1 1 19 12 22 o 15 193.647 2.63023 668.009     23.9883  662.213     26.9613  58.8039    276.816     157.792     96.8163     
1 1 1 19 12 23 o 6  224.825 2.80657 910.315     30.2997  883.124     32.8473  156.016    180.128     6.28349     0.127791    
1 1 1 19 12 24 o 4  149.089 2.52161 400.537     18.0941  388.208     19.5166  87.7566    21.3605     29.3488     201.361     
1 1 1 19 12 25 o 2  105.357 2.47612 201.86      12.5312  192.358     13.5299  63.8133    101.98      4.56766     281.98      
1 1 1 19 12 26 f 0  263.753 3.01678 1248.88     38.1943  1219.99     41.4468  122.433    129.124     0           0           
1 1 1 19 12 27 o 18 168.159 2.59142 490.25      20.4146  513.046     23.2265  94.4071    217.181     44.9869     37.1813     
1 1 1 19 12 28 o 17 205.735 2.78252 752.125     28.0299  749.748     29.3301  143.391    348.112     1.42504     168.112     
1 1 1 19 12 29 o 13 156.156 2.70305 437.712     20.1702  427.81      22.05    120.309    168.835     29.0155     168.835     
1 1 1 19 12 30 o 1  574.13  5.65814 5835.99     150.798  5913.23     174.091  422.487    322.549     22.7644     322.549     
1 1 1 19 12 31 o 11 287.079 3.24001 1474.33     43.4603  1451.98     49.5188  222.989    171.876     40.1616     171.876     
1 1 1 19 12 32 o 11 204.917 2.81271 754.548     27.6789  735.865     30.0096  154.786    107.148     24.2397     107.148     
1 1 1 19 12 33 o 7  169.406 2.71638 520.51      21.5593  498.168     24.4035  136.712    56.5308     41.7119     56.5308     
1 1 1 19 12 34 o 14 249.419 2.92186 1101.3      36.3598  1107.48     36.6832  197.305    96.4275     44.6159     96.4275     
1 1 1 19 12 35 o 13 258.195 2.94674 1190.32     37.222   1177.08     39.0033  207.987    214.164     53.5734     214.164     
1 1 1 19 12 36 o 15 104.953 2.57288 201.97      13.045   189.603     13.9254  44.2681    292.636     52.8609     112.636     
1 1 1 19 12 37 o 16 256.634 3.12224 1177.2      37.2591  1163.05     42.8212  195.026    97.5811     30.0853     97.5811     
1 1 1 19 12 38 o 15 151.428 2.45404 415.853     18.3813  398.29      18.8451  77.8539    323.444     53.6942     143.443     
1 1 1 19 12 39 o 11 208.697 2.80969 767.82      30.3061  779.67      28.4188  131.989    6.52206     26.8874     186.522     
1 1 1 19 12 40 o 15 205.537 2.6173  734.659     26.1706  766.219     27.7485  157.91     16.295      30.8529     16.295      
1 1 1 19 12 41 f 0  97.9814 2.5616  165.919     12.1129  175.679     13.002   94.6316    275.704     0           0           
1 1 1 19 12 42 o 12 219.395 2.74085 858.044     28.6765  853.055     31.5174  175.291    282.704     47.0164     282.704     
1 1 1 19 12 43 o 10 256.296 2.83761 1172.86     35.5786  1163.47     37.2865  168.698    9.1152      18.6208     189.115     
1 1 1 19 12 44 o 19 199.692 2.67254 715.994     25.9854  702.214     27.4677  130.69     263.854     14.1174     83.8545     
1 1 1 19 12 45 o 2  138.134 2.4127  349.242     16.3271  329.449     17.0224  85.5821    83.1687     16.7686     263.169     
1 1 1 19 12 46 o 17 80.6521 2.68902 118.174     10.5075  113.866     11.1433  42.5408    175.847     19.592      355.847     
1 1 1 19 12 47 o 1  64.5303 2.86813 79.1105     9.10292  69.9743     9.31049  42.8301    65.6391     12.4119     65.6391     
1 1 1 19 12 48 f 0  56.6211 3.07377 60.2179     8.60833  54.8836     8.6823   23.2882    133.431     0           0           
1 1 1 19 12 49 o 17 83.8734 2.63802 126.992     11.0698  124.124     11.0503  51.9808    343.307     4.15439     163.307     
1 1 1 19 12 50 o 13 182.882 2.66744 577.437     23.5817  615.018     25.3179  150.969    154.7       54.0416     154.7       
1 1 1 19 12 51 o 18 156.185 2.57905 407.812     19.2139  462.607     21.1747  116.173    281.063     21.1169     281.063     
1 1 1 19 12 52 o 8  89.5135 2.81037 127.533     12.3585  160.035     12.7041  67.5861    191.83      16.9874     191.83      
1 1 1 19 12 53 o 14 121.473 2.84059 254.065     16.6993  274.031     17.8432  88.6634    141.814     14.2544     141.814     
1 1 1 19 12 54 o 17 52.6489 3.96568 57.3077     10.176   44.1886     10.2487  19.4036    215.425     28.8598     35.4254     
1 1 1 19 12 55 o 1  16.5687 5.07577 -2.51743    7.3127   1.04028     8.26534  13.1743    349.252     40.9179     349.252     
1 1 1 19 12 56 o 16 115.489 2.71079 238.174     14.1475  239.736     17.0543  65.7359    228.312     22.688      48.3124     
1 1 1 19 12 57 o 10 15.6857 5.0601  -2.95943    6.48652  -5.73768    10.8083  1.1536     48.0002     4.69456     48.0002     
1 1 1 19 12 58 o 7  70.2531 3.42889 95.7333     10.737   83.3558     12.9262  53.5451    0.734654    16.9942     0.734654    
1 1 1 19 12 59 o 5  108.532 2.79346 205.357     14.425   218.054     15.9085  75.9949    141.172     8.88985     141.172     
1 1 1 19 12 60 o 6  54.8115 3.47838 56.5845     9.2891   52.9255     9.59229  21.5658    219.569     27.0805     39.5685     
1 1 1 19 12 61 o 6  36.2667 4.92931 31.9453     8.43439  18.7507     8.70622  22.391     358.496     10.6545     358.496     
1 1 1 19 12 62 o 5  31.3576 5.52556 10.8008     9.17972  27.4792     9.03326  10.0993    143.887     15.9309     323.887     
1 1 1 19 12 63 o 14 23.0082 5.97163 10.9242     8.81538  5.55021     9.55303  2.93649    305.021     17.7876     125.021     
1 1 1 19 12 64 o 16 58.0275 3.86914 69.2365     10.9141  55.4011     11.1571  33.8008    68.6192     6.25254     248.619     
1 1 1 19 12 65 o 3  18.1292 5.26925 -0.726556   7.28316  5.67319     8.3236   2.30274    13.1557     5.53984     193.156     
1 1 1 19 12 66 o 14 32.0553 5.7581  22.0833     9.08359  18.9827     9.49586  12.773     164.975     12.219      344.975     
1 1 1 19 12 67 o 12 62.1133 3.503   67.8522     10.6176  74.6287     11.0054  50.258     13.0811     22.8646     13.0811     
1 1 1 19 12 68 o 15 60.9858 3.95541 68.6194     12.4214  70.6242     11.4388  33.9873    90.392      9.01277     270.392     
1 1 1 19 12 69 o 12 23.4903 6.25754 9.89336     11.3535  8.93404     8.73786  5.808      338.485     12.3961     158.485     
1 1 1 19 12 70 o 15 58.7342 4.44363 62.3099     13.8329  69.3505     11.5558  33.1807    97.2768     6.76011     277.277     
1 1 1 19 12 71 o 13 47.693  6.11699 44.7409     14.7889  48.3296     13.2799  31.511     46.4608     6.44326     46.4608     
1 1 1 19 12 72 f 0  26.0538 6.94621 14.8148     13.4058  10.5075     11.3158  19.2351    48.0669     0           0           
1 1 1 19 12 73 o 2  22.5739 6.45086 -0.342561   13.3826  10.919      10.4567  4.96954    44.5418     0.437818    224.542     
1 1 1 19 12 74 o 5  50.929  5.70839 52.8882     14.8043  51.5246     13.3292  36.2063    258.964     11.4158     258.964     
1 1 1 19 12 75 o 14 27.2306 6.9955  14.0504     13.2102  15.5272     11.566   12.9857    201.086     4.51199     201.086     
1 1 1 19 12 76 o 8  26.3441 6.97914 20.1075     13.2841  6.05844     12.5105  11.1537    129.549     3.88466     309.549     
1 1 1 19 12 77 o 11 30.344  7.32913 19.1011     13.4602  22.5638     13.3756  16.2044    264.684     5.06908     264.684     
1 1 1 19 12 78 o 12 20.5873 6.43505 6.01973     12.1146  -5.31274    14.9389  3.34338    259.68      6.72213     79.6805     
1 1 1 19 12 79 o 15 22.3917 6.81256 11.5411     13.3438  -3.08976    15.6438  4.05283    50.3221     5.557       230.322     
1 1 1 19 12 80 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 13 0  o 13 297.132 3.75268 1567.22     55.8391  1567.22     55.8391  259.641    4.78719e-06 80.8597     4.78719e-06 
1 1 1 19 13 1  o 14 485.132 5.11896 4157.75     127.648  4211.05     121.124  376.239    67.8493     40.7083     67.8492     
1 1 1 19 13 2  o 3  121.322 2.76275 263.393     17.1832  259.266     16.3635  58.1456    353.54      49.7975     173.54      
1 1 1 19 13 3  o 18 160.572 2.71511 447.55      21.8038  467.106     21.887   108.253    221.019     8.60165     41.0192     
1 1 1 19 13 4  f 0  209.021 3.09034 781.32      31.4684  768.858     33.2335  139.637    56.984      0           0           
1 1 1 19 13 5  o 14 145.973 2.64026 382.3       19.7422  373.996     18.8525  94.4312    95.0615     13.5722     275.062     
1 1 1 19 13 6  o 5  160.347 2.60483 468.144     20.9089  443.952     20.9422  129.269    356.76      37.2463     356.76      
1 1 1 19 13 7  o 17 452.945 4.61581 3671.61     102.226  3619.56     107.222  373.344    42.1473     83.9397     42.1472     
1 1 1 19 13 8  o 6  86.2234 2.79038 126.5       12.0808  137.904     11.946   40.6894    137.081     14.2705     137.081     
1 1 1 19 13 9  o 1  424.398 4.3917  3189.4      91.1596  3210.2      95.609   383.612    192.594     148.169     192.594     
1 1 1 19 13 10 o 5  89.7419 2.70441 141.211     11.7224  144.998     12.5423  41.7139    265.687     26.664      85.6866     
1 1 1 19 13 11 o 5  149.244 2.7355  383.236     19.3662  407.612     21.5133  141.472    120.981     96.1349     120.981     
1 1 1 19 13 12 o 17 208.664 3.08545 764.416     33.0559  780.622     31.4331  173.206    71.3384     50.9458     71.3384     
1 1 1 19 13 13 o 9  215.526 3.08694 815.64      32.4035  832.726     34.2706  186.045    18.649      67.014      18.649      
1 1 1 19 13 14 o 17 107.279 2.64922 208.362     13.7236  200.414     14.6785  76.796     348.179     26.0427     348.179     
1 1 1 19 13 15 o 19 70.5039 3.07664 90.3597     10.4383  86.7207     11.1644  15.6957    143.88      1.56851     323.88      
1 1 1 19 13 16 o 2  269.58  3.29306 1266.98     47.4561  1312.67     41.1755  257.342    209.456     130.253     209.456     
1 1 1 19 13 17 o 7  46.7469 3.43367 35.1573     7.96995  43.4788     7.77465  23.9695    333.717     93.3154     333.717     
1 1 1 19 13 18 o 18 147.883 2.48043 387.54      18.305   388.159     18.4598  38.5022    131.917     131.434     311.917     
1 1 1 19 13 19 o 12 248.97  3.0809  1085        36.5983  1114.92     40.2395  143.293    242.614     71.0168     62.6139     
1 1 1 19 13 20 o 18 39.5909 4.28586 18.8288     7.93743  40.0515     7.70914  19.0237    1.67119     63.8297     1.67118     
1 1 1 19 13 21 o 16 134.364 2.62579 337.387     16.7346  303.805     18.4353  109.66     19.3259     44.3826     19.3259     
1 1 1 19 13 22 o 13 79.7197 2.68077 106.543     10.2934  119.625     11.0689  22.5106    307.199     51.9798     127.199     
1 1 1 19 13 23 o 7  115.287 2.60576 239.002     14.051   233.018     15.9337  33.8966    294.141     89.4068     114.141     
1 1 1 19 13 24 f 0  204.427 2.75638 735.786     27.0954  747.038     29.3518  151.073    91.036      0           0           
1 1 1 19 13 25 o 9  173.715 2.66125 540.712     22.2265  529.989     24.0527  109.346    75.3612     24.1761     255.361     
1 1 1 19 13 26 o 12 20.2788 5.11611 7.46785     6.34061  4.72116     6.91087  20.7363    197.025     46.0984     197.025     
1 1 1 19 13 27 o 13 163.349 2.54891 476.264     20.0378  470.421     21.6514  137.92     85.3296     53.374      85.3296     
1 1 1 19 13 28 o 5  315.421 3.38819 1746.17     52.4299  1787.32     54.6819  232.8      143.326     15.2381     143.326     
1 1 1 19 13 29 o 14 141.694 2.67143 356.132     18.1576  356.862     19.7167  83.4652    330.859     27.6071     150.859     
1 1 1 19 13 30 o 3  126.492 2.54467 282.589     15.7484  285.647     16.4757  36.2538    120.916     102.289     300.916     
1 1 1 19 13 31 o 13 256.766 2.93196 1158.91     36.9532  1181.98     38.4978  149.609    344.905     65.4298     164.905     
1 1 1 19 13 32 o 3  323.448 3.46006 1843.82     53.7311  1874.33     58.3774  232.148    217.778     4.08187     217.778     
1 1 1 19 13 33 o 8  154.115 2.5851  424.093     19.9426  419.026     19.9877  120.244    160.77      28.3692     160.77      
1 1 1 19 13 34 o 12 68.8158 2.96895 99.5079     9.72749  70.5782     10.3012  25.0639    125.728     13.8484     125.728     
1 1 1 19 13 35 o 10 85.9579 2.71022 128.253     11.5373  134.697     11.7526  9.61107    319.591     97.0351     139.591     
1 1 1 19 13 36 o 14 81.2756 2.89353 118.282     11.4002  117.016     12.0806  52.7829    73.4048     3.94113     73.4048     
1 1 1 19 13 37 o 5  185.603 2.6825  626.3       24.9173  597.636     24.9727  153.044    239.232     48.333      239.232     
1 1 1 19 13 38 o 7  80.4016 2.79994 114.236     11.2056  116.061     11.2884  52.511     162.051     4.17659     162.051     
1 1 1 19 13 39 f 0  116.074 2.66873 237.918     15.0994  241.386     15.9018  95.64      179.666     0           0           
1 1 1 19 13 40 o 18 105.615 2.59264 192.701     13.7093  204.279     13.684   55.5986    129.002     31.555      309.002     
1 1 1 19 13 41 o 14 153.168 2.57931 428.431     19.9181  405.675     19.6736  149.986    173.738     93.5114     173.738     
1 1 1 19 13 42 o 4  89.2936 2.76573 143.731     12.2153  140.471     12.4716  46.8292    102.18      24.8649     282.18      
1 1 1 19 13 43 o 2  107.366 2.71329 220.063     15.3749  191.137     13.7905  41.2936    166.622     63.5306     346.622     
1 1 1 19 13 44 o 5  56.9602 3.27715 49.0758     9.217    68.1883     9.09415  21.5742    96.7665     26.4896     276.767     
1 1 1 19 13 45 o 7  135.967 2.46701 325.682     16.9437  332.545     16.6423  99.4217    242.947     14.3224     242.947     
1 1 1 19 13 46 o 7  128.177 2.40594 283.94      15.5894  301.227     15.2707  96.9308    190.584     21.1972     190.584     
1 1 1 19 13 47 o 1  137.378 2.47727 331.377     16.8388  341.043     17.2441  104.225    113.389     22.949      113.389     
1 1 1 19 13 48 o 4  98.4941 2.60111 175.557     13.1602  170.623     12.471   69.216     325.708     7.977       325.708     
1 1 1 19 13 49 o 10 40.9182 4.27846 31.2751     8.60883  30.2534     8.40986  9.73832    54.6976     28.4865     234.698     
1 1 1 19 13 50 o 7  90.8481 2.76889 155.656     12.0127  139.71      13.0323  56.3057    165.348     8.9813      345.348     
1 1 1 19 13 51 o 17 96.0075 2.73437 168.21      12.8786  161.514     13.3604  62.5182    142.192     3.93428     322.192     
1 1 1 19 13 52 o 12 108.958 2.68854 200.352     14.0943  224.657     15.2282  83.0847    302.513     19.8687     302.513     
1 1 1 19 13 53 o 5  62.4534 3.17636 63.6241     9.54197  77.3492     10.1867  38.6261    327.023     3.77423     147.023     
1 1 1 19 13 54 o 14 74.6035 3.05028 98.6968     11.2968  101.648     11.4137  42.7812    39.7015     12.9399     219.702     
1 1 1 19 13 55 o 1  89.7259 2.91367 127.251     12.7324  163.256     13.3088  46.2205    352.887     27.1337     172.887     
1 1 1 19 13 56 o 1  135.177 2.67265 321.881     18.6543  333.346     17.4746  102.559    104.207     24.1683     104.207     
1 1 1 19 13 57 o 4  31.2024 5.85312 17.5834     8.16544  20.1604     10.4595  9.22121    13.0163     16.9968     193.016     
1 1 1 19 13 58 o 14 74.7819 3.09038 96.0815     10.9584  106.104     12.1107  58.6031    323.242     20.3883     323.242     
1 1 1 19 13 59 o 6  51.4185 4.05649 43.9612     9.15015  53.7877     11.4225  31.775     345.943     1.0433      165.942     
1 1 1 19 13 60 o 17 20.6982 5.64772 -1.18773    8.13303  10.8369     9.35039  4.02172    199.217     29.3505     199.217     
1 1 1 19 13 61 o 14 36.1955 5.43807 29.9688     8.90581  20.8776     10.2183  13.2687    111.071     17.3971     291.071     
1 1 1 19 13 62 o 3  63.338  3.72067 71.87       10.5424  75.423      12.7884  39.904     2.83637     1.66713     182.836     
1 1 1 19 13 63 f 0  86.5475 3.01642 130.78      12.6902  141.05      13.3983  58.8948    71.2721     0           0           
1 1 1 19 13 64 o 2  45.4624 5.36774 28.4165     12.1527  53.2486     10.2535  25.1433    351.76      6.43174     171.76      
1 1 1 19 13 65 o 3  29.8919 5.90677 12.6999     9.65735  22.9443     9.28822  15.3974    338.62      8.62377     338.62      
1 1 1 19 13 66 o 18 23.3148 5.7048  15.6007     9.01411  3.28394     8.21291  4.30851    258.812     16.9028     78.8124     
1 1 1 19 13 67 o 7  65.6595 4.08853 87.0595     15.2949  75.2822     11.2179  40.4977    176.32      2.47587     356.32      
1 1 1 19 13 68 o 9  23.752  6.43256 8.40726     12.7041  9.91899     8.97786  2.18625    248.985     21.7985     68.9854     
1 1 1 19 13 69 o 19 23.963  6.43491 14.6032     12.6977  6.0038      8.59706  8.1691     341.888     3.22206     161.888     
1 1 1 19 13 70 o 2  21.7461 6.10098 7.6028      11.3269  6.2768      8.48004  4.90692    309.113     5.8941      129.113     
1 1 1 19 13 71 o 11 38.4652 6.47195 33.8411     12.7363  28.6814     11.8744  19.0666    358.51      6.77692     178.51      
1 1 1 19 13 72 o 12 24.5909 6.72108 15.2787     11.8231  3.22171     12.7491  8.12515    250.968     1.3009      250.968     
1 1 1 19 13 73 o 18 21.1611 6.4347  4.4736      11.673   0.68483     13.0977  6.12665    317.63      1.74658     137.63      
1 1 1 19 13 74 o 19 35.7981 7.11003 20.2043     12.6601  37.0682     14.477   24.4751    128.631     11.2063     128.631     
1 1 1 19 13 75 o 12 22.6585 6.8028  2.13222     13.5252  8.55296     13.5656  7.71246    178.643     1.51296     358.643     
1 1 1 19 13 76 o 17 21.3809 6.55592 7.72154     12.032   -3.71613    14.9793  4.86187    145.427     2.328       325.427     
1 1 1 19 13 77 o 5  22.1269 6.60859 9.37845     12.7045  3.15173     12.6545  4.50401    64.9911     9.11395     244.991     
1 1 1 19 13 78 o 10 19.0599 6.09095 -4.6953     12.2759  2.63222     12.6988  0.899859   40.1862     3.95574     220.186     
1 1 1 19 13 79 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 14 0  o 6  446.853 4.28935 3544.64     96.0144  3544.64     96.0144  337.358    180         14.3345     180         
1 1 1 19 14 1  o 1  270.985 3.21512 1290.82     43.664   1315.37     43.6567  255.763    322.619     121.102     322.619     
1 1 1 19 14 2  o 1  153.108 2.6273  412.413     20.1502  419.145     20.167   69.639     221.393     77.7332     41.3934     
1 1 1 19 14 3  o 12 115.424 2.59366 247.098     14.9761  226.179     14.969   58.0165    291.588     40.3124     111.588     
1 1 1 19 14 4  o 17 118.776 2.71001 247.342     16.046   253.669     16.1732  71.2685    143.645     17.0566     323.645     
1 1 1 19 14 5  o 7  72.4269 2.86874 94.6122     10.5846  92.0912     10.1569  23.472     263.009     30.5606     83.0093     
1 1 1 19 14 6  o 15 230.89  2.95853 960.79      34.234   930.916     34.2252  161.28     192.355     10.509      12.3555     
1 1 1 19 14 7  o 17 73.1446 2.86412 90.5471     10.2138  99.9716     10.7005  27.3044    137.815     17.0525     317.815     
1 1 1 19 14 8  o 7  221.063 2.939   885.02      34.0187  849.152     31.084   203.701    3.46096     93.5027     3.46096     
1 1 1 19 14 9  o 18 188.931 2.75529 637.987     26.0501  628.379     26.1229  182.21     308.745     103.027     308.745     
1 1 1 19 14 10 o 15 186.028 2.72815 626.42      26.5784  601.427     24.2753  127.42     113.027     9.56217     293.027     
1 1 1 19 14 11 o 2  312.017 3.3918  1760.68     54.1857  1695.66     51.8902  216.981    235.687     20.0505     55.6868     
1 1 1 19 14 12 o 6  189.687 2.77252 641.131     26.3383  635.437     26.3721  166.426    342.381     67.1027     342.381     
1 1 1 19 14 13 o 16 92.8104 2.73294 154.167     12.9222  151.964     12.443   19.4761    86.5863     84.3291     266.586     
1 1 1 19 14 14 o 4  44.8245 3.86949 40.8883     8.48114  31.8283     8.42268  7.71694    154.147     41.1784     154.147     
1 1 1 19 14 15 o 4  455.05  4.60176 3654.05     102.395  3709.09     107.458  402.066    7.98906     140.777     7.98906     
1 1 1 19 14 16 o 13 414.662 4.42304 3022.14     87.2119  3090.67     96.4728  301.15     4.09722     1.92539     184.097     
1 1 1 19 14 17 o 3  312.431 3.47542 1715.62     51.8635  1750.44     56.8966  238.73     171.683     25.4337     171.683     
1 1 1 19 14 18 o 16 236.999 3.01613 997.115     34.1111  996.332     37.4544  165.89     355.558     8.04271     175.558     
1 1 1 19 14 19 o 12 109.858 2.65669 219.662     13.8232  209.088     15.3038  58.7679    73.4358     28.2385     253.436     
1 1 1 19 14 20 o 17 82.153  3.07903 125.096     10.9847  115.232     13.9509  22.9081    344.621     57.8856     164.621     
1 1 1 19 14 21 o 7  441.632 4.60232 3429.66     101.843  3507.85     101.865  319.242    58.8463     2.55508     238.846     
1 1 1 19 14 22 o 15 87.5723 2.71812 136.084     11.6149  136.558     12.1786  10.9478    161.509     94.1553     341.509     
1 1 1 19 14 23 o 4  103.143 2.57855 199.765     12.6232  178.46      13.8588  76.4546    281.67      31.5149     281.67      
1 1 1 19 14 24 f 0  82.6849 2.66859 118.16      10.4605  124.992     11.5928  93.934     304.827     0           0           
1 1 1 19 14 25 o 8  168.204 2.57249 492.995     20.7142  510.99      22.6412  132.076    337.996     30.7319     337.996     
1 1 1 19 14 26 o 5  40.4507 3.96425 31.6205     7.44886  27.7169     8.09343  6.43285    25.4283     34.6579     25.4283     
1 1 1 19 14 27 o 3  119.08  2.54292 255.409     15.1037  248.273     15.2078  71.4497    98.2495     18.4155     278.25      
1 1 1 19 14 28 o 11 220.639 2.89733 883.176     29.9018  845.478     33.942   148.729    304.79      16.0822     124.79      
1 1 1 19 14 29 o 15 185.982 2.60168 613.45      22.8554  614.31      25.567   168.958    73.3851     78.8686     73.3851     
1 1 1 19 14 30 f 0  166.916 2.62847 510.286     20.7064  479.017     23.1082  83.7092    58.6837     0           0           
1 1 1 19 14 31 o 15 213.471 2.83163 829.713     27.6634  788.918     32.581   155.825    215.805     9.28452     215.805     
1 1 1 19 14 32 o 18 56.4281 3.38285 59.3195     8.66059  54.7434     10.1454  24.122     1.59059     4.31867     181.591     
1 1 1 19 14 33 o 18 56.1793 3.33628 56.8712     8.90968  56.1452     9.67882  23.9097    118.555     9.42232     298.555     
1 1 1 19 14 34 o 1  134.963 2.54777 326.042     16.2382  321.129     18.1374  123.153    146.274     63.9643     146.274     
1 1 1 19 14 35 o 9  98.3196 2.8009  184.292     13.2209  160.216     14.1847  58.2585    127.3       15.5139     307.3       
1 1 1 19 14 36 o 10 139.437 2.5081  349.852     16.4872  341.085     18.4619  101.937    76.6563     11.5882     76.6563     
1 1 1 19 14 37 o 11 203.452 2.75956 738.882     27.0017  732.599     29.2161  167.133    116.306     49.5331     116.306     
1 1 1 19 14 38 o 1  105.454 2.66763 203.542     12.9245  192.371     15.0703  86.5518    178.212     33.8077     178.212     
1 1 1 19 14 39 o 17 220.972 2.86742 869.822     30.355   867.436     33.088   179.627    296.219     50.0508     296.219     
1 1 1 19 14 40 o 14 223.029 2.78306 904.353     30.4757  865.794     31.6866  193.852    331.886     76.4478     331.886     
1 1 1 19 14 41 o 16 67.0953 2.93768 83.0312     9.70447  77.9344     9.93674  43.3166    41.4954     4.71134     41.4954     
1 1 1 19 14 42 o 5  90.0263 2.61446 150.711     11.5353  138.336     11.9653  58.594     315.232     1.98797     135.232     
1 1 1 19 14 43 o 2  71.0481 2.90157 82.4561     10.3958  98.3912     10.0822  54.8096    34.2562     30.8144     34.2562     
1 1 1 19 14 44 o 14 194.696 2.7455  653.755     27.8376  697.332     25.596   166.663    126.416     64.8032     126.416     
1 1 1 19 14 45 o 15 95.8631 2.756   166.759     13.4725  161.387     12.9532  64.5507    344.161     1.9724      344.161     
1 1 1 19 14 46 o 7  115.307 2.77614 229.125     16.7219  245.738     15.2082  82.2095    322.18      8.59932     322.18      
1 1 1 19 14 47 o 6  38.7212 4.63842 26.7527     8.83339  28.8208     8.506    15.392     218.819     5.90365     38.8189     
1 1 1 19 14 48 o 16 94.7173 2.83702 155.812     13.9311  165.197     12.8776  71.6648    87.5471     16.253      87.5471     
1 1 1 19 14 49 o 12 26.1497 5.1937  7.90817     7.64801  17.1751     7.14646  1.34685    165.084     24.269      345.084     
1 1 1 19 14 50 o 8  116.483 2.51632 231.71      15.2121  253.231     14.0298  75.0627    59.5895     8.33049     239.589     
1 1 1 19 14 51 o 11 30.0314 5.20491 22.5017     8.12106  12.0223     7.73616  8.4485     182.267     15.4012     2.26685     
1 1 1 19 14 52 o 4  68.4475 3.12373 88.3164     10.7209  80.6266     10.5827  38.6401    92.6779     13.2642     272.678     
1 1 1 19 14 53 o 13 24.2984 5.44435 13.0458     7.7213   8.5438      7.27754  4.46924    321.562     5.68902     141.562     
1 1 1 19 14 54 o 14 20.4763 5.4635  -0.173197   7.5539   10.5231     8.55429  0.156811   272.425     15.405      272.425     
1 1 1 19 14 55 o 14 27.7398 5.77363 15.0596     7.92725  14.192      9.2584   3.95282    158.264     23.2034     338.264     
1 1 1 19 14 56 o 15 82.17   3.15959 121.06      12.5571  122.962     13.3589  45.9086    246.191     17.263      66.1909     
1 1 1 19 14 57 o 8  61.492  3.57573 71.5319     10.4488  66.3853     11.3218  36.5737    216.363     6.67522     36.3629     
1 1 1 19 14 58 o 3  32.4515 6.00245 20.537      9.0235   20.632      10.754   17.1726    273.062     5.53917     273.062     
1 1 1 19 14 59 o 7  30.6684 5.64204 22.2163     8.70455  14.3994     9.06964  15.9306    259.761     4.07909     259.761     
1 1 1 19 14 60 f 0  20.0853 5.59813 2.69094     7.99972  6.97385     8.69177  9.74537    170.216     0           0           
1 1 1 19 14 61 o 17 25.1972 5.91089 10.4497     8.19286  13.3167     9.23443  9.69497    181.998     1.65891     181.998     
1 1 1 19 14 62 o 16 120.83  2.97856 251.976     18.4751  277.649     17.4374  75.1822    199.18      9.12296     19.1804     
1 1 1 19 14 63 o 8  99.2032 3.03646 180.094     15.6709  178.017     14.4274  69.7445    263.269     9.57407     263.269     
1 1 1 19 14 64 o 18 48.9172 4.80114 39.6507     11.0359  52.6657     11.7571  33.0008    200.166     4.71012     200.166     
1 1 1 19 14 65 o 12 24.2275 6.79795 2.77488     15.7364  11.4924     10.1766  9.48594    242.528     0.211165    62.5279     
1 1 1 19 14 66 o 1  39.6171 6.78562 36.4468     14.1489  30.0041     12.5326  25.1511    272.374     3.38429     272.374     
1 1 1 19 14 67 o 16 38.4044 6.1893  29.0999     12.6911  31.8589     10.6331  26.2136    333.289     8.57121     333.289     
1 1 1 19 14 68 o 13 41.0169 5.76578 26.2127     11.8007  42.8172     10.9483  23.6544    90.1489     1.65543     270.149     
1 1 1 19 14 69 o 17 19.5532 5.7356  10.5816     10.6718  -7.24379    9.14351  2.34812    294.3       8.93771     114.3       
1 1 1 19 14 70 o 14 23.5746 6.63798 5.27607     11.2005  11.7089     12.4615  7.43151    274.042     1.93394     94.042      
1 1 1 19 14 71 o 18 45.8889 6.14694 44.5509     12.9092  42.2607     14.2763  27.0479    167.398     1.56499     347.398     
1 1 1 19 14 72 o 5  29.4726 6.92944 25.1445     12.6972  11.0297     12.174   15.2234    351.688     1.20256     171.688     
1 1 1 19 14 73 o 12 30.8901 7.13061 17.0423     12.5949  24.8287     13.0364  16.8375    189.083     0.439355    189.083     
1 1 1 19 14 74 o 19 20.9717 6.31314 9.63689     11.9435  -4.85291    12.4232  2.8545     1.83286     15.4455     181.833     
1 1 1 19 14 75 o 7  14.8895 5.10212 -19.3531    11.131   -10.4528    12.2564  0.891317   95.8502     8.95089     95.8502     
1 1 1 19 14 76 o 16 30.8868 7.60555 20.5807     13.5011  25.936      15.3751  15.2761    34.5462     2.26275     34.5462     
1 1 1 19 14 77 o 7  22.6557 6.79375 10.7212     12.7404  3.08288     14.5777  4.18333    58.3551     4.65825     238.355     
1 1 1 19 14 78 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 15 0  o 7  210.184 2.70717 783.977     28.4938  783.977     28.4938  161.191    180         11.2491     180         
1 1 1 19 15 1  o 9  125.102 2.4909  277.737     15.6339  277.851     15.5676  85.7128    305.458     2.60532     305.458     
1 1 1 19 15 2  o 18 340.393 3.5389  2051.32     60.3671  2062.95     60.3692  296.134    30.218      94.9226     30.218      
1 1 1 19 15 3  o 8  128.443 2.53357 294.325     16.6426  291.352     15.9373  113.218    199.442     72.5896     199.442     
1 1 1 19 15 4  o 12 41.1589 3.766   32.1587     7.60226  29.0491     7.55358  32.149     161.429     102.951     161.429     
1 1 1 19 15 5  o 15 129.906 2.61051 292.409     16.9129  306.832     17.0374  57.793     263.635     65.844      83.6347     
1 1 1 19 15 6  o 6  174.111 2.77847 541.284     24.8086  534.328     23.6712  126.558    295.741     6.60355     295.741     
1 1 1 19 15 7  o 19 115.257 2.60458 239.902     15.0345  231.882     15.0121  42.9775    48.5868     72.9409     228.587     
1 1 1 19 15 8  f 0  287.503 3.42469 1462.33     50.4945  1472.48     48.1545  128.226    203.494     0           0           
1 1 1 19 15 9  o 12 161.144 2.6968  462.803     21.2616  458.512     22.278   136.551    67.0541     50.4599     67.0541     
1 1 1 19 15 10 o 8  146.035 2.64607 382.027     19.3138  375.096     19.3825  84.6632    63.9887     35.3548     243.989     
1 1 1 19 15 11 o 15 246.17  3.05186 1088.2      37.6443  1062.7      37.6509  150.298    25.5015     56.4323     205.502     
1 1 1 19 15 12 o 13 108.667 2.56122 209.744     13.6264  209.64      14.2235  68.0511    132.584     6.10991     312.584     
1 1 1 19 15 13 o 9  315.073 3.42411 1763.35     55.2092  1761.57     52.8976  270.674    297.991     83.7792     297.991     
1 1 1 19 15 14 o 16 371.697 3.8291  2454.6      69.7583  2453.78     72.8588  343.81     154.617     146.597     154.617     
1 1 1 19 15 15 f 0  269.333 3.10849 1286.52     42.8347  1288.42     41.058   192.907    201.307     0           0           
1 1 1 19 15 16 o 1  149.526 2.67681 392.697     20.038   401.133     20.0446  98.1833    192.185     12.4491     12.1846     
1 1 1 19 15 17 o 7  201.389 2.84977 716.027     29.9923  723.33      27.4605  97.8691    298.27      93.8781     118.27      
1 1 1 19 15 18 o 14 306.401 3.37603 1676.36     52.9533  1657.62     50.7117  197.521    178.908     49.8295     358.908     
1 1 1 19 15 19 o 14 218.162 2.80767 872.072     30.6368  817.494     30.7284  166.4      256.074     20.857      256.074     
1 1 1 19 15 20 o 7  113.344 2.60221 239.018     14.2487  217.568     15.1888  65.7872    248.597     21.167      68.597      
1 1 1 19 15 21 o 3  159.664 2.91852 460.167     23.8721  445.429     22.7939  124.149    222.571     26.05       222.571     
1 1 1 19 15 22 o 10 174.264 2.86914 535.222     23.6801  542.795     26.3777  80.2072    352.988     87.9289     172.988     
1 1 1 19 15 23 o 1  207.266 2.93097 764.522     29.6151  760.684     31.2464  131.573    180.427     33.2334     0.426607    
1 1 1 19 15 24 o 17 238.855 3.19202 1013.87     36.1631  1012.63     40.1469  202.731    166.054     64.195      166.054     
1 1 1 19 15 25 o 8  150.114 2.65872 395.106     18.9374  405.113     21.0151  66.0552    238.537     80.3052     58.5367     
1 1 1 19 15 26 o 7  95.0689 2.73652 160.49      12.8862  160.932     13.1336  75.2621    290.943     48.8987     290.943     
1 1 1 19 15 27 o 13 233.68  3.15778 973.56      35.0176  966.692     38.8287  241.629    4.16098     152.771     4.16098     
1 1 1 19 15 28 o 9  139.893 2.60552 340.205     17.8065  355.175     18.6963  83.2071    192.766     30.092      12.7655     
1 1 1 19 15 29 o 3  152.853 2.5556  412.059     18.4409  417.507     20.6619  139.671    211.535     67.6421     211.535     
1 1 1 19 15 30 o 15 141.119 2.55123 343.926     17.0504  363.637     19.008   76.7959    27.6683     44.8265     207.668     
1 1 1 19 15 31 o 19 163.632 2.57025 476.174     19.8293  474.815     22.2505  130.279    16.6362     31.0497     16.6362     
1 1 1 19 15 32 o 16 150.861 2.71205 408.092     18.1877  400.923     22.521   94.4553    253.776     22.9677     73.7762     
1 1 1 19 15 33 o 3  114.903 2.62516 229.15      14.5909  240.519     15.6031  98.089     314.095     41.9094     314.095     
1 1 1 19 15 34 o 1  225.534 2.89705 915.87      31.3521  892.994     34.0412  187.642    329.116     56.246      329.116     
1 1 1 19 15 35 o 19 157.128 2.59228 444.275     19.2031  433.278     21.5233  121.95     207.526     24.6593     207.526     
1 1 1 19 15 36 o 4  132.753 2.50522 304.742     16.0767  322.209     17.2294  105.479    322.779     28.1303     322.779     
1 1 1 19 15 37 o 16 103.949 2.60627 188.771     12.7641  195.996     14.3267  81.3082    333.689     23.1365     333.689     
1 1 1 19 15 38 o 18 98.054  2.70307 174.803     12.4733  167.846     13.9622  83.9566    19.8385     39.2946     19.8385     
1 1 1 19 15 39 o 10 46.3461 3.83098 37.1299     8.37409  40.7202     9.0907   18.0739    337.706     0.282046    157.706     
1 1 1 19 15 40 o 19 138.399 2.58101 346.837     17.2615  335.205     18.4758  85.8934    269.148     20.0299     89.1476     
1 1 1 19 15 41 o 19 164.556 2.66753 482.568     21.2134  481.86      22.754   143.343    101.126     59.3549     101.126     
1 1 1 19 15 42 o 14 115.083 2.93871 239.41      16.8901  233.621     16.9484  81.6181    82.6039     6.7677      82.6039     
1 1 1 19 15 43 o 5  109.187 2.69982 205.225     14.2875  220.367     15.2174  89.6808    341.294     33.1084     341.295     
1 1 1 19 15 44 o 1  61.0331 3.38081 74.7707     10.1628  59.7323     10.2341  21.655     197.914     36.0416     17.9135     
1 1 1 19 15 45 o 19 52.0495 3.48269 46.7884     8.88292  51.1648     9.06164  25.5605    33.1539     13.8902     213.154     
1 1 1 19 15 46 o 12 121.884 2.58447 282.041     15.3106  248.826     16.116   75.2933    282.403     17.1028     102.403     
1 1 1 19 15 47 o 7  51.5268 3.56798 48.5162     8.96694  47.7063     9.21845  30.4436    18.3603     5.26018     198.36      
1 1 1 19 15 48 o 9  106.695 2.67147 201.79      14.4786  205.43      14.0361  86.1838    314.155     27.3028     314.155     
1 1 1 19 15 49 f 0  21.584  5.12491 0.65215     7.09629  13.3391     7.33849  17.4636    36.5558     0           0           
1 1 1 19 15 50 o 18 171.06  2.60386 523.977     21.891   522.4       22.7425  135.837    208.315     37.077      208.315     
1 1 1 19 15 51 o 15 33.3478 5.21605 23.2456     8.15566  19.1969     8.83342  9.97154    139.387     19.6633     319.387     
1 1 1 19 15 52 o 8  20.7267 5.45646 6.78483     7.72413  5.95684     7.43713  0.321981   285.998     14.7317     105.998     
1 1 1 19 15 53 o 15 68.5355 3.31689 86.7663     11.6069  83.4275     11.0408  43.3286    204.581     3.98442     24.5809     
1 1 1 19 15 54 f 0  35.4214 5.28648 30.0955     9.62451  18.5859     8.63945  39.9906    349.698     0           0           
1 1 1 19 15 55 o 16 30.9025 5.33467 20.3554     8.56284  16.6025     7.83669  11.706     335.633     11.6361     155.633     
1 1 1 19 15 56 o 19 26.3087 5.38773 19.156      8.22424  7.00656     7.60532  9.45968    246.504     2.64819     66.5044     
1 1 1 19 15 57 o 9  36.0346 5.43517 18.3449     9.8463   32.3854     9.29563  23.5786    359.86      10.736      359.86      
1 1 1 19 15 58 o 3  26.6181 6.16802 16.1295     9.34543  10.0147     9.98372  10.6065    358.944     5.16416     178.944     
1 1 1 19 15 59 f 0  23.7071 6.06757 10.2411     9.29286  8.78101     9.25863  1.91362    88.8206     0           0           
1 1 1 19 15 60 o 18 62.4192 4.03734 75.4628     13.0874  69.191      11.8963  39.4722    350.121     2.3779      170.121     
1 1 1 19 15 61 o 19 47.6782 5.15811 47.6184     12.1613  40.2768     11.6745  33.7886    271.913     7.73979     271.913     
1 1 1 19 15 62 o 15 36.7721 5.87999 27.9817     9.65189  26.3475     11.5235  3.99155    19.867      38.6384     199.867     
1 1 1 19 15 63 o 16 36.5839 5.84979 25.5953     9.14844  28.5571     11.8021  9.46538    162.521     26.8854     342.521     
1 1 1 19 15 64 o 2  56.5919 4.6794  57.0704     10.5463  66.0958     15.2416  28.1359    35.9833     16.4482     215.983     
1 1 1 19 15 65 o 8  19.1494 5.82474 -3.75482    8.76806  6.54424     11.549   1.28002    74.4369     15.7427     254.437     
1 1 1 19 15 66 o 1  67.3645 4.15424 82.7995     13.5069  89.0409     14.2649  53.2662    92.9536     21.1716     92.9536     
1 1 1 19 15 67 o 2  30.3146 6.3353  28.7096     11.0627  8.38966     11.6331  16.4556    168.847     3.47411     168.847     
1 1 1 19 15 68 o 15 36.4486 6.62486 25.0791     12.2333  31.7927     12.2171  17.2216    154.323     8.30342     334.323     
1 1 1 19 15 69 o 17 17.3402 5.53579 1.91661     10.1262  -12.0594    11.2778  2.56328    276.875     21.5074     276.875     
1 1 1 19 15 70 o 10 24.6176 6.63043 14.3402     11.169   6.07905     12.0961  10.5935    146.583     1.3796      146.583     
1 1 1 19 15 71 o 11 22.4499 6.46474 11.8442     11.4861  -0.832418   12.4806  6.02476    7.73341     1.02249     7.73341     
1 1 1 19 15 72 o 16 37.1127 6.94903 32.5194     13.1639  28.6627     13.1282  26.4715    178.797     12.4435     178.797     
1 1 1 19 15 73 o 15 18.1018 5.82101 -11.5488    12.3419  2.22386     11.5536  2.23328    182.766     9.63309     2.7663      
1 1 1 19 15 74 o 2  20.0194 6.0831  10.4924     11.7431  -9.64053    11.9922  3.36326    145.839     8.66851     325.839     
1 1 1 19 15 75 o 19 20.1889 6.34749 -1.10663    12.4623  4.32087     13.3619  2.29868    38.8707     10.2156     218.871     
1 1 1 19 15 76 f 0  17.6322 5.77617 -14.0962    12.1153  2.18736     12.6847  4.71906    220.294     0           0           
1 1 1 19 15 77 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 16 0  o 14 25.0945 6.32036 14.7468     7.24468  14.7468     7.24468  15.466     1.04592e-05 36.9828     1.04592e-05 
1 1 1 19 16 1  o 9  352.956 3.61958 2211.28     64.0327  2213.59     64.0144  249.866    156.546     19.0911     336.546     
1 1 1 19 16 2  o 2  153.055 2.55201 404.596     19.5571  426.633     19.5822  61.5972    219.516     95.9127     39.5164     
1 1 1 19 16 3  o 7  232.988 2.8874  971.111     33.7027  955.376     33.7219  159.512    187.605     19.557      7.60454     
1 1 1 19 16 4  o 17 157.962 2.61121 439.472     20.1934  445.825     21.1431  136.737    81.6478     54.5087     81.6478     
1 1 1 19 16 5  o 4  140.021 2.57685 350.117     17.6704  345.942     18.4488  103.381    147.548     13.0285     147.548     
1 1 1 19 16 6  o 1  138.524 2.57726 344.496     18.273   336.795     17.4771  104.139    240.614     17.3381     240.614     
1 1 1 19 16 7  o 4  209.903 2.73298 794.226     28.7601  769.285     28.7319  99.6484    264.462     105.712     84.4623     
1 1 1 19 16 8  o 3  131.759 2.72932 317.297     17.5791  299.39      18.3811  94.7879    32.0527     8.7774      32.0527     
1 1 1 19 16 9  o 19 333.306 3.49764 2001.67     58.427   1944.2      58.4085  288.189    146.821     89.1483     146.821     
1 1 1 19 16 10 o 1  78.587  2.73524 109.296     10.7036  110.393     10.7748  12.3387    183.426     77.7418     3.42593     
1 1 1 19 16 11 o 10 148.919 2.67018 391.16      19.8994  396.283     19.9228  108.537    142.861     8.77048     142.861     
1 1 1 19 16 12 o 3  130.561 2.69493 307.454     17.6386  297.996     17.5868  85.1017    260.914     10.3911     80.914      
1 1 1 19 16 13 o 9  105.497 2.66426 195.016     14.0312  200.448     14.0938  43.7428    108.543     56.6539     288.543     
1 1 1 19 16 14 o 6  480.128 5.10064 4123        125.918  4088.5      119.477  359.362    290.623     13.8327     290.623     
1 1 1 19 16 15 o 14 106.182 2.81979 188.735     14.1874  212.359     15.7814  72.4682    171.167     5.83567     171.167     
1 1 1 19 16 16 o 9  252.282 3.21959 1109.75     39.7538  1150.75     41.6583  155.157    349.987     56.0943     169.987     
1 1 1 19 16 17 o 18 138.595 2.72306 350.82      19.2785  331.611     18.5138  107.434    83.1668     23.5586     83.1668     
1 1 1 19 16 18 o 3  148.709 2.60956 395.362     19.8935  389.742     18.9803  95.8727    46.2112     18.0263     226.211     
1 1 1 19 16 19 f 0  242.777 3.06663 1039.89     35.5982  1053.34     38.9666  185.703    69.1411     0           0           
1 1 1 19 16 20 o 3  118.884 2.55565 251.062     15.2333  251.027     15.1833  64.1299    69.0388     37.034      249.039     
1 1 1 19 16 21 o 9  181.395 2.7079  588.345     24.0326  579.84      25.1769  125.474    104.163     8.38706     284.163     
1 1 1 19 16 22 o 5  108.517 2.77467 208.878     14.957   209.807     15.1716  39.7715    179.159     71.9334     359.159     
1 1 1 19 16 23 o 7  20.3194 5.32941 2.88411     6.81967  8.24507     7.81156  42.0704    188.39      98.4989     188.39      
1 1 1 19 16 24 o 13 47.375  3.7715  45.1736     8.36903  35.9527     9.01365  3.62862    135.179     44.9965     315.179     
1 1 1 19 16 25 o 5  258.824 3.08041 1223.05     38.9858  1158.01     40.8299  211.069    34.6342     49.0476     34.6342     
1 1 1 19 16 26 o 6  206.979 2.9818  775.595     30.8553  746.919     30.9916  193.242    81.5713     91.719      81.5713     
1 1 1 19 16 27 o 14 102.567 2.80881 191.946     14.2687  182.455     14.5361  92.0667    20.0808     71.5872     20.0809     
1 1 1 19 16 28 o 3  110.37  2.73437 223.96      14.9632  209.518     15.2157  104.501    337.508     65.8073     337.508     
1 1 1 19 16 29 o 19 121.996 2.72297 273.263     16.4867  256.28      16.7439  92.4001    48.2488     16.0901     48.2488     
1 1 1 19 16 30 o 1  39.8255 4.77014 22.3797     8.92927  36.6694     9.19871  11.3676    10.2968     68.4388     10.2969     
1 1 1 19 16 31 o 5  45.716  4.1187  44.0274     9.12323  32.2144     9.10735  13.5113    109.484     13.7207     289.484     
1 1 1 19 16 32 o 1  53.7035 3.61693 54.7942     9.1632   49.0087     9.97055  19.5283    61.0603     6.55008     61.0603     
1 1 1 19 16 33 o 9  57.5743 3.45522 52.7074     9.5706   66.6849     10.1266  30.2753    225.125     5.7672      45.125      
1 1 1 19 16 34 o 16 76.2533 3.09673 93.2544     10.808   115.069     12.7873  60.8028    237.119     30.0459     237.119     
1 1 1 19 16 35 o 15 171.714 2.66742 527.146     21.6201  521.888     24.2006  128.296    22.3757     14.6092     22.3757     
1 1 1 19 16 36 o 6  132.978 2.75923 325.324     17.1846  304.859     19.3942  100.059    147.593     15.2493     147.593     
1 1 1 19 16 37 o 10 141.073 2.63682 363.099     17.6681  345.703     19.4937  109.62     220.001     22.9903     220.001     
1 1 1 19 16 38 o 3  171.8   2.70549 517.437     22.4798  533.91      24.0995  148.992    129.777     58.0318     129.777     
1 1 1 19 16 39 o 19 75.8152 3.1272  104.209     11.5124  101.657     12.1292  44.0166    52.7388     11.7331     232.739     
1 1 1 19 16 40 o 1  130.871 2.68781 308.72      16.9236  302.207     18.2529  105.452    282.924     30.9775     282.924     
1 1 1 19 16 41 o 13 153.174 2.72855 413.134     20.2461  423.754     21.6169  103.319    231.321     6.68787     51.321      
1 1 1 19 16 42 o 4  38.4256 4.55215 24.53       7.98723  30.266      8.93264  9.60621    53.8927     0.675425    53.8927     
1 1 1 19 16 43 o 4  58.4128 3.3492  62.6883     9.47597  60.2936     9.94416  23.5608    300.379     29.8979     120.379     
1 1 1 19 16 44 o 11 35.2344 4.74527 24.3196     7.89875  22.0946     8.23335  8.00031    69.5093     3.22021     69.5093     
1 1 1 19 16 45 o 9  79.7919 2.75069 118.125     10.6399  109.95      11.249   55.0427    85.6285     1.79637     85.6285     
1 1 1 19 16 46 o 14 102.947 2.63209 187.802     13.7627  191.325     13.3427  71.4141    140.446     1.46206     140.446     
1 1 1 19 16 47 o 2  117.108 2.63005 239.017     15.2058  251.818     15.6256  91.8581    224.305     22.9067     224.305     
1 1 1 19 16 48 o 14 78.2108 2.97334 111.092     11.3175  108.912     11.8899  55.7472    111.919     6.14895     111.919     
1 1 1 19 16 49 o 17 18.5778 5.23389 3.62549     7.31679  3.53779     7.32526  0.263977   153.586     5.43467     153.586     
1 1 1 19 16 50 o 7  38.219  4.74368 26.4745     8.60133  28.5359     8.90816  24.5779    330.178     6.73527     330.178     
1 1 1 19 16 51 o 13 44.2255 4.76126 36.4865     10.0816  36.8434     10.3573  27.3023    104.506     0.46682     284.506     
1 1 1 19 16 52 o 2  77.7422 2.97535 107.293     11.737   110.774     11.3478  46.1321    79.5766     12.2251     259.577     
1 1 1 19 16 53 o 2  23.9694 5.73405 10.6532     8.74913  9.89535     7.63331  5.31265    40.3076     11.3636     220.308     
1 1 1 19 16 54 o 10 47.5624 4.4933  43.642      11.1874  40.8306     9.67525  31.3875    102.249     2.74431     102.249     
1 1 1 19 16 55 o 8  82.2129 3.25238 118.758     12.9925  126.48      13.7034  55.7087    6.34379     1.66491     6.3438      
1 1 1 19 16 56 o 2  20.4809 5.74134 4.29031     8.67429  5.65578     8.87134  1.57955    153.335     1.50564     333.335     
1 1 1 19 16 57 o 4  88.0749 3.13697 136.246     13.7769  145.339     13.8154  58.9334    279.525     0.277592    279.525     
1 1 1 19 16 58 o 18 50.3286 4.07911 45.6777     9.49453  48.7615     10.701   43.7774    264.658     24.9543     264.658     
1 1 1 19 16 59 o 13 39.7105 5.74205 29.7662     9.35428  32.6688     12.681   26.3046    112.782     3.86707     112.782     
1 1 1 19 16 60 o 2  46.8651 5.16158 36.3923     10.7892  49.3358     12.6793  29.3308    192.321     1.05095     12.3207     
1 1 1 19 16 61 o 16 104.559 2.98995 194.641     15.2854  204.064     15.9861  83.3459    51.5998     28.3358     51.5998     
1 1 1 19 16 62 o 7  32.2784 5.96352 27.0106     9.36216  15.3227     10.8588  16.7437    263.569     4.68576     83.5685     
1 1 1 19 16 63 o 13 46.2953 4.81663 36.5096     10.4766  47.1388     11.1309  37.2327    324.299     18.0412     324.299     
1 1 1 19 16 64 o 4  53.2365 4.49386 58.7716     11.0949  50.1786     12.1672  23.3654    219.332     21.6147     39.3319     
1 1 1 19 16 65 o 17 26.6276 7.29584 15.0017     12.6767  9.75147     15.5954  8.34038    54.909      2.62926     54.909      
1 1 1 19 16 66 o 12 75.512  4.17071 106.378     14.9847  110.174     16.3166  53.3445    262.182     9.85331     262.182     
1 1 1 19 16 67 o 13 21.8028 6.14873 -1.11664    10.5197  12.352      10.7828  5.82189    295.356     6.08191     115.356     
1 1 1 19 16 68 o 19 54.1155 5.0647  49.0507     13.1691  66.7594     13.3065  40.6364    339.458     14.1253     339.458     
1 1 1 19 16 69 o 3  18.6101 5.83822 2.62344     11.0435  -5.29968    10.936   4.01213    245.981     5.93276     65.9806     
1 1 1 19 16 70 o 15 42.4359 6.35164 38.2184     13.2424  38.2201     12.9293  28.8803    296.032     6.9553      296.032     
1 1 1 19 16 71 o 14 19.0216 5.93129 -10.9124    11.8079  6.61306     11.5375  3.18529    297.788     10.8147     117.788     
1 1 1 19 16 72 o 2  20.0139 6.20566 4.71544     11.8934  -1.63224    12.1681  4.04439    249.304     2.92614     69.3041     
1 1 1 19 16 73 o 11 24.406  6.60612 21.0877     12.5645  -1.99038    12.6252  8.29551    346.42      1.50268     166.42      
1 1 1 19 16 74 o 10 37.8264 7.25632 35.6743     14.4498  33.4794     13.755   23.2119    61.2586     6.06937     61.2586     
1 1 1 19 16 75 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 16 76 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 17 0  o 19 111.167 2.65887 219.873     14.7743  219.873     14.7743  96.8075    180         30.6447     180         
1 1 1 19 17 1  o 15 315.646 3.43051 1757.57     53.0625  1781.64     55.4554  238.858    30.3994     13.7157     30.3994     
1 1 1 19 17 2  o 5  146.201 2.62126 378.45      19.6334  380.32      18.7472  82.4311    65.3619     43.4656     245.362     
1 1 1 19 17 3  o 9  140.736 2.58893 342.407     17.8427  361.033     18.6479  68.4555    260.638     63.7146     80.6375     
1 1 1 19 17 4  o 12 247.433 3.11233 1102.37     40.3096  1071.65     36.8405  176.073    338.983     9.36722     158.983     
1 1 1 19 17 5  o 9  132.256 2.52937 310.347     16.7972  310.775     16.7006  36.7217    322.176     115.692     142.176     
1 1 1 19 17 6  o 15 187.269 2.78851 610.784     24.9732  634.11      27.3496  59.0696    18.479      154.722     198.479     
1 1 1 19 17 7  o 7  277.955 3.36632 1378.44     50.1562  1366        43.4107  204.482    43.5276     1.86799     43.5278     
1 1 1 19 17 8  o 16 93.1088 2.80288 158.268     12.4315  150.071     13.5993  59.7623    119.842     37.2406     119.842     
1 1 1 19 17 9  f 0  261.907 3.06305 1205.58     40.1917  1230.28     40.212   152.759    271.893     0           0           
1 1 1 19 17 10 o 5  210.813 2.77842 794.594     29.3283  783.019     29.3766  171.806    113.381     38.8961     113.381     
1 1 1 19 17 11 o 5  17.5775 5.06468 -0.391317   7.06438  3.94716     7.16703  45.1433    147.313     99.0449     147.313     
1 1 1 19 17 12 o 14 78.0111 2.83018 106.817     10.9713  109.818     11.0834  41.7544    37.393      12.3151     217.393     
1 1 1 19 17 13 o 7  359.477 3.77872 2270.4      66.5832  2324.75     69.5585  296.086    4.13465     64.644      4.13465     
1 1 1 19 17 14 o 17 126.522 2.55489 287.993     16.2015  280.665     16.1625  77.697     54.8507     22.4848     234.851     
1 1 1 19 17 15 o 18 233.375 3.00267 969.836     36.6494  964.624     33.5237  182.132    256.581     25.2088     256.581     
1 1 1 19 17 16 o 18 116.102 2.8687  231.221     16.3151  248.216     17.0175  105.088    305.615     57.0117     305.615     
1 1 1 19 17 17 o 13 39.8477 4.84399 29.984      9.0568   28.2267     9.56974  6.62735    263.048     49.7935     263.048     
1 1 1 19 17 18 o 10 17.531  5.2228  -1.1067     8.15542  1.90243     7.59435  34.2606    22.6513     77.5228     22.6513     
1 1 1 19 17 19 o 18 124.026 2.76575 264.446     17.5234  282.546     16.7659  89.2317    142.708     4.48541     142.708     
1 1 1 19 17 20 o 16 247.101 3.10279 1092.88     38.4224  1077.11     38.4215  185.611    307.513     12.0753     307.513     
1 1 1 19 17 21 o 12 86.2891 2.94611 133.572     12.7233  131.611     12.6809  35.5216    307.832     47.3677     127.832     
1 1 1 19 17 22 o 5  215.898 3.07837 826.85      31.6163  830.081     34.9203  191.079    339.299     71.1229     339.299     
1 1 1 19 17 23 o 15 43.8404 4.372   36.8735     9.32638  33.0638     9.32609  6.08302    296.766     63.6979     296.766     
1 1 1 19 17 24 o 15 131.988 2.59655 313.046     16.3708  306.301     17.8926  113.067    183.092     42.0334     183.092     
1 1 1 19 17 25 o 5  158.606 2.73662 452.367     20.6109  441.954     22.7885  110.064    214.602     6.22423     34.6023     
1 1 1 19 17 26 o 11 105.706 2.65914 194.541     14.033   203.084     14.0912  86.038     5.91124     28.5122     5.91124     
1 1 1 19 17 27 o 5  95.7287 2.69235 167.577     12.7462  158.726     13.0181  84.5467    84.5238     45.1704     84.5238     
1 1 1 19 17 28 o 19 125.602 2.55604 281.937     15.3879  279.195     16.721   113.537    152.618     53.9689     152.618     
1 1 1 19 17 29 o 7  149.989 2.55817 410.078     18.7424  389.968     19.6546  113.568    214.927     14.8776     214.927     
1 1 1 19 17 30 o 6  77.2098 2.97756 106.786     10.9711  106.028     11.9575  57.1001    222.254     15.5107     222.254     
1 1 1 19 17 31 o 10 72.1846 3.51449 104.018     11.723   83.2872     13.196   43.9743    323.87      6.06787     143.87      
1 1 1 19 17 32 o 1  87.2314 3.39827 130.263     14.054   142.105     15.5486  53.1578    185.147     12.2491     5.1472      
1 1 1 19 17 33 o 14 228.37  3.15309 921.352     34.1538  938.048     37.9477  160.003    162.86      6.46028     342.86      
1 1 1 19 17 34 o 13 95.0576 2.98864 165.516     14.4705  157.24      13.9341  64.6932    133.52      0.374157    313.519     
1 1 1 19 17 35 o 7  198.181 3.07178 685.063     30.7154  716.165     30.2776  145.911    222.911     10.4713     222.911     
1 1 1 19 17 36 o 10 148.927 2.72029 399.991     21.0049  390.874     19.5545  115.214    10.929      21.6228     10.929      
1 1 1 19 17 37 o 16 156.567 2.65422 438.603     21.0093  434.924     20.6415  144.666    26.4505     71.2189     26.4505     
1 1 1 19 17 38 o 6  149.005 2.56226 391.933     19.2869  399.166     18.9738  111.643    196.785     14.7575     196.785     
1 1 1 19 17 39 o 11 131.839 2.76426 296.876     18.2698  324.034     18.1861  94.501     82.4167     5.15918     82.4167     
1 1 1 19 17 40 o 9  92.1197 2.78946 156.998     12.9146  146.533     12.7735  64.2706    34.9709     2.51277     34.9709     
1 1 1 19 17 41 o 11 144.777 2.57898 375.777     18.5046  372.151     18.8982  124.305    332.294     46.452      332.294     
1 1 1 19 17 42 o 18 83.433  2.813   122.54      11.6052  126.771     11.8507  60.0912    50.7583     5.72302     50.7583     
1 1 1 19 17 43 o 12 76.2699 3.0902  107.411     11.6331  101.677     11.875   69.6751    52.3784     37.7155     52.3784     
1 1 1 19 17 44 o 9  29.3572 5.50729 13.9811     8.36253  18.7887     8.21871  10.3751    248.49      8.07305     68.4897     
1 1 1 19 17 45 o 14 13.4472 4.38933 -9.6217     7.10581  -2.48013    6.9852   3.28141    97.1421     9.71928     97.1421     
1 1 1 19 17 46 o 13 59.2443 3.54946 67.7728     10.4026  59.7991     10.437   39.0146    65.1578     0.561637    245.157     
1 1 1 19 17 47 o 6  38.9185 4.86842 24.8321     9.10171  32.4573     9.12254  8.2276     86.4918     33.7252     266.492     
1 1 1 19 17 48 o 6  75.5394 3.22007 112.965     12.1248  93.7625     12.0614  45.1276    266.621     12.2775     86.6214     
1 1 1 19 17 49 o 1  47.6487 4.58465 41.048      10.2442  43.6138     11.0842  31.6219    26.9342     2.61176     26.9341     
1 1 1 19 17 50 o 4  25.2095 6.14982 8.48415     9.32488  13.8236     9.711    2.10642    91.4652     0.165609    271.465     
1 1 1 19 17 51 o 2  77.3976 3.43822 111.25      13.3391  106.434     13.1955  42.0843    221.138     20.5789     41.1375     
1 1 1 19 17 52 o 9  35.7457 5.6143  25.0867     9.5076   24.5326     10.0842  20.3515    225.196     1.2239      45.1964     
1 1 1 19 17 53 o 2  84.4491 3.25703 125.201     13.5046  133.607     13.9592  69.2499    169.798     25.3739     169.798     
1 1 1 19 17 54 o 7  112.615 2.74622 227.749     14.7781  229.228     16.1446  97.1666    235.804     42.1131     235.804     
1 1 1 19 17 55 o 7  24.9837 5.73292 13.5508     8.40742  9.83545     8.09622  0.0715511  153.095     29.7661     333.096     
1 1 1 19 17 56 o 16 81.6343 2.96623 120.022     11.9657  121.748     12.2228  51.9288    139.697     5.68822     319.697     
1 1 1 19 17 57 o 17 87.1548 2.96688 137.884     12.9675  138.062     12.8729  67.9182    81.1244     19.3736     81.1244     
1 1 1 19 17 58 o 12 15.2926 4.80923 0.767409    7.52929  -5.64973    7.56115  2.50322    88.8532     18.6045     88.8532     
1 1 1 19 17 59 o 18 52.1102 4.29107 60.4996     9.99233  42.8604     11.2987  42.8082    283.856     19.1501     283.856     
1 1 1 19 17 60 o 14 35.8856 6.02515 28.8419     10.4071  23.9126     11.0004  7.56732    65.5937     30.4846     245.594     
1 1 1 19 17 61 o 5  64.5474 3.85322 72.0891     10.9935  84.3694     13.698   48.3204    253.214     12.6672     253.214     
1 1 1 19 17 62 o 7  20.833  6.0105  6.83804     8.25347  2.25257     12.0722  1.37399    89.2234     19.5801     269.223     
1 1 1 19 17 63 o 10 18.0919 5.50468 2.30718     8.09238  -0.180462   10.0497  2.02554    240.568     8.58998     60.5677     
1 1 1 19 17 64 o 15 21.6418 6.22533 8.62934     10.8122  3.22536     10.5445  5.34333    93.061      6.88078     273.061     
1 1 1 19 17 65 o 1  18.7844 5.95142 -11.9479    12.4089  3.86243     11.7564  2.1171     145.65      4.74559     325.65      
1 1 1 19 17 66 o 6  81.2993 4.27726 120.323     17.7556  131.781     16.733   62.1161    82.6402     19.3177     82.6402     
1 1 1 19 17 67 o 6  26.645  7.03344 12.6124     13.9748  14.5974     11.4592  13.1678    85.6657     0.747535    265.666     
1 1 1 19 17 68 o 8  26.8279 6.71745 7.25944     11.914   20.7181     11.7918  14.2181    273.535     4.32987     273.535     
1 1 1 19 17 69 o 13 32.8303 7.04882 23.2069     12.8717  25.1325     12.3961  15.7752    74.1197     6.92998     254.12      
1 1 1 19 17 70 o 6  28.8225 7.17887 20.2179     12.9618  16.741      12.871   15.0562    75.0289     0.195981    255.029     
1 1 1 19 17 71 o 17 35.9054 7.0289  37.8609     13.6672  22.5963     13.1325  16.615     65.1674     8.8668      245.167     
1 1 1 19 17 72 o 7  22.7747 6.63008 6.88014     12.1353  10.5071     12.3201  5.6907     39.0701     8.02342     219.07      
1 1 1 19 17 73 o 18 24.827  6.96951 14.1396     13.0029  11.6258     12.9018  6.85597    179.56      2.01574     359.56      
1 1 1 19 17 74 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 18 0  o 19 124.527 2.64773 275.744     16.4895  275.744     16.4895  120.598    180         56.2178     180         
1 1 1 19 18 1  o 18 43.9421 3.97052 35.1754     8.52911  34.632      8.55817  7.21657    50.2198     60.1265     50.2198     
1 1 1 19 18 2  o 10 103.93  2.62687 192.48      13.637   191.454     13.6821  62.4258    272.232     18.8797     92.2324     
1 1 1 19 18 3  o 10 70.2273 2.97425 86.9284     10.3805  88.8704     10.4584  30.963     117.942     25.9671     297.942     
1 1 1 19 18 4  f 0  117.332 2.72687 241.923     15.9997  247.409     16.0233  147.316    206.179     0           0           
1 1 1 19 18 5  o 17 159.531 2.71377 460.702     21.7076  443.006     21.6788  76.2804    115.963     79.2984     295.963     
1 1 1 19 18 6  o 13 119.767 2.56378 261.857     15.3767  247.901     15.3555  48.9413    195.55      73.3647     15.5496     
1 1 1 19 18 7  o 16 101.207 2.82943 177.014     14.6684  187.382     13.9363  57.3271    276.099     25.7274     96.099      
1 1 1 19 18 8  o 2  83.7312 2.93047 121.72      12.2589  127.95      12.2518  38.3443    200.571     36.6641     20.5708     
1 1 1 19 18 9  o 16 174.894 2.6244  549.72      23.002   536.324     22.9996  150.456    143.571     48.8701     143.571     
1 1 1 19 18 10 o 2  171.122 2.6818  534.87      23.4655  505.128     22.534   137.557    163.489     28.0446     163.489     
1 1 1 19 18 11 o 2  284.574 3.19876 1439.04     45.6271  1439.15     45.6092  185.56     93.3044     47.8766     273.304     
1 1 1 19 18 12 o 17 56.4884 3.43831 59.1693     9.7124   55.1654     9.56017  25.3914    279.222     5.15374     99.2221     
1 1 1 19 18 13 o 7  86.5944 2.83811 134.247     12.4878  132.689     12.0763  64.0199    264.599     14.2817     264.599     
1 1 1 19 18 14 o 5  105.41  2.6514  198.302     13.9569  196.795     14.0104  93.7196    122.226     46.1951     122.226     
1 1 1 19 18 15 o 3  182.698 2.67123 595.982     24.4561  589.531     24.4575  147.139    246.513     29.7069     246.513     
1 1 1 19 18 16 o 5  97.1621 2.93301 168.844     13.5741  167.251     14.8849  59.2731    219.919     16.1635     39.9186     
1 1 1 19 18 17 o 6  70.6124 3.0902  84.2255     11.0431  93.8475     10.6696  47.3478    209.96      9.6119      209.96      
1 1 1 19 18 18 o 18 74.445  2.98565 102.748     11.0869  94.9751     11.0856  21.0958    47.7818     59.517      227.782     
1 1 1 19 18 19 o 14 213.124 2.78456 810.795     29.7193  803.458     29.761   161.508    248.913     13.1508     248.913     
1 1 1 19 18 20 o 14 149.67  2.63235 398.371     19.752   397.574     19.7362  81.8211    166.137     52.1127     346.137     
1 1 1 19 18 21 o 3  99.6418 2.75328 180.449     14.0322  173.026     13.4131  64.5278    202.6       9.18829     22.5996     
1 1 1 19 18 22 o 1  42.8482 4.50119 36.4612     9.36295  30.6649     9.32568  3.65955    152.703     57.9179     152.703     
1 1 1 19 18 23 o 18 59.8797 4.08357 51.9431     11.748   78.5946     12.0628  28.2274    300.397     17.6384     120.397     
1 1 1 19 18 24 o 8  110.293 2.83053 218.907     15.1905  214.318     16.0256  39.4822    68.4908     77.8605     248.491     
1 1 1 19 18 25 o 9  55.3535 4.07197 51.6973     11.0731  59.023      11.1481  17.0745    352.265     35.8012     172.265     
1 1 1 19 18 26 o 10 158.685 2.71576 456.389     21.5855  439.356     21.6016  94.8949    171.403     38.1265     351.403     
1 1 1 19 18 27 o 6  37.1743 5.14578 32.9389     8.45726  18.8907     9.81132  5.49089    121.408     17.1766     301.408     
1 1 1 19 18 28 o 6  132.226 2.69238 300.855     17.6667  321.951     17.9713  107.292    331.405     28.1014     331.405     
1 1 1 19 18 29 o 6  69.9968 3.30193 86.9836     11.1922  88.5466     11.8362  34.4072    4.73664     24.9159     184.737     
1 1 1 19 18 30 o 6  74.5829 3.2827  105.338     11.5397  94.0512     12.7408  51.4384    94.4182     4.74187     94.4182     
1 1 1 19 18 31 o 13 80.0311 3.11969 118.588     13.0447  110.64      11.8844  41.2508    37.3989     26.7819     217.399     
1 1 1 19 18 32 f 0  55.3365 3.59634 55.3965     9.30925  55.0305     10.3756  60.0908    321.889     0           0           
1 1 1 19 18 33 o 1  96.7497 2.69019 159.571     12.984   174.655     13.0337  73.9915    43.0599     15.8521     43.0599     
1 1 1 19 18 34 o 8  131.203 2.61766 307.924     17.2112  305.958     17.1774  135.935    338.322     92.818      338.322     
1 1 1 19 18 35 o 8  62.0585 3.34822 77.15       10.267   61.8188     10.2914  45.4969    4.89689     19.2623     4.89689     
1 1 1 19 18 36 o 1  73.3427 3.1794  99.2352     11.2328  93.8339     11.9833  28.1838    324.263     43.9031     144.263     
1 1 1 19 18 37 o 2  148.999 2.65314 408.799     20.2683  383.566     19.3412  118.56     289.284     26.9547     289.284     
1 1 1 19 18 38 o 11 127.909 2.70903 294.498     17.226   290.027     17.4614  97.8336    325.929     15.9002     325.929     
1 1 1 19 18 39 o 17 145.311 3.10846 382.539     21.5258  374.042     23.617   116.279    160.761     27.5421     160.761     
1 1 1 19 18 40 o 1  35.1889 5.58551 25.8694     10.217   21.339      9.01754  18.006     353.262     3.01995     173.262     
1 1 1 19 18 41 f 0  14.7536 4.67924 -1.87009    7.21609  -4.34348    7.16368  18.8118    67.4602     0           0           
1 1 1 19 18 42 o 12 30.5806 5.4911  17.151      8.48702  18.5728     8.38066  9.6044     270.214     2.19473     270.214     
1 1 1 19 18 43 o 11 52.9839 3.87832 49.3971     10.3949  53.1977     9.8556   44.0529    199.139     21.4236     199.139     
1 1 1 19 18 44 o 15 26.243  5.92715 13.7507     8.82852  11.6551     8.79812  2.6397     101.984     0.305308    281.984     
1 1 1 19 18 45 o 14 111.994 2.80795 221.44      15.3025  229.14      16.1659  84.9686    193.301     14.6112     193.301     
1 1 1 19 18 46 f 0  17.7424 5.29694 3.22293     8.04824  -1.75121    8.32484  5.20758    199.301     0           0           
1 1 1 19 18 47 o 11 79.6225 3.12303 107.201     12.6042  122.146     12.1405  68.5499    41.1228     29.4716     41.1228     
1 1 1 19 18 48 o 1  83.8294 3.08705 120.974     13.1252  133.124     12.671   50.1123    110.556     14.6149     290.556     
1 1 1 19 18 49 o 1  64.5494 3.2711  70.4953     10.3789  81.0036     10.6177  42.2268    265.85      2.28253     85.8497     
1 1 1 19 18 50 o 13 42.8392 4.50725 39.0274     9.57801  30.1029     9.11187  27.7575    266.179     1.57412     266.179     
1 1 1 19 18 51 o 5  76.0962 3.04172 109.752     11.4846  100.017     11.5938  64.3971    208.805     26.8155     208.805     
1 1 1 19 18 52 o 18 49.2821 4.34995 43.5595     10.6781  47.1822     10.2983  32.2165    25.8208     0.261926    25.8209     
1 1 1 19 18 53 o 1  77.6106 3.17647 115.848     11.9673  103.3       12.5571  73.422     77.0899     43.581      77.0899     
1 1 1 19 18 54 o 18 112.909 2.70723 233.894     15.2713  226.514     15.3174  83.2174    62.8725     12.7491     62.8725     
1 1 1 19 18 55 o 2  86.9808 3.01034 150.684     12.621   124.994     13.3624  51.3145    333.628     15.0564     153.628     
1 1 1 19 18 56 o 12 25.7906 5.89427 12.8679     8.61483  12.9977     8.74999  8.09834    302.652     14.068      122.652     
1 1 1 19 18 57 o 7  70.5599 3.45752 88.5778     12.1897  95.1979     12.0928  41.5002    166.953     11.3545     346.953     
1 1 1 19 18 58 o 14 53.4969 4.01445 56.1696     10.4849  51.6433     10.6801  25.2301    333.392     20.1131     153.392     
1 1 1 19 18 59 o 17 32.551  5.61234 11.691      9.10526  32.3723     10.0485  18.0823    323.346     2.90402     143.346     
1 1 1 19 18 60 o 15 23.757  6.22687 6.2691      9.87056  13.512      10.1787  5.6862     226.036     15.1895     46.0364     
1 1 1 19 18 61 o 14 23.5171 5.93681 9.27844     8.86004  11.4108     8.85467  8.99436    1.49803     1.47372     181.498     
1 1 1 19 18 62 o 4  16.3977 5.13812 2.79729     8.10324  -9.33517    9.67231  0.508245   213.686     4.10258     33.6858     
1 1 1 19 18 63 o 1  30.8008 6.35457 9.45723     11.5865  29.7841     11.2196  8.66946    258.312     5.19139     258.312     
1 1 1 19 18 64 o 18 23.7249 6.63455 2.21154     10.9708  15.2566     12.9688  8.5089     177.332     0.798227    357.332     
1 1 1 19 18 65 o 8  15.7871 5.22454 -10.9499    10.232   -4.75824    10.501   0.278335   86.91       10.9997     266.91      
1 1 1 19 18 66 o 2  41.1036 6.60562 29.0276     13.0725  44.0435     13.7227  21.0903    263.994     9.00163     83.9939     
1 1 1 19 18 67 o 13 43.1007 6.26236 44.7826     12.8222  34.3247     13.3131  27.4211    200.912     1.69062     200.912     
1 1 1 19 18 68 o 18 20.7204 6.2974  1.91651     11.8437  5.03075     11.7724  4.41579    152.117     0.0700938   332.117     
1 1 1 19 18 69 o 4  17.3687 5.67256 -8.0778     11.7013  -1.95074    11.555   0.0131294  66.8112     15.3726     66.8108     
1 1 1 19 18 70 o 3  45.9521 6.39406 42.8428     14.2098  51.0948     14.1699  36.429     151.732     20.123      151.732     
1 1 1 19 18 71 o 15 38.9942 7.05373 30.6499     13.9748  42.2713     13.998   26.6997    232.661     12.6307     232.661     
1 1 1 19 18 72 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 18 73 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 19 19 0  o 1  168.747 3.74399 506.591     31.5908  506.591     31.5908  128.188    1.88258e-05 4.75552     1.88257e-05 
1 1 1 19 19 1  o 15 15.1473 6.37149 4.41953     8.46303  4.41953     8.46303  2.57856    29.9999     5.77151     29.9999     
1 1 1 19 19 2  o 13 45.686  4.31844 39.0176     9.39266  39.0176     9.39266  9.38598    240         84.1418     240         
1 1 1 19 19 3  o 13 27.3306 7.05742 17.7256     8.90616  17.7256     8.90616  1.86814    270         6.85013     270         
1 1 1 19 19 4  o 5  141.628 2.62526 356.536     18.6041  356.536     18.6041  95.7678    120         19.5577     300         
1 1 1 19 19 5  o 15 83.7619 2.86261 125.349     11.952   125.349     11.952   73.4504    330         24.218      330         
1 1 1 19 19 6  o 15 143.956 2.59689 368.312     18.707   368.312     18.707   137.113    360         59.7838     360         
1 1 1 19 19 7  o 17 22.3731 7.0959  12.913      8.48809  12.913      8.48809  32.511     30          84.3839     30          
1 1 1 19 19 8  o 14 57.417  3.62219 59.9238     10.2227  59.9238     10.2227  34.9884    60          3.64301     240         
1 1 1 19 19 9  o 5  229.533 3.03076 935.995     34.835   935.995     34.835   148.872    270         43.7537     90          
1 1 1 19 19 10 o 11 53.5151 3.61943 52.2374     9.48998  52.2374     9.48998  26.0961    120         131.579     120         
1 1 1 19 19 11 o 3  32.4397 6.04109 22.2062     8.4849   22.2062     8.4849   3.73519    330         30.034      330         
1 1 1 19 19 12 o 13 114.347 2.64806 232.723     15.1376  232.723     15.1376  103.622    1.06879e-06 37.4483     1.06879e-06 
1 1 1 19 19 13 o 3  63.8317 3.26648 73.468      10.3207  73.468      10.3207  18.8704    30          11.6863     30          
1 1 1 19 19 14 o 4  15.456  6.29202 5.35647     7.81403  5.35647     7.81403  1.29747    240         2.95663     240         
1 1 1 19 19 15 o 5  292.446 3.25353 1519.77     47.6562  1519.77     47.6562  248.279    90          63.1841     90          
1 1 1 19 19 16 o 15 34.0026 5.94789 23.995      8.77269  23.995      8.77269  0.621114   300         7.65702     120         
1 1 1 19 19 17 o 14 97.0953 2.86354 168.206     13.8783  168.206     13.8783  84.9819    330         26.5044     330         
1 1 1 19 19 18 o 4  10.3764 4.94916 -3.3818     7.45483  -3.3818     7.45483  11.6382    8.75781e-06 24.6437     8.75781e-06 
1 1 1 19 19 19 o 5  297.494 3.42956 1573.71     51.0995  1573.71     51.0995  199.412    30          40.3755     210         
1 1 1 19 19 20 o 2  52.4443 3.81208 50.4236     9.75557  50.4236     9.75557  30.0387    60          7.16668     60          
1 1 1 19 19 21 o 15 31.3649 6.31447 21.2993     8.59831  21.2993     8.59831  0.0783234  90.0001     9.8037      270         
1 1 1 19 19 22 o 15 15.6196 6.57994 4.72248     9.05091  4.72248     9.05091  18.2294    300         42.6604     300         
1 1 1 19 19 23 o 8  173.554 2.93426 535.892     25.4878  535.892     25.4878  165.122    150         75.209      150         
1 1 1 19 19 24 o 9  154.628 3.24364 426.068     25.0851  426.068     25.0851  152.743    180         78.5553     180         
1 1 1 19 19 25 o 3  9.20667 4.60037 -10.5207    8.60927  -10.5207    8.60927  9.34443    30          19.73       30          
1 1 1 19 19 26 o 9  64.7812 3.66786 76.0938     11.7266  76.0938     11.7266  27.6684    60          39.3195     240         
1 1 1 19 19 27 o 19 50.5629 4.21021 47.4086     10.2806  47.4086     10.2806  26.6049    90          16.883      270         
1 1 1 19 19 28 o 19 13.9438 6.08405 2.69138     8.33602  2.69138     8.33602  7.91679    300         18.2397     300         
1 1 1 19 19 29 o 13 24.8704 6.92893 15.2622     8.2914   15.2622     8.2914   16.36      150         57.8621     150         
1 1 1 19 19 30 o 2  22.0963 7.07656 12.7502     8.44491  12.7502     8.44491  1.23336    8.60299e-06 4.26939     8.60299e-06 
1 1 1 19 19 31 o 9  47.9278 4.64779 43.2681     10.5679  43.2681     10.5679  24.9712    210         14.515      30          
1 1 1 19 19 32 o 19 56.9399 3.45454 58.9929     9.68386  58.9929     9.68386  46.7652    240         23.8814     240         
1 1 1 19 19 33 o 3  130.448 2.65629 303.229     17.3324  303.229     17.3324  95.5189    270         2.28909     270         
1 1 1 19 19 34 o 14 9.21689 4.50447 -5.53134    7.04881  -5.53134    7.04881  0.0962168  300.008     0.209263    300.008     
1 1 1 19 19 35 o 15 55.5456 3.76737 56.5375     10.2512  56.5375     10.2512  36.5924    330         6.72471     150         
1 1 1 19 19 36 f 0  38.0986 5.28451 28.7996     8.9816   28.7996     8.9816   65.65      180         0           0           
1 1 1 19 19 37 o 1  127.583 2.78279 290.5       17.7541  290.5       17.7541  85.1267    30          12.9263     210         
1 1 1 19 19 38 o 8  139.926 2.81574 349.426     19.7086  349.426     19.7086  123.788    240         47.0904     240         
1 1 1 19 19 39 o 13 116.574 3.04877 243.219     17.7556  243.219     17.7556  133.119    270         99.5667     270         
1 1 1 19 19 40 o 5  132.609 2.86069 314.205     18.9709  314.205     18.9709  106.852    120         24.5193     120         
1 1 1 19 19 41 f 0  22.1912 7.39649 13.2283     9.27431  13.2283     9.27431  17.5295    150         0           0           
1 1 1 19 19 42 o 3  36.147  6.56507 27.8452     10.2782  27.8452     10.2782  17.7558    1.82549e-05 10.9056     1.82549e-05 
1 1 1 19 19 43 o 2  113.211 2.77314 229.342     15.6904  229.342     15.6904  101.177    30          41.9511     30          
1 1 1 19 19 44 o 19 14.1535 5.93248 4.1946      7.28943  4.1946      7.28943  4.45372    60          16.0841     60          
1 1 1 19 19 45 o 2  13.1465 5.7069  2.74702     7.24736  2.74702     7.24736  1.73595    90.0001     5.81711     90.0001     
1 1 1 19 19 46 f 0  21.6645 6.90005 12.4659     8.0269   12.4659     8.0269   2.77301    120         0           0           
1 1 1 19 19 47 o 11 12.0701 5.43647 0.945457    7.24472  0.945457    7.24472  0.708455   150         2.17514     150         
1 1 1 19 19 48 o 3  20.0145 6.79248 10.8587     7.85687  10.8587     7.85687  2.8532     1.19407e-05 5.44582     180         
1 1 1 19 19 49 o 18 79.1746 3.222   113.348     12.6865  113.348     12.6865  63.1432    30          15.8065     30          
1 1 1 19 19 50 o 17 11.7897 5.43101 -0.341687   7.77926  -0.341687   7.77926  2.00234    240         6.68596     240         
1 1 1 19 19 51 o 17 11.2257 5.25577 -1.51082    7.74714  -1.51082    7.74714  5.25002    270         16.6825     270         
1 1 1 19 19 52 o 14 67.0546 3.54297 82.2198     11.7493  82.2198     11.7493  58.0207    300         23.254      300         
1 1 1 19 19 53 o 4  27.129  7.0269  18.1387     8.81474  18.1387     8.81474  17.4684    330         0.218292    330         
1 1 1 19 19 54 o 2  74.4826 3.2965  100.986     12.1928  100.986     12.1928  46.2667    180         9.93051     8.65617e-06 
1 1 1 19 19 55 o 12 22.5441 7.18223 13.8813     8.69693  13.8813     8.69693  11.5107    210         2.44301     30          
1 1 1 19 19 56 o 12 10.0316 4.85244 -4.31763    7.70316  -4.31763    7.70316  3.67482    60          11.4567     60          
1 1 1 19 19 57 o 14 13.5673 5.97182 2.85321     8.20579  2.85321     8.20579  0.206641   270         3.44376     270         
1 1 1 19 19 58 o 11 85.1025 3.10861 131.608     13.1765  131.608     13.1765  54.7322    120         6.16837     300         
1 1 1 19 19 59 o 1  27.433  7.31425 19.1939     9.41209  19.1939     9.41209  17.0181    330         7.15709     330         
1 1 1 19 19 60 o 13 38.793  6.65844 32.6766     11.2173  32.6766     11.2173  14.2989    1.86195e-06 23.7629     180         
1 1 1 19 19 61 o 19 10.8126 5.18184 -3.39963    8.36543  -3.39963    8.36543  4.29578    30          12.79       30          
1 1 1 19 19 62 o 14 14.9884 6.68877 3.22739     10.678   3.22739     10.678   0.318315   240         8.70107     240         
1 1 1 19 19 63 o 19 47.7131 5.94139 46.2504     12.8908  46.2504     12.8908  40.3516    270         16.9716     270         
1 1 1 19 19 64 o 11 15.4358 6.86349 3.75119     11.1313  3.75119     11.1313  1.40932    300         9.83472     120         
1 1 1 19 19 65 o 1  52.8988 5.30054 55.1847     13.2387  55.1847     13.2387  45.3576    150         20.5308     150         
1 1 1 19 19 66 o 12 57.4152 5.71954 65.7876     15.5185  65.7876     15.5185  51.6434    0           27.3849     0           
1 1 1 19 19 67 o 19 13.3589 6.29453 -1.35744    11.4116  -1.35744    11.4116  6.52895    210         26.9247     210         
1 1 1 19 19 68 f 0  14.8158 6.7769  2.29432     11.8209  2.29432     11.8209  11.9084    240         0           0           
1 1 1 19 19 69 o 6  52.256  7.5051  60.462      17.3965  60.462      17.3965  45.7315    90          23.2543     90          
1 1 1 19 19 70 o 16 35.8813 9.62684 36.8637     16.2573  36.8637     16.2573  24.7892    300         5.13145     300         
1 1 1 19 19 71 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 0  0  o 10 1012.51 11.3906 18192.6     577.639  18192.6     577.639  642.729    3.58072e-06 189.247     180         
1 1 1 20 0  1  o 13 77.6334 2.14087 107.278     8.30029  107.278     8.30029  7.4458     59.9999     23.0906     59.9999     
1 1 1 20 0  2  o 12 14.52   5.10048 5.49577     4.48689  5.49577     4.48689  7.96465    299.999     16.0788     299.999     
1 1 1 20 0  3  o 15 128.35  2.38443 292.509     15.3132  292.509     15.3132  17.1525    360         25.8423     180         
1 1 1 20 0  4  f 0  89.9313 2.34126 143.889     10.5191  143.889     10.5191  127.739    60          0           0           
1 1 1 20 0  5  o 11 960.86  7.46121 16375.9     359.18   16375.9     359.18   823.221    300         247.929     300         
1 1 1 20 0  6  o 13 50.9437 2.62832 46.7173     6.62627  46.7173     6.62627  147.421    8.44109e-06 334.586     8.44109e-06 
1 1 1 20 0  7  o 17 310.972 2.92646 1714.51     45.588   1714.51     45.588   304.662    60          159.846     60          
1 1 1 20 0  8  o 18 163.43  2.19969 473.782     18.0011  473.782     18.0011  87.2394    120         4.30057     300         
1 1 1 20 0  9  o 8  125.983 2.28272 281.789     14.3906  281.789     14.3906  12.423     2.87434e-05 11.1483     180         
1 1 1 20 0  10 o 7  318.43  3.14108 1797.87     50.1028  1797.87     50.1028  156.161    240         150.186     60          
1 1 1 20 0  11 o 7  446.373 4.45092 3533.43     99.5207  3533.43     99.5207  273.494    300         100.979     120         
1 1 1 20 0  12 o 9  111.938 2.2292  222.555     12.4827  222.555     12.4827  4.56035    360         140.761     360         
1 1 1 20 0  13 o 14 93.643  2.27862 155.934     10.6645  155.934     10.6645  39.6693    240         185.807     240         
1 1 1 20 0  14 f 0  330.795 3.44749 1940.45     57.1229  1940.45     57.1229  101.231    300         0           0           
1 1 1 20 0  15 o 5  412.517 3.80024 3017.38     78.5321  3017.38     78.5321  327.842    360         58.5822     360         
1 1 1 20 0  16 o 16 138.318 2.23957 339.542     15.5056  339.542     15.5056  62.9143    240         53.6349     60          
1 1 1 20 0  17 o 1  162.764 2.29925 470         18.7377  470         18.7377  72.3698    120         87.1578     300         
1 1 1 20 0  18 o 16 846.484 6.86439 12712.6     291.107  12712.6     291.107  449.281    360         323.34      180         
1 1 1 20 0  19 o 3  443.14  4.02018 3482.25     89.2455  3482.25     89.2455  332.787    240         26.553      240         
1 1 1 20 0  20 o 1  248.499 2.7465  1095.1      34.1842  1095.1      34.1842  114.545    120         128.865     300         
1 1 1 20 0  21 o 11 92.2949 2.25686 151.487     10.4103  151.487     10.4103  48.2354    180         222.086     180         
1 1 1 20 0  22 o 2  230.285 2.59736 940.484     29.9578  940.484     29.9578  207.685    60          85.3166     60          
1 1 1 20 0  23 o 10 28.9871 4.19958 16.6348     5.39247  16.6348     5.39247  59.6209    120         129.413     120         
1 1 1 20 0  24 o 10 379.445 3.63537 2553.37     69.1001  2553.37     69.1001  158.835    180         226.259     8.65064e-06 
1 1 1 20 0  25 o 14 792.799 6.89637 11157.1     273.903  11157.1     273.903  601.97     60          69.0104     60          
1 1 1 20 0  26 o 3  139.785 2.42344 346.894     16.9536  346.894     16.9536  11.2864    300         177.006     120         
1 1 1 20 0  27 o 8  115.193 2.38715 235.756     13.7537  235.756     13.7537  63.5527    180         4.64285     180         
1 1 1 20 0  28 o 11 89.5965 2.36802 142.856     10.5988  142.856     10.5988  9.61035    60          90.0342     240         
1 1 1 20 0  29 o 1  311.587 3.28235 1722.03     51.2281  1722.03     51.2281  226.062    300         8.72812     300         
1 1 1 20 0  30 f 0  280.1   3.37468 1391.92     47.3393  1391.92     47.3393  221.96     180         0           0           
1 1 1 20 0  31 o 8  107.115 2.59536 204.062     13.8947  204.062     13.8947  11.4486    240         3.1846      240         
1 1 1 20 0  32 o 4  188.208 2.70705 628.589     25.5087  628.589     25.5087  115.871    120         34.6656     300         
1 1 1 20 0  33 o 3  49.9656 3.1525  45.3004     7.74246  45.3004     7.74246  29.4263    8.65298e-06 95.6906     8.65298e-06 
1 1 1 20 0  34 o 1  209.307 2.95981 777.465     31.0181  777.465     31.0181  217.229    60          140.31      60          
1 1 1 20 0  35 f 0  268.125 3.00542 1275.29     40.3605  1275.29     40.3605  143.929    120         0           0           
1 1 1 20 0  36 f 0  331.389 3.75739 1948.69     62.3639  1948.69     62.3639  252.095    180         0           0           
1 1 1 20 0  37 o 13 189.47  2.51295 636.945     23.8418  636.945     23.8418  122.702    240         20.3093     60          
1 1 1 20 0  38 o 7  242.446 2.95937 1042.91     35.9321  1042.91     35.9321  211.339    300         83.3733     300         
1 1 1 20 0  39 o 8  176.043 2.84519 550.221     25.0714  550.221     25.0714  180.056    1.66325e-05 153.485     1.66325e-05 
1 1 1 20 0  40 o 11 62.1255 2.72579 69.2018     8.41068  69.2018     8.41068  15.5814    60          109.904     60          
1 1 1 20 0  41 o 16 351.301 3.74264 2190.06     65.856   2190.06     65.856   298.148    300         107.858     300         
1 1 1 20 0  42 o 11 145.001 2.60021 373.413     18.8673  373.413     18.8673  49.5208    360         102.098     180         
1 1 1 20 0  43 o 15 45.8992 3.34496 38.5295     7.49062  38.5295     7.49062  27.8748    240         100.97      240         
1 1 1 20 0  44 o 16 530.18  5.00919 4991.99     133.038  4991.99     133.038  481.785    300         231.602     300         
1 1 1 20 0  45 o 1  12.2019 5.2136  2.511       5.84328  2.511       5.84328  1.53763    0.000161476 3.16629     0.000161476 
1 1 1 20 0  46 o 4  92.0756 2.92827 151.219     13.4495  151.219     13.4495  59.3339    240         17.5481     240         
1 1 1 20 0  47 o 10 103.494 2.76633 190.707     14.301   190.707     14.301   59.4523    300         20.925      120         
1 1 1 20 0  48 o 18 133.357 2.61433 316.008     17.4413  316.008     17.4413  118.735    180         57.4148     180         
1 1 1 20 0  49 o 8  52.7259 3.18169 50.3693     8.26063  50.3693     8.26063  5.02232    240         26.8595     60          
1 1 1 20 0  50 o 18 109.379 2.45793 212.747     13.4421  212.747     13.4421  52.3694    300         43.8345     120         
1 1 1 20 0  51 o 10 143.204 2.61325 364.361     18.7259  364.361     18.7259  117.816    180         41.5523     180         
1 1 1 20 0  52 o 4  173.752 2.64417 536.113     22.9998  536.113     22.9998  162.31     240         89.7773     240         
1 1 1 20 0  53 o 8  219.685 2.88644 856.991     31.7531  856.991     31.7531  198.334    120         100.6       120         
1 1 1 20 0  54 o 6  238.289 2.95776 1008.38     35.296   1008.38     35.296   203.411    180         86.6301     180         
1 1 1 20 0  55 o 18 44.1439 3.83112 36.1395     8.13382  36.1395     8.13382  5.93624    240         33.6527     60          
1 1 1 20 0  56 o 19 32.611  5.29683 21.6449     7.53726  21.6449     7.53726  21.9059    300         79.6746     300         
1 1 1 20 0  57 o 16 89.72   2.8771  143.761     12.8754  143.761     12.8754  57.9492    180         3.40875     8.8488e-06  
1 1 1 20 0  58 o 11 143.257 2.73946 365.092     19.6346  365.092     19.6346  106.454    60          22.7801     60          
1 1 1 20 0  59 o 13 11.036  5.22318 -2.8757     8.01149  -2.8757     8.01149  13.98      120         29.8546     120         
1 1 1 20 0  60 o 15 159.445 2.8368  452.428     22.6349  452.428     22.6349  128.728    180         47.2197     180         
1 1 1 20 0  61 o 4  61.3713 4.50383 69.3042     13.4796  69.3042     13.4796  42.3494    240         16.6837     240         
1 1 1 20 0  62 o 12 40.0293 4.85137 30.9798     8.87469  30.9798     8.87469  8.00955    120         0.629216    300         
1 1 1 20 0  63 o 13 23.6403 6.38967 13.5962     7.13826  13.5962     7.13826  5.72557    360         30.4213     360         
1 1 1 20 0  64 o 2  142.607 2.74387 362.352     19.5765  362.352     19.5765  105.222    240         24.9692     240         
1 1 1 20 0  65 o 19 63.746  3.1796  73.429      10.0392  73.429      10.0392  57.2231    300         32.3805     300         
1 1 1 20 0  66 o 12 37.2033 4.71069 27.0076     7.94503  27.0076     7.94503  21.8604    180         0.285515    180         
1 1 1 20 0  67 o 2  27.9788 6.10601 17.5554     7.49104  17.5554     7.49104  4.45514    60          43.8796     60          
1 1 1 20 0  68 o 6  152.512 2.70641 414.95      20.6557  414.95      20.6557  112.138    300         28.7923     300         
1 1 1 20 0  69 o 1  57.2554 3.35191 59.7263     9.46069  59.7263     9.46069  36.8769    1.52983e-11 0.658447    1.52981e-11 
1 1 1 20 0  70 o 8  97.2034 2.76057 169.19      13.3981  169.19      13.3981  63.0508    240         2.45707     240         
1 1 1 20 0  71 o 13 109.281 2.74003 213.66      14.963   213.66      14.963   85.6176    120         32.7681     120         
1 1 1 20 0  72 o 17 78.4072 2.9138  110.609     11.3766  110.609     11.3766  41.4382    180         16.0793     8.65046e-06 
1 1 1 20 0  73 o 2  69.2263 2.9621  86.519      10.1891  86.519      10.1891  48.704     240         10.3888     240         
1 1 1 20 0  74 o 14 8.38755 4.22065 -10.4849    7.70397  -10.4849    7.70397  1.80071    300         4.35909     300         
1 1 1 20 0  75 o 18 ?       ?       -16.1211    1.08166  -16.1211    1.08166  8.71662    180         0           0           
1 1 1 20 0  76 f 0  81.6142 3.67705 121.451     14.8975  121.451     14.8975  44.835     60          0           0           
1 1 1 20 0  77 o 19 27.1046 7.81812 19.2355     10.4379  19.2355     10.4379  14.406     300         3.37695     300         
1 1 1 20 0  78 o 1  28.7018 7.77741 21.0174     10.5638  21.0174     10.5638  8.79345    180         17.2013     8.65164e-06 
1 1 1 20 0  79 o 5  11.3184 5.42023 -3.79527    9.11932  -3.79527    9.11932  13.8907    240         37.5793     240         
1 1 1 20 0  80 o 13 11.1792 5.5277  -10.1643    11.4702  -10.1643    11.4702  8.00024    300         22.0755     300         
1 1 1 20 0  81 o 9  10.3441 5.1912  -13.8167    11.3759  -13.8167    11.3759  10.8834    8.71618e-06 28.1054     8.71618e-06 
1 1 1 20 0  82 o 6  14.2764 6.8029  -4.09667    14.0223  -4.09667    14.0223  6.19793    240         24.9791     240         
1 1 1 20 0  83 o 5  20.4122 8.68826 10.3238     16.1008  10.3238     16.1008  4.56524    300         2.31492     120         
1 1 1 20 0  84 f 0  29.8617 10.092  27.144      17.3234  27.144      17.3234  1.99873    0           0           0           
1 1 1 20 0  85 o 18 14.9373 7.1675  -4.94627    16.1063  -4.94627    16.1063  0.0580801  240         1.34168     240         
1 1 1 20 0  86 o 2  16.7147 7.85835 -0.215258   17.6198  -0.215258   17.6198  2.55768    300         18.4039     300         
1 1 1 20 0  87 o 8  27.7513 10.4897 26.6139     19.9144  26.6139     19.9144  6.09883    4.15235e-06 18.5396     180         
1 1 1 20 0  88 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 1  0  o 13 72.606  2.35157 93.9969     8.5154   93.9969     8.5154   6.07508    360         18.7135     360         
1 1 1 20 1  1  o 5  429.818 3.76468 3272.65     81.0883  3276.56     81.0937  333.569    270.855     60.7375     270.855     
1 1 1 20 1  2  o 5  226.969 2.66118 920.292     29.7006  905.597     30.8171  164.699    319.835     50.9158     319.835     
1 1 1 20 1  3  o 19 417.849 3.87499 3125.28     84.2402  3064.59     77.98    247.453    233.531     98.3972     53.5313     
1 1 1 20 1  4  o 11 450.663 4.07094 3579.64     90.2247  3620.83     93.6417  297.414    275.683     46.2503     95.6831     
1 1 1 20 1  5  o 15 333.887 3.1376  1980.3      52.5009  1971.28     52.4985  212.657    252.906     40.0215     72.9058     
1 1 1 20 1  6  o 2  118.995 2.26482 247.025     13.5139  255.216     13.4698  15.2662    61.1134     72.5301     241.113     
1 1 1 20 1  7  o 7  606.702 5.17458 6523.85     154.382  6530.36     160.226  504.672    171.2       140.053     171.2       
1 1 1 20 1  8  o 7  614.973 5.23143 6718.91     158.197  6694.18     164.189  505.821    123.547     129.935     123.547     
1 1 1 20 1  9  o 19 323.874 3.10568 1815.56     50.3837  1903.14     50.4103  142.549    97.6833     170.559     277.683     
1 1 1 20 1  10 o 18 491.676 4.40435 4292.53     112.621  4279.45     104.276  341.797    25.519      18.2375     205.519     
1 1 1 20 1  11 o 18 492.969 4.34017 4283.97     103.023  4333.25     111.307  278.055    357.275     149.634     177.275     
1 1 1 20 1  12 o 16 405.188 3.75131 2892.94     77.5452  2927.81     74.7563  318.988    50.7388     66.7275     50.7388     
1 1 1 20 1  13 o 2  274.244 2.85985 1321.33     39.2894  1344.66     39.3175  200.227    130.893     26.5011     130.893     
1 1 1 20 1  14 o 1  683.031 6.20939 8290.06     207.881  8266.25     217.093  462.965    176.331     56.8356     356.331     
1 1 1 20 1  15 o 3  283.342 3.15318 1426.2      46.5871  1419.83     42.8916  235.101    38.9636     85.4204     38.9636     
1 1 1 20 1  16 o 19 568.638 4.87197 5651.99     136.249  5818.06     141.427  422.406    193.007     31.0956     193.007     
1 1 1 20 1  17 o 18 288.814 2.92911 1462.12     42.371   1494.91     42.4156  237.489    203.162     80.0709     203.162     
1 1 1 20 1  18 o 5  439.602 3.82153 3408.52     84.1699  3444.07     84.2074  262.094    176.921     101.572     356.921     
1 1 1 20 1  19 o 6  354.756 3.32763 2231.56     60.224   2230.47     58.0762  254.376    27.338      10.1288     27.3381     
1 1 1 20 1  20 o 5  603.189 5.08565 6470.87     150.855  6438.74     156.539  417.025    347.401     28.5265     167.401     
1 1 1 20 1  21 o 15 144.307 2.28416 355.305     16.2257  383.096     16.8108  86.5769    161.582     36.9183     161.582     
1 1 1 20 1  22 o 15 217.011 2.57868 830.97      27.5357  838.479     28.5474  99.5127    168.189     98.7719     348.189     
1 1 1 20 1  23 o 5  467.948 4.17576 3867.59     96.1026  3900.04     99.7278  326.928    206.545     10.5014     26.5448     
1 1 1 20 1  24 o 16 134.111 2.2439  306.682     14.5273  331.095     15.6401  61.2425    308.22      43.0956     128.22      
1 1 1 20 1  25 o 18 363.528 3.35268 2370.47     59.9348  2316.13     62.1702  200.342    222.105     111.92      42.1049     
1 1 1 20 1  26 o 7  272.424 2.89628 1305.2      38.8141  1326.26     40.2642  192.695    94.4767     9.6202      94.4767     
1 1 1 20 1  27 o 10 90.572  2.45005 150.985     10.9428  140.358     11.2334  45.9256    142.724     204.199     142.724     
1 1 1 20 1  28 o 9  317.284 3.5599  1788.94     57.9447  1781.9      55.2358  231.622    333.889     22.6082     333.889     
1 1 1 20 1  29 o 7  261.318 3.2615  1196.82     42.7229  1225.19     42.696   154.727    159.231     50.6654     339.231     
1 1 1 20 1  30 o 13 167.401 2.87629 512.088     24.1141  482.166     24.1089  53.5666    97.4615     116.571     277.462     
1 1 1 20 1  31 f 0  154.983 2.83889 420.603     22.0323  431.775     22.0261  166.656    283.914     0           0           
1 1 1 20 1  32 o 2  399.336 4.23016 2810.06     84.6245  2850.23     84.6842  301.502    223.787     44.9124     223.787     
1 1 1 20 1  33 o 18 264.647 3.23057 1242.99     41.8246  1241.35     43.8416  224.915    162.286     88.6934     162.286     
1 1 1 20 1  34 o 18 64.7059 2.69332 71.6326     8.57884  77.4095     8.80842  0.00101569 236.489     59.6676     56.3906     
1 1 1 20 1  35 o 17 79.7934 2.65454 111.167     10.4334  115.136     10.7376  13.2278    268.356     67.3292     88.3562     
1 1 1 20 1  36 o 12 181.496 2.61012 563.641     24.1741  604.888     23.2424  121.425    36.9462     1.27831     216.947     
1 1 1 20 1  37 o 12 144.298 2.32469 373.167     16.802   365.154     16.8177  94.1316    182.1       0.607189    182.1       
1 1 1 20 1  38 o 11 314.45  3.36684 1784.79     54.226   1724.06     51.8888  219.659    73.4512     5.21645     73.4511     
1 1 1 20 1  39 o 13 95.9239 2.55349 163.932     12.1151  162.857     12.3885  50.7917    32.3169     19.3782     32.3169     
1 1 1 20 1  40 o 11 455.41  4.32751 3630.47     100.808  3737.03     96.5989  316.563    127.872     2.34777     127.872     
1 1 1 20 1  41 o 1  217.735 2.93489 845.469     31.2312  836.451     32.7893  193.72     127.709     98.7566     127.709     
1 1 1 20 1  42 o 18 527.276 5.45414 5036.33     132.116  4857.02     154.768  403.847    225.256     79.8028     225.256     
1 1 1 20 1  43 o 11 308.719 3.67379 1754.21     56.8387  1630.79     56.7821  213.084    259.548     4.85292     259.548     
1 1 1 20 1  44 o 5  333.874 4.02167 1984.2      63.4536  1975.44     70.9011  256.647    64.5397     58.4488     64.5397     
1 1 1 20 1  45 f 0  242.551 3.37886 1070.76     38.7781  1017.96     43.1182  133.205    197.502     0           0           
1 1 1 20 1  46 o 10 238.913 3.37331 1025.29     34.6016  1001.18     45.3231  138.253    99.1305     45.5781     279.131     
1 1 1 20 1  47 f 0  138.686 2.69559 346.374     17.76    336.599     19.5984  84.5242    190.024     0           0           
1 1 1 20 1  48 f 0  86.3544 2.90931 130.586     11.3767  134.693     13.6577  63.7544    299.638     0           0           
1 1 1 20 1  49 o 8  118.326 2.67196 243.237     15.6564  254.195     15.9911  72.4358    243.378     4.06549     63.3775     
1 1 1 20 1  50 o 1  111.794 2.6378  213.051     14.2604  231.197     15.2599  90.4482    273.624     51.3955     273.624     
1 1 1 20 1  51 o 1  74.5423 2.8986  101.171     10.3872  96.7585     11.1493  29.7868    122.14      28.897      302.14      
1 1 1 20 1  52 o 15 76.7169 2.89605 106.85      11.104   102.803     11.0807  22.5001    201.167     49.2694     21.1672     
1 1 1 20 1  53 o 5  42.3945 3.78488 30.0611     7.81477  35.0114     7.87023  8.02896    296.427     58.8401     296.427     
1 1 1 20 1  54 o 11 98.1205 2.63458 166.773     13.0162  175.756     12.8339  63.2645    15.7532     5.01873     15.7532     
1 1 1 20 1  55 o 15 121.196 2.52396 259.987     15.5102  262.242     15.1111  86.4248    91.7092     18.6228     91.7092     
1 1 1 20 1  56 o 1  31.2544 4.85553 15.7795     7.55291  20.5832     7.26635  18.3858    259.462     65.2382     259.462     
1 1 1 20 1  57 o 7  35.3772 4.44255 24.7741     7.75894  21.363      7.41361  5.10095    320.81      41.5354     320.81      
1 1 1 20 1  58 o 4  77.5668 2.81638 106.704     11.3671  107.981     10.4277  43.5886    229.347     6.48506     49.3474     
1 1 1 20 1  59 o 1  73.3143 2.93189 103.783     11.5234  88.5932     9.9493   52.0502    42.1454     27.1601     42.1454     
1 1 1 20 1  60 o 16 74.0104 3.03942 114.742     11.6722  82.54       10.6829  35.7526    76.5094     17.8758     256.509     
1 1 1 20 1  61 o 8  64.8333 3.20585 82.1865     11.6046  68.8935     9.10289  26.2144    272.039     25.2993     92.0385     
1 1 1 20 1  62 o 7  102.165 2.68395 204.149     14.2968  169.187     13.1321  49.6758    316.832     30.9469     136.832     
1 1 1 20 1  63 f 0  76.1723 3.16269 106.236     11.9031  101.902     12.1262  65.5292    327.052     0           0           
1 1 1 20 1  64 o 5  98.7805 2.91831 173.127     14.4157  176.146     14.4128  46.4023    222.65      33.4317     42.6498     
1 1 1 20 1  65 o 18 70.2212 3.27559 90.9176     11.4198  86.6361     11.4978  41.3971    311.838     4.32843     131.839     
1 1 1 20 1  66 o 8  81.145  2.98352 118.571     12.2515  117.889     11.9288  40.5015    28.3553     21.111      208.355     
1 1 1 20 1  67 o 10 85.4598 2.89928 131.239     12.5071  131.041     12.253   57.4484    213.85      8.11389     213.85      
1 1 1 20 1  68 o 11 19.4808 5.14275 2.8293      6.82465  7.62951     6.90474  4.69767    294.05      25.044      294.05      
1 1 1 20 1  69 o 1  46.8041 4.05659 35.2787     8.765    45.7094     9.85018  15.7623    203.71      24.5876     23.7102     
1 1 1 20 1  70 o 17 26.661  5.26542 19.8042     7.47703  5.90873     8.4745   1.80641    39.3316     24.1342     219.332     
1 1 1 20 1  71 o 16 57.4535 3.8173  58.3315     11.0555  62.5036     10.6337  19.7732    74.4625     30.7106     254.463     
1 1 1 20 1  72 o 5  22.9768 4.99587 19.6817     8.4098   -6.80283    7.95434  5.11929    74.161      4.9803      254.161     
1 1 1 20 1  73 o 2  75.22   3.19211 102.645     10.8256  102.613     13.0148  44.6059    85.3829     3.33974     265.383     
1 1 1 20 1  74 f 0  30.2653 5.96855 16.5287     9.46898  19.5799     9.36531  16.2147    253.58      0           0           
1 1 1 20 1  75 o 19 23.8965 5.64112 10.5389     9.01471  10.5239     6.92217  8.18892    328.528     4.01195     148.528     
1 1 1 20 1  76 o 8  48.7791 4.33654 43.6985     11.1831  46.0193     9.35778  32.7843    286.253     8.73599     286.253     
1 1 1 20 1  77 o 11 55.578  4.89454 49.768      12.2789  69.5528     14.3647  31.7044    31.448      2.63548     211.448     
1 1 1 20 1  78 o 5  23.197  6.3639  -2.32315    10.7185  15.6993     11.9707  5.00499    21.368      0.620814    201.368     
1 1 1 20 1  79 o 11 23.1408 6.33329 12.3768     9.9324   1.54841     12.1728  5.04732    235.518     9.24426     55.5183     
1 1 1 20 1  80 o 9  37.064  6.35671 16.0508     13.2712  41.0335     11.6842  10.9551    288.005     19.4415     108.005     
1 1 1 20 1  81 o 10 21.304  6.2671  -1.03525    12.3944  7.82599     10.4301  0.713052   34.6863     18.268      214.686     
1 1 1 20 1  82 o 16 30.7204 7.12537 4.7202      15.318   30.1342     13.4468  2.88995    258.829     28.3607     78.8293     
1 1 1 20 1  83 o 12 23.8583 7.0777  6.21881     15.8448  6.58983     12.7453  7.88911    130.043     3.71551     310.043     
1 1 1 20 1  84 o 11 49.3529 7.43471 52.4805     19.6701  54.69       15.9268  21.1522    331.875     14.2709     151.875     
1 1 1 20 1  85 o 5  32.0702 7.87459 34.1022     17.678   13.859      13.9811  12.2969    213.44      8.23378     33.4399     
1 1 1 20 1  86 o 14 23.2507 7.10509 -1.19133    18.1944  9.63764     13.3294  4.54301    138.329     4.4151      318.329     
1 1 1 20 1  87 o 10 30.07   8.59148 21.8908     19.7065  21.0715     20.351   10.1604    182.289     0.634144    2.28911     
1 1 1 20 1  88 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 2  0  o 11 142.296 2.39179 359.4       17.0342  359.4       17.0342  58.3446    180         4.35312     180         
1 1 1 20 2  1  o 12 103.923 2.19077 188.555     11.4063  194.577     11.3848  6.82781    262.545     111.552     262.545     
1 1 1 20 2  2  o 1  203.393 2.51724 736.636     25.6435  729.627     25.6718  137.343    130.582     21.88       130.582     
1 1 1 20 2  3  o 14 183.898 2.3808  609.216     22.3474  589.483     21.5363  80.2955    141.184     76.3714     321.184     
1 1 1 20 2  4  o 15 636.621 5.41383 7196.36     175.894  7179.59     169.497  447.998    197.54      22.5979     17.5403     
1 1 1 20 2  5  o 3  611.265 5.19411 6642.41     156.127  6610.31     162.026  585.302    66.4987     294.987     66.4987     
1 1 1 20 2  6  o 11 351.246 3.3437  2191.77     57.7484  2181.82     59.9404  220.519    223.479     54.792      43.4792     
1 1 1 20 2  7  o 1  474.544 4.20277 4026.79     101.796  3958.26     98.0915  361.818    346.563     45.9126     346.563     
1 1 1 20 2  8  o 12 459.083 3.9831  3734.6      91.6337  3738.11     91.6411  296.529    246.864     63.8916     66.8639     
1 1 1 20 2  9  o 14 37.7698 3.20815 25.0357     6.00458  26.2712     5.88984  51.249     321.288     114.162     321.288     
1 1 1 20 2  10 o 17 289.752 3.00744 1484.85     44.4649  1491.25     42.8568  251.361    315.454     109.178     315.454     
1 1 1 20 2  11 o 12 481.34  4.26389 4120.74     100.921  4095.27     104.738  370.923    204.598     54.0134     204.598     
1 1 1 20 2  12 o 13 480.742 4.26606 4083.52     100.85   4112.28     104.682  352.058    38.2424     16.6722     38.2424     
1 1 1 20 2  13 o 13 406.11  3.71594 2928.69     77.0059  2919        74.2256  264.858    67.1071     48.391      247.107     
1 1 1 20 2  14 o 19 201.684 2.5159  730.022     25.4233  711.843     25.4311  134.489    242.258     4.65535     242.258     
1 1 1 20 2  15 o 1  270.867 3.12278 1291.07     45.0324  1310.01     39.5252  80.0479    227.647     221.229     47.6468     
1 1 1 20 2  16 o 6  634.817 5.47307 7215.53     167.211  7085.35     180.629  467.16     17.7422     22.2047     17.7422     
1 1 1 20 2  17 o 9  529.668 4.58048 4970.81     119.295  4980.97     123.835  318.457    356.393     122.412     176.393     
1 1 1 20 2  18 o 10 966.709 7.90185 16582.1     375.635  16639.9     389.878  779.345    26.7376     166.082     26.7376     
1 1 1 20 2  19 o 18 531.336 4.57662 4972.16     121.838  5043.51     121.885  392.579    187.289     25.6884     187.289     
1 1 1 20 2  20 o 15 546.793 4.69957 5309.72     126.349  5298.31     131.156  392.76     168.509     3.77102     168.509     
1 1 1 20 2  21 o 18 211.836 2.5855  799.713     26.8989  791.106     27.9792  192.819    295.619     117.537     295.619     
1 1 1 20 2  22 o 17 434.995 3.96428 3399.31     84.7637  3312.85     87.9914  286.407    226.419     45.5171     46.4186     
1 1 1 20 2  23 o 13 683.571 5.72776 8321.79     192.509  8272.46     199.826  528.581    71.7929     80.2061     71.7929     
1 1 1 20 2  24 o 6  240.659 2.972   1011.34     35.0375  1042.39     36.6497  148.177    295.503     35.1626     115.503     
1 1 1 20 2  25 f 0  339.961 3.51469 2030.2      58.5381  2069.09     61.212   231.816    22.2709     0           0           
1 1 1 20 2  26 o 2  543.184 5.19423 5190.95     134.824  5286.46     147.773  356.645    46.5429     58.4104     226.543     
1 1 1 20 2  27 o 18 196.585 2.83351 672.245     27.2678  698.221     28.564   122.726    245.799     17.624      65.799      
1 1 1 20 2  28 o 15 227.861 3.01168 900.726     33.5975  940.764     35.1877  186.209    350.362     68.3349     350.362     
1 1 1 20 2  29 o 9  63.4551 2.64529 67.862      8.16648  75.508      8.5818   26.4298    165.188     110.949     165.188     
1 1 1 20 2  30 o 17 418.228 4.09295 3084.11     83.9143  3123.62     87.6357  287.436    192.017     13.3073     12.0172     
1 1 1 20 2  31 o 1  308.055 3.41146 1688.48     50.2244  1678.01     54.9841  250.966    87.9003     75.1196     87.9003     
1 1 1 20 2  32 o 3  238.387 2.92275 1004.79     35.6671  1010.66     34.1451  112.991    42.892      104.255     222.892     
1 1 1 20 2  33 o 15 411.435 4.04146 3035.59     85.1465  2973.13     81.5039  243.047    287.714     91.8401     107.714     
1 1 1 20 2  34 o 12 304.29  3.4037  1684.51     51.8651  1601.19     51.9162  218.146    56.4331     12.9216     56.4332     
1 1 1 20 2  35 o 19 262.1   3.1003  1218.7      38.8189  1218.24     42.5394  146.419    12.3362     70.5603     192.336     
1 1 1 20 2  36 o 14 300.196 3.2197  1599.43     46.3487  1597.82     50.4374  212.773    231.416     9.69422     231.416     
1 1 1 20 2  37 o 14 202.39  2.8944  726.765     25.5893  726.233     32.6892  165.036    168.19      58.7055     168.19      
1 1 1 20 2  38 o 7  208.83  3.02126 752.297     28.3295  795.155     34.7402  117.772    280.933     48.9916     100.933     
1 1 1 20 2  39 o 1  50.6617 3.74989 54.9648     7.79391  37.9664     10.0311  7.60572    171.484     49.4797     171.484     
1 1 1 20 2  40 o 12 74.1879 2.76905 97.1422     9.75644  98.6399     10.7431  17.432     139.991     42.6707     319.991     
1 1 1 20 2  41 o 9  217.917 2.97606 838.038     31.6949  846.855     33.2947  138.967    296.7       17.0401     116.7       
1 1 1 20 2  42 o 2  158.2   2.70011 455.889     20.8649  432.359     21.879   70.7478    308.727     68.8772     128.727     
1 1 1 20 2  43 o 5  551.216 5.53388 5292.47     148.722  5525.13     157.022  426.844    110.543     93.5087     110.543     
1 1 1 20 2  44 o 4  265.469 3.41692 1299.61     44.1635  1203.15     46.5759  197.063    287.948     34.5846     287.948     
1 1 1 20 2  45 o 14 561.131 5.88951 5798.21     141.629  5425.49     185.079  463.371    357.024     156.588     357.024     
1 1 1 20 2  46 o 14 23.0745 5.28078 7.88316     6.40691  10.5416     7.5447   13.6568    75.6841     31.275      75.6841     
1 1 1 20 2  47 o 4  87.0436 2.8045  138.353     11.7364  131.131     12.6187  46.1816    139.933     3.1916      319.933     
1 1 1 20 2  48 f 0  112.821 2.64935 227.912     13.9878  224.291     15.8536  74.913     91.6963     0           0           
1 1 1 20 2  49 o 15 131.25  2.52332 309.275     16.2698  302.521     16.8796  75.6481    57.9106     19.1402     237.911     
1 1 1 20 2  50 f 0  135.685 2.5205  343.555     16.7044  310.538     17.4731  54.8394    100.044     0           0           
1 1 1 20 2  51 o 8  150.346 2.47476 396.817     18.6451  405.545     18.6452  92.9237    320.059     11.9673     140.058     
1 1 1 20 2  52 o 5  63.6133 2.97021 71.1691     9.36088  73.2499     9.47049  30.1926    345.039     5.08511     165.039     
1 1 1 20 2  53 o 1  169.696 2.68518 517.721     22.331   505.285     23.3143  137.149    326.93      52.2598     326.93      
1 1 1 20 2  54 o 12 62.5908 2.98563 67.4426     9.25432  72.5257     9.35978  29.7381    321.851     7.9723      141.851     
1 1 1 20 2  55 o 1  168.734 2.61407 521.698     22.1888  490.385     22.0094  127.236    244.762     33.6257     244.762     
1 1 1 20 2  56 o 6  49.0566 3.64225 39.7059     9.04537  47.2036     8.46102  17.3066    293.099     4.64411     113.099     
1 1 1 20 2  57 o 11 74.895  2.88701 100.165     11.1642  100.078     10.4118  38.1517    57.7723     14.6541     237.772     
1 1 1 20 2  58 o 14 35.3402 4.6482  19.8409     8.04169  26.5689     7.74407  4.12402    328.104     40.5021     328.104     
1 1 1 20 2  59 o 10 109.771 2.7048  212.257     15.2689  217.345     14.4197  63.0447    307.368     13.7008     127.368     
1 1 1 20 2  60 o 4  167.996 2.61606 489.45      23.2947  515.743     20.5862  118.586    350.738     19.2472     350.738     
1 1 1 20 2  61 o 12 51.3495 3.30277 44.8834     8.80094  50.1867     7.90145  10.756     133.73      39.6066     313.73      
1 1 1 20 2  62 o 19 41.4598 4.09687 32.5853     8.55347  30.3709     8.0092   20.3407    283.682     1.174       103.682     
1 1 1 20 2  63 o 3  162.165 2.51892 491.166     21.3983  446.931     19.5541  106.43     56.4793     2.68469     56.4793     
1 1 1 20 2  64 o 16 157.565 2.5136  464.514     20.7509  421.734     18.9563  118.822    204.831     34.5153     204.831     
1 1 1 20 2  65 o 14 93.6353 3.01931 133.986     14.1801  182.522     13.7406  49.2025    122.562     20.6776     302.562     
1 1 1 20 2  66 o 17 53.219  3.94305 47.1736     10.3319  56.4763     10.3043  36.3862    204.784     10.6756     204.784     
1 1 1 20 2  67 o 2  87.8875 3.1802  137.919     13.2737  140.395     14.6231  57.0954    65.4554     3.84446     65.4554     
1 1 1 20 2  68 o 5  128.833 2.83566 301.174     17.0755  294.624     19.3897  83.1576    118.297     2.72027     118.297     
1 1 1 20 2  69 o 15 64.5422 3.5849  76.812      10.4001  74.6485     12.4589  40.2644    326.022     1.64848     326.022     
1 1 1 20 2  70 o 9  86.9516 3.00235 131.389     12.5047  141.232     13.5853  66.4845    321.994     25.3959     321.994     
1 1 1 20 2  71 o 6  37.2171 4.61963 24.6553     8.12289  27.6351     8.48053  15.5796    284.274     11.2351     104.274     
1 1 1 20 2  72 o 6  91.0968 2.82854 139.275     12.5162  160.235     13.2393  60.76      2.73692     8.34637     2.73692     
1 1 1 20 2  73 o 5  85.7235 2.66157 126.744     11.2137  138.23      11.5956  48.626     210.151     9.07353     30.151      
1 1 1 20 2  74 o 19 37.7093 5.21945 23.4897     9.91608  31.8792     9.00691  9.89225    176.37      24.6614     356.37      
1 1 1 20 2  75 o 11 74.42   3.51981 99.8005     13.2047  103.683     12.8851  47.4202    20.562      3.87873     20.562      
1 1 1 20 2  76 o 8  24.2965 5.93474 14.639      9.37977  7.04025     8.50791  8.67653    36.4852     2.26516     216.485     
1 1 1 20 2  77 o 6  48.9093 5.23251 49.041      12.3701  44.3077     12.4444  24.9505    265.399     7.70942     85.3993     
1 1 1 20 2  78 o 4  53.8518 4.74788 57.6891     12.2492  53.6909     12.7682  24.2172    93.78       15.459      273.78      
1 1 1 20 2  79 o 7  29.1323 6.8534  18.5595     12.4881  16.2158     10.9177  11.5344    180.575     4.31823     0.575266    
1 1 1 20 2  80 o 18 31.5611 6.95367 18.5125     13.0076  23.1696     11.6153  8.13827    152.017     17.7671     332.017     
1 1 1 20 2  81 o 5  25.3061 7.03663 10.6394     14.7715  10.0738     11.4312  8.60471    358.67      5.34514     178.67      
1 1 1 20 2  82 o 18 39.6154 7.22904 48.6216     16.756   21.2533     13.039   26.4496    90.5206     11.3638     90.5206     
1 1 1 20 2  83 o 12 47.067  7.58668 38.933      19.4506  59.5069     16.0855  18.5741    177.483     16.9711     357.483     
1 1 1 20 2  84 o 1  34.9773 7.77388 19.0637     18.3144  35.4149     14.357   15.235     163.421     6.84848     343.421     
1 1 1 20 2  85 o 19 39.272  7.60484 21.0892     19.2498  50.2193     15.2683  19.2764    345.49      3.28905     165.49      
1 1 1 20 2  86 o 12 24.4017 7.13137 -5.55621    18.2512  16.7709     13.4446  5.03667    50.857      3.56015     230.857     
1 1 1 20 2  87 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 3  0  o 7  402.699 3.6593  2875.43     73.8206  2875.43     73.8206  421.187    4.40559e-06 254.457     4.40559e-06 
1 1 1 20 3  1  o 4  321.767 3.20225 1821.25     50.6798  1849.09     52.5878  169.235    117.982     117.762     297.982     
1 1 1 20 3  2  o 7  405.023 3.75229 2914.92     77.5703  2901.34     74.7332  364.002    82.4959     155.33      82.4959     
1 1 1 20 3  3  o 17 416.43  3.81729 3071.78     81.1246  3076.84     78.1718  374.851    234.004     159.802     234.004     
1 1 1 20 3  4  o 5  336.936 3.25109 2018.46     54.8954  2006.12     54.8952  339.55     250.108     220.118     250.108     
1 1 1 20 3  5  o 12 366.509 3.40237 2387.96     63.6381  2374.34     61.3317  328.512    237.638     142.819     237.638     
1 1 1 20 3  6  o 8  848.348 7.00457 12675.1     292.255  12879.1     303.304  637.015    94.6829     42.9764     94.6829     
1 1 1 20 3  7  o 4  481.678 4.1805  4088.45     100.905  4139.18     100.917  242.406    9.889       209.344     189.889     
1 1 1 20 3  8  o 3  199.325 2.46315 691.803     24.5992  716.559     24.604   159.826    297.294     78.9782     297.294     
1 1 1 20 3  9  o 17 219.065 2.54831 852.529     27.9693  848.51      27.9826  163.407    189.683     37.124      189.683     
1 1 1 20 3  10 o 4  281.059 2.84292 1399.36     40.7665  1400.88     39.3046  132.5      355.046     130.866     175.046     
1 1 1 20 3  11 o 2  351.61  3.34696 2208.88     57.8629  2174.36     60.0479  186.562    11.4576     127.63      191.458     
1 1 1 20 3  12 o 5  350.854 3.31232 2190.24     58.234   2174.15     58.2447  204.449    215.656     89.9855     35.6559     
1 1 1 20 3  13 o 3  208.185 2.56172 755.207     26.2096  781.217     27.245   147.418    47.6524     18.3572     47.6524     
1 1 1 20 3  14 o 3  273.38  3.03669 1326.72     42.4108  1322.88     40.7822  185.351    290.754     10.0331     110.754     
1 1 1 20 3  15 o 1  64.5366 2.61878 73.3591     8.78037  74.7729     8.06402  78.7695    344.2       227.161     344.2       
1 1 1 20 3  16 o 17 459.665 4.20322 3747.16     93.0115  3747.32     100.492  330.163    238.924     2.87083     238.923     
1 1 1 20 3  17 o 17 553.778 4.87326 5388.86     135.226  5493.08     135.252  338.135    215.994     119.69      35.9938     
1 1 1 20 3  18 o 8  442.086 3.88117 3477.81     87.5601  3453.99     84.394   335.455    194.716     40.2939     194.716     
1 1 1 20 3  19 o 14 229.26  2.69073 942.122     30.3097  921.3       31.4915  180.911    157.647     50.8526     157.647     
1 1 1 20 3  20 o 1  73.8303 2.36154 95.2211     8.84565  98.4156     8.57566  15.7465    118.224     102.313     118.224     
1 1 1 20 3  21 o 16 138.007 2.50125 340.119     16.8824  335.326     17.6836  82.5392    69.3038     0.919474    69.3037     
1 1 1 20 3  22 o 14 404.263 4.02253 2900.86     79.6834  2897.06     83.2621  290.87     27.387      8.33044     27.3871     
1 1 1 20 3  23 o 9  184.65  2.74838 605.66      25.9832  603.232     24.8714  146.653    312.443     57.4304     312.443     
1 1 1 20 3  24 o 11 179.185 2.65806 566.513     23.843   571.873     23.894   111.7      192.868     13.5273     12.8684     
1 1 1 20 3  25 o 19 227.081 2.97616 887.296     34.5781  941.71      33.0751  148.164    228.361     14.1281     48.3612     
1 1 1 20 3  26 o 7  149.364 2.48006 391.766     18.48    399.228     18.6477  49.0042    280.37      98.9868     100.37      
1 1 1 20 3  27 o 5  570.933 5.06674 5768.98     142.013  5807.86     147.883  467.027    152.896     123.844     152.896     
1 1 1 20 3  28 o 15 41.3019 3.21666 31.2737     6.33574  29.9702     6.73879  54.2946    252.07      138.445     252.07      
1 1 1 20 3  29 o 19 126.023 2.36087 276.2       14.4762  287.332     15.3182  81.8112    72.3483     18.8649     72.3482     
1 1 1 20 3  30 o 8  236.425 2.74345 977.313     31.7647  1004.99     33.2445  149.112    39.5596     28.4974     219.56      
1 1 1 20 3  31 o 18 130.54  2.35633 299.585     14.7307  304.831     16.0658  68.5636    212.875     32.2388     32.8751     
1 1 1 20 3  32 o 18 167.282 2.42279 503.61      19.4221  488.679     21.1339  132.454    66.1663     43.3833     66.1663     
1 1 1 20 3  33 o 18 312.841 3.33561 1741.02     50.0733  1731.35     54.4136  212.657    154.623     11.9        334.623     
1 1 1 20 3  34 o 2  338.183 3.84208 2080.69     61.6837  1979.52     68.1888  257.482    216.467     43.037      216.467     
1 1 1 20 3  35 o 11 110.764 2.78367 215.531     14.2053  220.179     16.5798  44.862     317.547     52.0377     137.547     
1 1 1 20 3  36 o 15 218.612 3.09029 866.077     32.9402  829.659     34.6991  124.317    86.1737     51.5794     266.174     
1 1 1 20 3  37 f 0  191.957 2.9054  661.588     28.6952  645.613     27.1985  161.412    352.916     0           0           
1 1 1 20 3  38 f 0  144.23  2.74261 373.468     19.1329  364.974     20.4388  155.045    193.734     0           0           
1 1 1 20 3  39 o 1  93.2827 2.82145 157.992     12.514   151.299     13.7427  49.4463    167.971     1.31202     347.971     
1 1 1 20 3  40 o 16 91.7998 2.69196 148.073     11.986   151.384     12.7246  48.876     201.52      9.99349     201.52      
1 1 1 20 3  41 o 10 270.609 3.15336 1276.03     40.7346  1322.96     44.7603  201.579    87.319      33.7379     87.319      
1 1 1 20 3  42 o 19 82.2156 2.68876 120.974     10.2665  119.33      11.7661  34.8473    244.63      3.61884     244.63      
1 1 1 20 3  43 o 8  432.7   4.44145 3160.28     96.1033  3499.26     96.3409  303.486    290.983     10.8529     290.983     
1 1 1 20 3  44 o 19 167.186 2.64905 487.025     21.1061  504.685     23.2639  116.119    98.7746     12.2128     98.7746     
1 1 1 20 3  45 o 3  446.537 4.47318 3412.32     97.6593  3680.86     102.559  348.579    169.028     84.9139     169.028     
1 1 1 20 3  46 o 7  208.539 2.75113 766.732     27.6177  776.562     29.8548  145.516    306.914     11.5748     306.914     
1 1 1 20 3  47 o 18 213.059 2.91337 790.618     29.6897  820.965     32.5048  163.105    131.666     41.1447     131.666     
1 1 1 20 3  48 o 12 16.4936 4.75004 4.08479     6.07984  -1.93683    6.7196   6.95077    294.485     15.2011     294.485     
1 1 1 20 3  49 o 9  250.096 3.1544  1091.08     38.5981  1131.08     40.4741  174.636    141.384     11.8749     141.384     
1 1 1 20 3  50 o 9  101.671 2.75127 186.346     13.1499  181.275     14.7619  78.5167    283.693     34.2091     283.693     
1 1 1 20 3  51 o 4  81.1796 2.86194 116.762     11.1019  117.942     12.0936  49.1789    11.8684     2.42897     11.8684     
1 1 1 20 3  52 o 3  235.756 3.10073 993.501     36.6097  982.591     36.6577  156.768    207.233     2.15142     27.2335     
1 1 1 20 3  53 o 10 119.956 2.61667 248.297     15.623   263.537     15.7937  83.2302    183.774     12.4249     183.774     
1 1 1 20 3  54 o 13 135.932 2.62531 340.986     18.6998  316.421     17.0392  78.7347    340.201     20.3384     160.201     
1 1 1 20 3  55 o 4  154.026 2.4983  414.341     19.2182  428.914     19.3477  89.8604    59.6075     22.8306     239.608     
1 1 1 20 3  56 o 10 154.007 2.61061 429.616     20.5544  413.993     19.7443  103.708    164.737     5.86425     164.737     
1 1 1 20 3  57 o 2  198.9   2.78127 709.714     28.9313  698.719     26.4774  139.733    142.676     17.6227     142.676     
1 1 1 20 3  58 o 5  148.739 2.63368 410.987     20.0292  377.199     19.2164  92.294     108.078     9.03601     288.078     
1 1 1 20 3  59 o 12 60.0941 3.13893 63.0579     9.46247  66.5275     9.29898  18.8669    139.523     33.9233     319.523     
1 1 1 20 3  60 o 19 112.065 2.49055 214.435     13.8     233.391     14.1326  75.0761    89.1891     6.78654     89.1891     
1 1 1 20 3  61 o 14 25.6835 5.00261 17.0127     6.88927  7.22859     7.01852  12.6785    88.8663     51.8269     88.8663     
1 1 1 20 3  62 o 3  152.444 2.64455 437.718     21.674   391.896     18.7413  109.482    97.7932     20.968      97.7932     
1 1 1 20 3  63 o 4  24.9931 5.24475 13.3141     7.32719  9.85071     6.81679  0.87717    273.436     1.22867     93.4363     
1 1 1 20 3  64 o 10 146.288 2.5068  402.289     19.5907  362.16      17.1735  87.5764    37.7549     13.8777     217.755     
1 1 1 20 3  65 o 11 56.7637 3.39978 56.051      9.91307  60.6576     9.18478  41.7463    177.653     16.6372     177.653     
1 1 1 20 3  66 o 9  34.0537 4.91739 20.9265     8.02343  22.9924     8.19385  15.869     181.64      3.71273     181.64      
1 1 1 20 3  67 o 5  80.3377 2.97914 117.278     12.1615  115.058     11.7424  57.1183    297.775     14.0617     297.775     
1 1 1 20 3  68 o 16 124.742 2.79807 283.292     17.1869  275.448     17.7369  74.9577    289.863     8.69831     109.863     
1 1 1 20 3  69 o 4  34.4014 5.03623 16.6668     8.02175  29.1111     8.85179  15.0106    197.342     7.05571     17.3425     
1 1 1 20 3  70 o 14 89.6675 2.89879 146.178     12.6152  143.5       13.3485  51.139     203.62      10.0608     23.6198     
1 1 1 20 3  71 o 11 39.912  4.72841 31.6675     8.16281  28.5285     9.90089  23.635     194.621     2.17986     194.621     
1 1 1 20 3  72 o 17 18.6261 5.5166  -0.675167   8.233    4.32927     9.18239  1.21015    319.638     11.2965     139.638     
1 1 1 20 3  73 o 13 66.9729 4.04001 70.234      12.1962  96.8685     14.6848  47.2187    330.812     12.7647     330.812     
1 1 1 20 3  74 o 17 80.0201 3.73606 115.158     13.676   120.839     16.0629  54.0742    200.372     9.70234     200.372     
1 1 1 20 3  75 o 5  102.033 3.41843 184.643     17.3332  197.188     17.5167  74.8814    190.018     23.9382     190.018     
1 1 1 20 3  76 o 6  38.6711 5.65301 31.8528     10.5162  27.9291     10.6692  20.032     84.2181     3.88151     264.218     
1 1 1 20 3  77 o 10 58.5724 5.133   63.4808     14.5403  69.6608     14.9363  31.8719    64.1129     6.26397     244.113     
1 1 1 20 3  78 o 7  80.7944 4.6149  133.222     17.0622  115.612     19.5537  49.5702    313.772     1.5704      313.772     
1 1 1 20 3  79 o 1  22.2129 6.65479 9.20385     14.311   -0.911316   11.4267  3.80475    217.602     3.82369     37.602      
1 1 1 20 3  80 o 15 23.8579 6.65335 -7.03851    14.632   15.927      11.9227  7.1825     183.468     4.06679     3.46806     
1 1 1 20 3  81 o 2  22.0605 6.67766 -0.957423   14.6237  6.18456     12.1328  6.26225    162.951     4.90875     342.951     
1 1 1 20 3  82 o 14 45.445  7.23696 57.4019     17.0187  33.4255     15.5301  25.7942    344.936     0.107282    344.936     
1 1 1 20 3  83 o 18 23.2101 6.92949 -2.71674    16.1696  10.7628     12.8562  4.95672    14.6873     12.1142     194.687     
1 1 1 20 3  84 o 14 27.9198 7.63587 15.1555     17.0203  16.6896     13.6316  9.22569    141.23      2.6661      141.23      
1 1 1 20 3  85 o 1  28.9981 7.97091 5.07955     18.7514  28.2628     17.0956  10.8394    198.239     0.805969    18.2387     
1 1 1 20 3  86 o 3  28.013  7.9855  27.354      19.2008  6.4612      16.0464  4.30487    316.228     0.369983    316.228     
1 1 1 20 3  87 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 4  0  o 18 275.148 2.87295 1342.49     39.5951  1342.49     39.5951  135.741    180         130.593     8.66634e-06 
1 1 1 20 4  1  o 7  33.177  3.68203 18.6008     5.94417  21.42       5.86972  44.4991    172.538     98.0406     172.538     
1 1 1 20 4  2  o 14 493.229 4.23121 4316.91     104.589  4310.79     104.584  398.991    224.009     88.3626     224.009     
1 1 1 20 4  3  o 15 782.057 6.28288 10870       246.236  10842.1     246.242  644.286    69.035      152.974     69.035      
1 1 1 20 4  4  o 11 244.331 2.69744 1058.79     33.0377  1057.36     33.0196  109.631    36.1038     122.852     216.104     
1 1 1 20 4  5  o 6  605.114 5.17881 6491.63     154.112  6499.92     159.93   352.228    280.952     172.814     100.952     
1 1 1 20 4  6  o 10 129.967 2.30917 301.827     15.0325  297.086     15.0345  58.7051    141.789     12.2937     141.789     
1 1 1 20 4  7  o 3  250.092 2.80154 1107.96     35.105   1109.26     35.1191  108.33     146.276     134.714     326.276     
1 1 1 20 4  8  o 17 129.029 2.27424 306.322     14.6967  284.186     14.6864  23.3847    19.8536     116.747     199.854     
1 1 1 20 4  9  o 10 192.624 2.46726 656.462     23.8015  658.758     23.8324  85.7917    104.128     90.9543     284.128     
1 1 1 20 4  10 o 5  388.155 3.6815  2691.23     71.615   2651.5      71.6076  317.997    286.56      83.5512     286.56      
1 1 1 20 4  11 o 16 426.053 3.84444 3224.13     80.5391  3213.27     83.5948  317.231    320.372     24.2183     320.372     
1 1 1 20 4  12 f 0  465.481 4.06079 3843.54     94.72    3841.34     94.7337  386.846    61.4332     0           0           
1 1 1 20 4  13 o 15 351.537 3.37978 2206.96     58.4125  2175.02     60.631   218.983    118.602     63.2787     298.602     
1 1 1 20 4  14 o 15 525.837 4.56799 4925.71     122.587  4884.43     118.139  345.007    97.979      67.6194     277.979     
1 1 1 20 4  15 o 8  118.54  2.29337 256.758     13.3526  241.821     13.8409  3.31842    88.9259     161.199     88.9259     
1 1 1 20 4  16 o 15 347.909 3.44086 2143.88     62.2395  2148.51     57.6516  245.247    331.776     3.90789     151.776     
1 1 1 20 4  17 o 16 356.216 3.65504 2246.93     63.8027  2253.45     66.6654  218.986    3.75335     69.5047     183.753     
1 1 1 20 4  18 o 3  335.31  3.54986 1981.9      60.9135  2005.73     58.344   218.624    256.577     38.4158     76.5771     
1 1 1 20 4  19 o 11 86.5829 2.44462 138.61      10.8361  127.687     10.337   15.7348    83.8609     23.5796     263.861     
1 1 1 20 4  20 o 4  230.563 2.88801 935.326     34.0687  949.617     32.6427  89.444     199.205     143.443     19.2053     
1 1 1 20 4  21 o 12 255.626 3.04506 1141.54     39.8203  1175.78     38.1479  119.182    241.719     120.172     61.7185     
1 1 1 20 4  22 o 15 242.49  2.9705  1040.14     37.6804  1045.02     34.4346  148.68     311.637     38.9529     131.637     
1 1 1 20 4  23 o 17 277.747 2.98385 1381.35     40.6599  1354.39     42.3675  237.287    34.6453     91.6548     34.6453     
1 1 1 20 4  24 o 13 275.917 2.92045 1371.9      40.3504  1328.02     40.4048  118.781    170.285     150.219     350.285     
1 1 1 20 4  25 f 0  263.577 2.92968 1237.41     37.8742  1226.31     39.4966  177.306    172.601     0           0           
1 1 1 20 4  26 o 4  562.48  4.99614 5603.14     137.952  5633.75     143.669  403.873    133.93      6.33084     133.93      
1 1 1 20 4  27 o 3  279.937 2.90882 1370.74     39.1757  1408.53     42.4128  180.261    33.3464     31.1224     213.346     
1 1 1 20 4  28 o 9  188.579 2.48504 609.415     22.4897  651.878     24.4846  117.193    251.279     22.3032     71.2794     
1 1 1 20 4  29 o 11 124.877 2.33466 274.826     13.9237  278.468     15.2496  27.3443    313.198     111.758     133.198     
1 1 1 20 4  30 o 2  211.342 2.72844 794.39      27.0177  789.622     30.6516  108.535    15.8879     76.4571     195.888     
1 1 1 20 4  31 o 6  323.651 3.44684 1837.76     50.9915  1879.13     60.5134  283.194    43.9143     113.765     43.9143     
1 1 1 20 4  32 o 19 391.16  4.01592 2672.49     75.0869  2759.79     82.2936  315.563    81.4354     81.2059     81.4354     
1 1 1 20 4  33 o 7  80.7753 2.70753 118.696     11.1578  113.262     10.7014  29.7162    67.7618     27.7202     247.762     
1 1 1 20 4  34 o 9  153.618 2.48434 428.99      18.6729  408.009     19.5376  102.036    348.181     0.246482    348.181     
1 1 1 20 4  35 o 1  214.373 3.17697 811.719     34.098   818.887     34.163   89.3285    317.463     117.621     137.463     
1 1 1 20 4  36 o 11 260.43  3.25844 1214.84     42.5775  1191.99     42.4739  186.042    299.32      12.7184     299.32      
1 1 1 20 4  37 o 7  101.232 2.62595 169.654     13.2941  194.753     13.2529  62.74      170.787     23.0414     170.787     
1 1 1 20 4  38 o 18 153.756 2.57137 405.672     19.4159  433.071     20.2127  91.7117    341.312     20.4654     161.312     
1 1 1 20 4  39 o 1  139.461 2.621   323.635     17.7715  367.448     18.8286  72.9681    195.816     37.3635     15.8155     
1 1 1 20 4  40 o 11 226.266 2.78874 885.448     30.2777  931.157     32.9614  175.542    138.133     44.6486     138.133     
1 1 1 20 4  41 o 6  94.6294 2.55295 157.664     11.8281  160.443     12.3394  41.0528    356.378     31.166      176.378     
1 1 1 20 4  42 o 8  111.174 2.54247 217.348     13.7895  221.55      14.5003  79.3548    260.726     33.2567     260.726     
1 1 1 20 4  43 o 5  77.7153 2.94437 108.61      10.9506  106.345     11.8697  22.1336    318.231     44.3178     138.231     
1 1 1 20 4  44 o 16 271.512 3.14181 1301.83     42.6502  1315.14     42.8483  190.09     263.388     10.1744     263.388     
1 1 1 20 4  45 o 18 236.147 3.00303 969.215     36.2418  1010.59     34.7783  174.636    8.08963     29.9407     8.08963     
1 1 1 20 4  46 o 6  225.326 3.02419 902.037     33.2812  900.633     34.9941  136.708    161.436     31.8062     341.436     
1 1 1 20 4  47 o 3  20.8122 5.334   8.55826     6.61634  2.83896     8.24463  16.313     120.168     38.1321     120.168     
1 1 1 20 4  48 o 18 22.7179 5.40893 10.8136     7.04684  5.7392      7.86806  24.3039    178.869     60.3494     178.869     
1 1 1 20 4  49 o 19 118.38  2.65784 252.578     15.1258  245.532     16.3265  54.0772    333.084     47.2161     153.084     
1 1 1 20 4  50 o 14 88.7387 2.97713 142.056     12.2643  138.409     14.0501  46.7305    174.828     17.4961     354.828     
1 1 1 20 4  51 o 5  166.314 2.68559 489.665     20.9731  492.979     23.7181  113.737    307.784     6.83622     307.784     
1 1 1 20 4  52 o 18 312.228 3.51431 1723.48     53.6238  1747.56     56.3364  241.915    353.287     63.5376     353.287     
1 1 1 20 4  53 o 17 27.7453 5.05608 7.50437     6.75373  21.5161     8.08435  2.86505    175.42      11.4102     175.42      
1 1 1 20 4  54 o 3  80.8551 3.07421 106.667     10.8551  127.167     13.9708  47.7202    83.2762     3.76294     263.276     
1 1 1 20 4  55 o 16 191.659 2.69104 656.13      24.0119  650.612     27.5439  138.122    251.108     22.5379     251.108     
1 1 1 20 4  56 o 3  191.766 2.61343 649.202     23.964   659.317     26.2317  127.581    356.964     1.69294     356.964     
1 1 1 20 4  57 o 15 146.934 2.69028 390.697     20.2611  378.598     19.3251  102.365    303.279     13.3048     303.279     
1 1 1 20 4  58 o 9  151.757 2.66058 407.54      19.2151  413.004     21.1973  121.609    205.566     46.5967     205.566     
1 1 1 20 4  59 o 4  52.1527 3.37708 46.405      8.75838  51.7002     8.66978  29.3829    325.29      10.3058     325.29      
1 1 1 20 4  60 f 0  93.6823 2.68815 160.268     12.2757  153.205     12.8856  57.958     270.313     0           0           
1 1 1 20 4  61 o 9  136.807 2.50281 325.174     17.3951  342.315     16.8803  93.0056    1.23258     7.85793     1.23258     
1 1 1 20 4  62 o 3  32.7981 4.9735  24.0271     8.57917  16.7825     7.33079  7.25828    320.336     21.1377     140.336     
1 1 1 20 4  63 o 5  109.319 2.6976  220.613     14.5521  207.057     14.9331  72.2622    337.862     3.90923     337.862     
1 1 1 20 4  64 o 13 39.1795 4.29508 26.6624     8.37967  30.272      7.87101  12.3682    175.205     21.0341     355.205     
1 1 1 20 4  65 o 10 49.0221 3.58861 46.4791     8.98897  41.159      8.38991  31.891     293.397     6.66266     293.397     
1 1 1 20 4  66 o 13 66.9853 3.06689 77.0872     10.5743  84.8603     9.83166  51.3578    240.559     20.9093     240.559     
1 1 1 20 4  67 o 16 67.4149 3.09779 81.8895     10.6017  82.2369     10.2113  27.5389    167.858     29.4505     347.858     
1 1 1 20 4  68 f 0  119.692 2.72951 250.403     15.9997  264.036     16.7047  72.0252    57.355      0           0           
1 1 1 20 4  69 f 0  54.95   3.22004 52.5912     9.1256   57.0755     8.3828   52.6377    334.719     0           0           
1 1 1 20 4  70 o 19 64.6837 3.3299  76.0397     10.5779  76.0284     10.8602  37.7185    25.2599     4.43492     205.26      
1 1 1 20 4  71 o 19 33.1551 5.64419 14.8546     10.0334  28.1421     9.0131   15.8786    122.298     4.86034     302.298     
1 1 1 20 4  72 o 13 31.626  5.91634 25.3564     10.088   14.4805     9.30011  12.7338    177.121     9.76076     357.121     
1 1 1 20 4  73 o 4  38.4461 5.29739 27.9275     9.48535  29.7387     10.1953  16.7897    73.7002     11.4709     253.7       
1 1 1 20 4  74 o 7  60.6258 4.31755 64.0256     13.3975  74.1916     12.2639  38.0706    343.619     2.50446     343.619     
1 1 1 20 4  75 o 13 62.3437 4.52442 64.5618     14.7181  83.1811     12.3818  43.8215    282.55      12.6073     282.55      
1 1 1 20 4  76 o 13 25.1585 6.51643 16.8069     11.5254  5.14876     10.6572  9.12721    322.147     1.42246     142.147     
1 1 1 20 4  77 o 9  22.2744 6.45349 8.2608      12.4212  3.60858     10.5454  4.89439    30.1337     4.74593     210.134     
1 1 1 20 4  78 o 14 41.5708 6.45725 33.9003     13.87    37.8809     12.3068  16.8048    116.269     13.8793     296.269     
1 1 1 20 4  79 o 8  34.5991 6.18868 4.88623     13.6637  42.3164     12.0862  13.333     18.6263     11.5571     198.626     
1 1 1 20 4  80 o 12 57.1747 6.24049 85.3497     17.597   49.4942     16.3171  30.5918    266.795     6.38452     86.7948     
1 1 1 20 4  81 f 0  49.4785 6.97997 47.1897     17.0913  56.9589     16.258   22.3219    216.377     0           0           
1 1 1 20 4  82 o 6  22.8115 6.79263 -6.34406    15.004   12.1082     13.2477  5.08865    59.308      0.197841    59.3079     
1 1 1 20 4  83 o 13 25.5976 7.6205  13.8296     17.8412  5.60822     15.4584  6.03955    143.689     1.26553     143.689     
1 1 1 20 4  84 o 4  25.1585 8.0031  -1.03952    17.8745  12.4806     23.9128  5.39051    14.6931     0.783395    194.693     
1 1 1 20 4  85 o 18 23.0304 7.15015 9.93489     18.1291  1.68504     13.3077  2.90164    180.508     2.86811     0.507954    
1 1 1 20 4  86 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 5  0  o 1  57.4074 2.77559 59.2184     7.89804  59.2184     7.89804  129.208    8.6768e-06  333.327     8.6768e-06  
1 1 1 20 5  1  o 15 384.205 3.62809 2629.14     71.147   2605.36     68.551   352.598    87.8563     158.889     87.8563     
1 1 1 20 5  2  o 11 341.546 3.33298 2043.39     55.9911  2092.93     58.1047  293.243    249.126     102.865     249.126     
1 1 1 20 5  3  o 3  701.311 5.75518 8697.26     202.263  8762.39     202.274  539.118    256.272     58.8511     256.272     
1 1 1 20 5  4  o 5  338.247 3.17225 2017.31     53.7636  2039.19     53.7806  233.228    54.1986     16.1713     234.199     
1 1 1 20 5  5  o 9  141.646 2.28442 350.253     16.2112  360.964     16.2179  22.8392    59.6147     142.93      239.615     
1 1 1 20 5  6  f 0  258.143 2.84591 1185.99     38.2182  1176.45     35.3704  138.264    178.222     0           0           
1 1 1 20 5  7  o 1  572.193 5.14143 5861.52     144.411  5757.89     150.328  487.588    192.734     147.694     192.734     
1 1 1 20 5  8  o 17 343.67  3.3105  2105.85     58.0663  2082.14     55.9565  270.473    136.187     51.969      136.187     
1 1 1 20 5  9  o 2  83.3249 2.28857 125.512     9.33695  120.99      9.72591  1.05912    91.2084     84.1658     91.2084     
1 1 1 20 5  10 o 9  194.98  2.53431 676.714     24.7588  670.995     24.7678  110.587    133.016     45.7834     313.016     
1 1 1 20 5  11 o 11 218.522 2.64763 844.89      27.8363  847.984     30.1118  99.4843    67.9114     106.869     247.911     
1 1 1 20 5  12 o 5  212.785 2.5739  802.837     27.4347  802.29      27.459   179.449    31.1832     74.4582     31.1832     
1 1 1 20 5  13 o 13 105.248 2.37491 203.01      12.9982  190.169     12.0251  27.0456    262.676     68.505      82.6756     
1 1 1 20 5  14 o 15 271.628 3.10319 1315.18     43.1558  1301.08     41.3171  181.231    115.621     19.8888     295.621     
1 1 1 20 5  15 o 14 511.081 5.31166 4610.33     139.571  4663.98     132.376  371.177    185.703     6.37065     185.703     
1 1 1 20 5  16 o 7  170.838 2.68028 520.048     22.9487  514.714     22.9447  55.0884    293.236     123.471     113.236     
1 1 1 20 5  17 f 0  210.857 2.93371 804.252     30.2275  772.426     31.7154  220.148    294.726     0           0           
1 1 1 20 5  18 o 3  31.4677 4.13084 21.114      6.34768  15.3455     6.17125  40.3484    227.526     91.0697     227.526     
1 1 1 20 5  19 o 13 241.512 2.94416 1037.03     35.6246  1031.32     35.6424  177.948    291.247     22.2885     291.247     
1 1 1 20 5  20 o 14 401.3   3.75565 2848.25     75.5114  2865.12     75.5465  283.929    57.0192     4.16977     237.019     
1 1 1 20 5  21 o 16 89.4452 2.19035 145.665     9.76177  138.343     9.83779  18.74      180.291     47.2633     0.290886    
1 1 1 20 5  22 o 4  191.034 2.46187 657.026     23.0861  636.951     24.0234  114.45     193.783     30.0967     13.7826     
1 1 1 20 5  23 o 5  326.281 3.22727 1905.31     51.7565  1870.81     53.7432  281.109    167.633     104.495     167.633     
1 1 1 20 5  24 o 19 322.603 3.20975 1834.16     50.9034  1857.32     52.8724  183.5      48.9674     89.8791     228.967     
1 1 1 20 5  25 o 5  193.994 2.50983 674.394     23.8999  660.032     24.8779  161.798    256.244     65.0926     256.244     
1 1 1 20 5  26 o 10 89.722  2.2808  140.923     9.99198  144.867     10.4845  36.8366    323.518     7.70934     143.518     
1 1 1 20 5  27 o 10 175.163 2.46987 550.688     21.2286  537.282     22.1109  113.729    343.876     10.6513     163.876     
1 1 1 20 5  28 o 3  378.487 3.74179 2511.31     70.9611  2572.73     70.9768  333.046    332.514     131.355     332.514     
1 1 1 20 5  29 f 0  182.509 2.64429 596.502     24.1798  584.8       24.1892  121.581    198.737     0           0           
1 1 1 20 5  30 o 12 339.668 3.63924 2039.21     61.9304  2055.44     61.9647  260.251    227.544     42.0127     227.544     
1 1 1 20 5  31 o 15 266.804 3.17667 1261.18     42.4708  1264.33     42.4775  140.829    183.084     92.6163     3.08385     
1 1 1 20 5  32 o 14 283.847 3.4025  1426.14     48.3636  1432.96     48.436   217.716    330.426     39.4012     330.426     
1 1 1 20 5  33 o 17 162.215 2.76488 463.081     23.5616  470.603     21.2932  135.77     359.883     59.7397     359.883     
1 1 1 20 5  34 o 3  234.686 2.99894 978.19      32.823   975.855     37.5535  160.3      107.465     3.59408     287.464     
1 1 1 20 5  35 o 13 81.7895 2.84607 113.502     10.7931  124.508     12.4644  35.0941    224.948     8.29095     44.9484     
1 1 1 20 5  36 o 14 107.886 2.42037 192.968     12.3936  220.704     13.757   72.5992    315.76      35.8467     315.76      
1 1 1 20 5  37 o 6  37.0043 4.29402 24.7743     6.6012   25.1217     8.65613  10.5231    234.427     31.9613     234.427     
1 1 1 20 5  38 o 15 73.6148 2.7896  88.8569     10.1308  104.258     10.3412  24.3995    254.85      15.9998     74.85       
1 1 1 20 5  39 o 15 178.936 2.7533  523.224     24.9477  614.516     24.2502  116.822    1.43351     6.91621     181.434     
1 1 1 20 5  40 o 2  106.421 2.62205 202.77      14.0954  199.488     13.8299  54.525     190.854     23.1812     10.8544     
1 1 1 20 5  41 o 6  230.23  2.99288 892.647     35.7766  989.701     33.0187  130.95     142.703     53.1892     322.703     
1 1 1 20 5  42 o 18 122.978 2.58972 270.173     16.3604  266.852     15.5181  54.109     355.215     52.2432     175.215     
1 1 1 20 5  43 o 9  150.446 2.64705 393.858     19.0041  409.593     20.8793  89.1827    126.737     20.807      306.737     
1 1 1 20 5  44 o 15 221.029 2.83825 844.608     30.7532  889.689     32.1283  108.438    329.864     84.5543     149.864     
1 1 1 20 5  45 f 0  102.023 2.66479 179.405     13.5044  190.604     13.6933  73.4727    223.624     0           0           
1 1 1 20 5  46 o 18 212.675 2.79059 805.571     28.9812  800.24      30.4788  130.465    13.3921     27.6539     193.392     
1 1 1 20 5  47 o 10 96.9729 2.67488 169.464     12.5252  164.915     13.3943  3.024      172.428     121.928     352.428     
1 1 1 20 5  48 o 2  105.569 2.93297 199.851     13.9646  196.686     16.8458  66.0115    230.624     3.29093     50.6242     
1 1 1 20 5  49 o 9  192.353 2.92841 663.823     26.6587  651.003     29.6849  155.713    47.6154     54.2109     47.6154     
1 1 1 20 5  50 o 13 182.737 2.81028 609.936     22.6718  576.933     28.3133  161.088    132.947     79.9837     132.947     
1 1 1 20 5  51 o 18 67.2839 3.14311 81.146      9.73992  80.5968     11.2716  37.1179    5.6565      18.6563     5.6565      
1 1 1 20 5  52 o 11 279.378 3.15356 1379.78     40.3541  1398.19     47.688   215.018    182.077     53.9896     182.077     
1 1 1 20 5  53 o 14 81.7441 2.6676  121.491     10.4915  116.646     11.2708  63.6469    194.229     35.972      194.229     
1 1 1 20 5  54 o 14 41.3094 4.35732 40.1558     8.25235  23.3352     8.64114  9.01696    262.815     9.3853      82.815      
1 1 1 20 5  55 o 13 130.378 2.48229 309.857     15.6362  295.293     16.7196  89.6396    79.6934     9.38635     79.6934     
1 1 1 20 5  56 o 15 72.8588 2.90069 101.889     9.84266  88.1212     11.0764  47.8021    193.736     10.1331     193.736     
1 1 1 20 5  57 o 3  162.931 2.56598 465.432     20.2015  479.841     21.694   82.6557    192.9       49.4887     12.8999     
1 1 1 20 5  58 o 15 65.0559 3.04071 72.0023     9.97667  79.8117     9.6998   31.261     172.045     17.1155     352.045     
1 1 1 20 5  59 o 1  153.362 2.5809  411.75      20.2386  426.568     19.4042  116.859    153.263     32.9511     153.263     
1 1 1 20 5  60 o 18 19.2816 5.24193 4.73217     7.81683  4.56381     6.44219  1.36806    132.417     8.3174      132.417     
1 1 1 20 5  61 o 14 42.7866 3.80678 31.785      8.19896  35.1035     7.70399  20.8872    179.045     7.76512     359.045     
1 1 1 20 5  62 o 14 50.1801 3.44067 49.6023     8.86571  41.8328     8.2161   26.6367    106.472     7.35923     286.472     
1 1 1 20 5  63 o 9  72.5644 2.97415 105.698     10.9796  84.2225     10.499   60.7988    152.741     32.5031     152.741     
1 1 1 20 5  64 o 2  69.1147 3.05669 94.2957     11.3966  78.2074     9.69313  46.1876    148.759     6.08869     148.759     
1 1 1 20 5  65 o 14 123.18  2.55787 276.156     16.2136  267.236     15.3307  89.1973    114.067     20.2083     114.067     
1 1 1 20 5  66 o 10 53.9666 3.53557 63.2052     9.61032  43.7492     9.10693  22.5831    287.82      21.5201     107.82      
1 1 1 20 5  67 o 16 16.6707 4.80087 4.71452     6.62179  -1.16977    6.32666  3.22315    282.608     15.8803     282.608     
1 1 1 20 5  68 o 2  29.5621 5.12595 18.8105     7.85263  14.8681     7.24874  11.7641    187.799     2.2613      187.799     
1 1 1 20 5  69 o 8  71.1324 3.12679 79.5748     10.9154  104.462     11.1276  39.4425    46.6212     10.0284     226.621     
1 1 1 20 5  70 o 5  42.7935 4.76666 46.9203     10.5324  24.1576     8.94534  21.7796    282.044     7.40021     102.044     
1 1 1 20 5  71 o 8  44.9107 4.06776 40.7803     10.3728  34.5523     7.43788  25.8749    146.802     1.90033     326.802     
1 1 1 20 5  72 o 13 82.5584 3.14442 143.687     15.0242  105.991     10.9691  56.5856    188.039     10.4306     188.039     
1 1 1 20 5  73 o 3  33.285  6.62854 19.6477     12.2711  25.5653     11.0456  13.3158    243.476     11.1513     63.4761     
1 1 1 20 5  74 o 18 94.5854 3.75961 168.385     19.0614  162.878     16.3582  72.0472    101.723     27.1341     101.723     
1 1 1 20 5  75 o 15 25.4189 6.6388  13.168      12.8155  10.3172     9.54306  9.35652    72.681      0.229588    72.681      
1 1 1 20 5  76 o 19 34.5175 6.79587 18.4167     11.7574  32.175      13.0741  13.3746    273.465     11.727      93.4648     
1 1 1 20 5  77 o 8  23.7736 6.23914 -6.31324    10.786   19.9297     12.019   6.31418    112.909     5.0483      292.909     
1 1 1 20 5  78 o 8  45.1197 6.15032 31.5094     12.8227  52.9332     13.9518  30.2385    219.98      10.2418     219.98      
1 1 1 20 5  79 o 15 22.7941 6.89306 1.87928     14.9881  5.55945     13.129   4.84093    231.255     11.4726     51.2551     
1 1 1 20 5  80 o 10 52.6875 6.82163 69.6055     18.2012  47.8776     16.4537  30.5126    134.7       0.67355     314.7       
1 1 1 20 5  81 o 15 32.4699 7.70174 28.5965     16.5977  18.8189     12.9841  14.1078    277.063     6.5797      97.0634     
1 1 1 20 5  82 o 9  19.4017 6.30338 -0.229459   15.5155  -8.02054    12.1783  2.02091    227.509     1.92374     47.5087     
1 1 1 20 5  83 o 16 30.3055 7.97478 19.6562     16.8782  22.6066     15.6383  12.2756    67.6928     4.33317     67.6928     
1 1 1 20 5  84 o 19 19.2983 6.37759 -1.08974    16.6374  -11.0593    13.6096  0.858994   60.1722     6.90962     240.172     
1 1 1 20 5  85 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 6  0  o 9  330.273 3.3588  1934.57     55.5668  1934.57     55.5668  188.507    180         106.614     8.65166e-06 
1 1 1 20 6  1  o 16 507.173 4.52952 4557.9      115.124  4568.83     115.126  350.757    343.336     34.4072     163.336     
1 1 1 20 6  2  o 1  390.466 3.58992 2696.02     70.2488  2711.09     70.245   394.224    79.9844     232.932     79.9844     
1 1 1 20 6  3  o 13 277.48  2.8455  1374.44     39.5624  1355.39     39.5732  215.112    60.4181     38.8575     60.4181     
1 1 1 20 6  4  o 12 197.918 2.33299 701.721     23.1469  686.885     23.1308  128.891    295.908     13.2176     115.908     
1 1 1 20 6  5  o 7  95.1191 2.2398  158.912     10.662   162.168     10.6608  18.9515    306.914     64.9902     126.914     
1 1 1 20 6  6  o 14 241.193 2.65957 1046.2      32.1431  1016.32     32.1453  246.807    339.135     191.457     339.135     
1 1 1 20 6  7  o 15 675.33  5.91766 8174.92     204.28   8024.39     196.251  607.271    327.736     233.86      327.736     
1 1 1 20 6  8  o 15 407.257 3.83185 2930.37     78.2026  2952.85     78.2076  308.677    249.445     31.2919     249.445     
1 1 1 20 6  9  o 4  245.913 2.95241 1085.69     35.5403  1058.62     37.1853  176.712    179.876     9.63589     179.876     
1 1 1 20 6  10 o 2  646.399 5.9572  7435.21     197.127  7408.12     188.748  505.872    28.8647     73.7011     28.8647     
1 1 1 20 6  11 o 5  399.566 4.19477 2812.23     81.9872  2852.47     85.9815  369.646    278.66      168.82      278.66      
1 1 1 20 6  12 o 4  249.19  3.21221 1082.87     40.1409  1119.39     40.0777  178.76     200.531     9.14377     200.531     
1 1 1 20 6  13 o 11 96.3539 2.55009 169.123     12.3284  160.547     12.2509  30.3971    44.9493     17.4462     224.949     
1 1 1 20 6  14 o 16 397.8   4.18951 2774.61     81.5181  2840.83     85.5116  299.951    6.31904     29.7895     6.31903     
1 1 1 20 6  15 o 7  134.204 2.76633 345.219     18.6741  294.933     18.4275  74.7908    124.268     15.5519     304.268     
1 1 1 20 6  16 o 18 537.775 5.2247  5181.98     147.112  5089.45     134.315  399.142    124.496     22.9078     124.496     
1 1 1 20 6  17 o 6  66.702  2.62741 77.8258     8.7864   80.426      8.70611  19.0636    155.447     97.3496     155.447     
1 1 1 20 6  18 o 19 292.109 3.26491 1507.87     44.5747  1518.62     50.8304  141.955    309.865     131.089     129.865     
1 1 1 20 6  19 o 14 421.721 3.89308 3158.96     82.2621  3151.8      82.292   296.278    117.236     11.2035     297.236     
1 1 1 20 6  20 f 0  186.451 2.52488 604.206     23.5567  628.529     23.6217  151.562    196.692     0           0           
1 1 1 20 6  21 o 13 436.651 4.06448 3388.51     87.1351  3378.26     90.7044  319.015    3.59429     13.2268     3.59428     
1 1 1 20 6  22 o 13 199.317 2.61232 692.56      26.0694  716.241     26.1128  120.801    6.51902     33.484      186.519     
1 1 1 20 6  23 o 5  230.09  2.79714 923.082     31.5823  954.521     32.9255  155.685    240.702     9.55592     60.7017     
1 1 1 20 6  24 o 1  224.47  2.77499 918.913     31.8674  868.337     30.5694  216.875    102.964     129.982     102.964     
1 1 1 20 6  25 f 0  92.0681 2.55318 145.074     11.7509  156.068     11.7517  77.0011    284.342     0           0           
1 1 1 20 6  26 f 0  164.28  2.59422 478.438     21.3691  478.601     21.3459  85.0493    210.949     0           0           
1 1 1 20 6  27 o 7  319.318 3.46209 1786.76     55.3866  1831.46     55.4105  235.221    103.926     18.3719     103.926     
1 1 1 20 6  28 o 1  71.4994 2.77571 87.1087     9.75803  94.8358     10.0538  10.0001    290.898     107.372     290.898     
1 1 1 20 6  29 o 18 103.123 2.52952 185.257     13.0969  192.359     13.0028  57.8092    292.811     33.3098     292.811     
1 1 1 20 6  30 o 14 96.2449 2.41853 157.809     11.1945  171.226     12.1035  52.1231    290.626     23.7844     290.626     
1 1 1 20 6  31 o 8  94.2448 2.42601 148.796     11.3782  166.864     11.4764  21.5612    294.497     76.7161     114.497     
1 1 1 20 6  32 o 19 85.1083 2.8014  126.075     12.2781  131.452     11.5201  9.3407     230.911     127.81      230.911     
1 1 1 20 6  33 o 6  101.485 2.50231 177.821     12.2632  187.971     13.1524  28.1376    16.2137     74.1834     196.214     
1 1 1 20 6  34 o 12 193.262 2.96668 659.032     25.5531  666.17      31.6218  147.041    269.661     31.6578     269.661     
1 1 1 20 6  35 o 9  119.963 2.49984 255.907     15.1738  254.962     14.8495  30.0034    65.0529     99.4082     245.053     
1 1 1 20 6  36 o 19 189.362 2.62052 616.929     24.732   655.337     24.9944  128.47     148.76      0.397781    328.76      
1 1 1 20 6  37 o 4  128.163 2.37155 273.123     15.3514  310.254     15.0263  103.789    12.2383     58.733      12.2383     
1 1 1 20 6  38 o 3  226.506 2.75516 884.831     31.1435  935.747     31.3931  155.226    130.378     0.228425    310.378     
1 1 1 20 6  39 f 0  169.53  2.57364 492.447     21.6176  527.406     22.1078  153.342    266.856     0           0           
1 1 1 20 6  40 o 19 115.935 2.43153 247.142     13.3146  230.201     14.8015  63.0712    299.549     22.2639     119.549     
1 1 1 20 6  41 o 12 81.3014 2.67442 110.69      10.9791  124.554     10.7063  35.2185    268.834     20.9434     88.8336     
1 1 1 20 6  42 o 13 180.946 2.57321 577.229     22.6906  584.508     23.9668  132.991    46.0451     23.0722     46.0451     
1 1 1 20 6  43 o 3  198.908 2.58715 680.781     25.0691  723.54      26.5145  119.094    9.81101     32.4286     189.811     
1 1 1 20 6  44 f 0  134.251 2.42095 314.198     16.1385  325.815     16.4104  125.339    147.784     0           0           
1 1 1 20 6  45 o 8  31.7602 4.69223 14.3034     6.94635  23.3715     7.56472  8.07507    147.085     29.9652     147.085     
1 1 1 20 6  46 f 0  199.136 2.58455 715.996     24.7707  691.896     26.7372  133.136    208.097     0           0           
1 1 1 20 6  47 f 0  200.792 2.59539 706.222     25.0948  725.49      27.1217  131.599    158.403     0           0           
1 1 1 20 6  48 o 11 125.594 2.66782 288.256     15.8785  272.664     17.5652  81.1204    58.9875     3.01458     238.988     
1 1 1 20 6  49 o 4  107.638 2.59742 203.616     13.8749  208.461     14.1065  39.302     235.609     63.2003     55.6089     
1 1 1 20 6  50 o 11 139.708 2.62066 348.606     18.2288  345.475     18.4332  85.0906    47.2628     15.3025     227.263     
1 1 1 20 6  51 o 6  49.085  3.72573 37.509      8.75635  49.8155     9.18185  14.1053    184.581     22.1908     4.58149     
1 1 1 20 6  52 o 1  145.738 2.5603  391.892     17.8707  363.762     19.3992  102.686    352.057     12.5917     352.057     
1 1 1 20 6  53 o 11 41.3648 4.20021 27.484      7.6283   35.198      9.31538  7.62821    62.2744     22.9032     242.274     
1 1 1 20 6  54 o 15 95.791  2.70557 164.463     12.2001  162.704     13.6718  74.416     192.956     29.5634     192.956     
1 1 1 20 6  55 o 3  25.2343 5.55388 11.4796     6.88005  11.3543     8.72494  13.5774    223.118     44.7546     223.118     
1 1 1 20 6  56 f 0  110.924 2.58509 216.93      13.4027  221.72      15.2558  83.9829    24.9609     0           0           
1 1 1 20 6  57 o 15 310.89  3.35456 1702.08     50.1932  1754.1      54.305   238.231    13.3552     62.1409     13.3552     
1 1 1 20 6  58 o 8  182.228 2.64116 585.22      24.2775  598.758     23.9544  133.134    353.224     25.3905     353.224     
1 1 1 20 6  59 o 18 36.8061 4.51407 22.4649     8.35181  27.9105     7.56855  16.9078    220.608     5.60358     220.608     
1 1 1 20 6  60 o 13 102.258 2.76994 174.826     14.1076  199.702     14.1857  84.3221    198.228     36.9584     198.228     
1 1 1 20 6  61 o 11 94.9014 2.84478 140.849     12.9811  183.288     13.9477  48.6736    316.746     25.6953     136.746     
1 1 1 20 6  62 o 19 90.835  3.01088 152.372     14.5873  144.125     12.7262  59.1788    138.582     1.65109     138.582     
1 1 1 20 6  63 o 19 114.918 2.74829 239.744     16.4554  233.749     15.1405  84.0813    1.51588     19.8101     1.51588     
1 1 1 20 6  64 o 6  104.199 2.74103 202.294     14.8228  187.433     13.7588  73.4216    3.3682      13.0557     3.3682      
1 1 1 20 6  65 o 12 132.949 2.60214 325.215     18.1177  308.436     16.5188  98.8246    164.289     26.3645     164.289     
1 1 1 20 6  66 o 11 41.2653 4.41101 25.7786     8.96935  38.2923     8.26195  9.05276    330.592     31.9645     150.592     
1 1 1 20 6  67 o 5  88.2594 2.82393 140.881     12.9846  139.546     11.9115  51.8943    273.752     8.24695     93.7524     
1 1 1 20 6  68 o 14 21.0022 5.26984 4.06064     7.25376  9.93421     7.03982  4.24378    358.168     30.1847     358.168     
1 1 1 20 6  69 o 1  16.5879 4.8557  4.56936     6.94353  -2.19679    6.63749  1.08833    144.734     13.2051     144.734     
1 1 1 20 6  70 o 1  20.8622 5.23119 7.04764     6.71109  7.70801     6.99147  3.71334    294.651     11.2788     114.651     
1 1 1 20 6  71 o 6  72.9265 3.47252 117.601     15.0097  79.3079     10.3401  51.7233    324.348     12.8517     324.348     
1 1 1 20 6  72 o 3  22.9484 6.15611 14.3945     11.3584  1.87883     8.70481  2.48628    38.2512     0.413641    38.2512     
1 1 1 20 6  73 o 16 51.9681 5.07278 43.6668     12.8376  61.3658     12.3956  30.2594    164.383     2.26498     344.384     
1 1 1 20 6  74 o 14 25.3678 6.43663 11.1845     10.433   12.692      10.3896  9.0121     46.3494     1.26293     46.3494     
1 1 1 20 6  75 o 10 25.9665 6.25083 3.73154     10.471   20.3837     10.6597  9.77695    148.102     3.82746     328.102     
1 1 1 20 6  76 o 5  23.9901 6.68366 3.00591     10.3559  14.9833     13.5558  1.43675    106.903     21.5173     286.903     
1 1 1 20 6  77 f 0  45.8356 5.83266 39.5465     12.1773  45.4252     13.6462  29.6179    294.74      0           0           
1 1 1 20 6  78 o 19 41.8881 6.49898 32.897      13.4214  40.3703     13.1476  22.0766    314.29      3.82452     134.29      
1 1 1 20 6  79 o 1  26.4756 6.98584 14.3987     11.9272  11.6522     13.0736  11.5895    67.7676     2.75169     67.7676     
1 1 1 20 6  80 o 5  48.9329 6.49369 58.6779     14.2393  42.0569     16.0686  30.3838    353.954     4.11438     353.954     
1 1 1 20 6  81 o 16 23.8519 6.70741 15.0128     12.16    0.511596    13.2198  8.37422    56.3581     2.72062     236.358     
1 1 1 20 6  82 o 5  23.5097 7.25027 7.84812     15.4749  1.78487     16.9486  6.05214    93.3496     6.65602     273.35      
1 1 1 20 6  83 o 1  24.403  7.38505 11.6728     18.2938  6.278       13.6958  5.86015    2.9692      3.80043     182.969     
1 1 1 20 6  84 o 17 26.2807 8.01493 -2.71569    29.2023  16.0543     14.5294  6.24444    322.989     8.25435     142.989     
1 1 1 20 6  85 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 7  0  o 3  231.423 2.83419 950.052     32.8475  950.052     32.8475  212.467    180         85.7955     180         
1 1 1 20 7  1  o 10 125.496 2.57805 274.43      16.9078  284.45      15.4194  59.2782    198.909     36.2859     18.9086     
1 1 1 20 7  2  o 4  424.573 4.20127 3216.14     91.3317  3180.04     87.4273  282.686    21.2846     49.3791     201.285     
1 1 1 20 7  3  o 8  499.802 4.7301  4441.45     121.029  4425.3      115.875  376.117    120.972     26.9283     120.971     
1 1 1 20 7  4  o 9  166.49  2.65372 498.933     23.0823  483.888     21.1848  135.877    263.78      72.2963     263.78      
1 1 1 20 7  5  o 2  106.999 2.51597 204.146     13.416   202.2       13.5275  46.5811    158.189     8.08255     338.189     
1 1 1 20 7  6  o 10 405.768 4.22042 2958.66     87.8651  2884.02     83.77    334.101    148.653     83.9909     148.653     
1 1 1 20 7  7  o 13 187.072 2.8079  634.095     26.3497  606.932     26.29    150.702    63.7307     55.0529     63.7307     
1 1 1 20 7  8  o 1  47.8395 3.44273 43.2168     8.47899  38.8544     7.80333  105.24     321.517     261.551     321.517     
1 1 1 20 7  9  o 5  189.721 2.86619 635.207     27.2688  641.124     27.2323  135.985    249.838     15.8996     249.838     
1 1 1 20 7  10 o 6  598.492 5.91639 6395.39     177.463  6333.88     177.434  455.043    194.908     41.1089     194.908     
1 1 1 20 7  11 o 13 264.571 3.07854 1250.49     41.7376  1231.95     39.8887  191.13     19.8003     9.4075      19.8002     
1 1 1 20 7  12 o 1  128.235 2.37665 294.035     15.2804  289.374     15.2395  33.0513    357.073     102.002     177.073     
1 1 1 20 7  13 o 12 208.443 2.60618 783.543     27.2197  757.116     27.2222  122.579    160.977     44.0804     340.977     
1 1 1 20 7  14 o 6  366.743 3.57561 2387.79     65.7079  2383.75     65.7245  268.135    231.826     10.9941     231.826     
1 1 1 20 7  15 o 9  415.931 4.06696 3037.66     84.7719  3101.99     84.7648  419.94     14.1071     247.691     14.1071     
1 1 1 20 7  16 o 19 72.1776 2.6941  94.8311     9.81566  90.4389     9.60479  1.99696    290.095     51.7912     110.095     
1 1 1 20 7  17 o 4  407.612 3.83976 2967.12     79.9913  2928.64     76.8658  360.383    129.692     137.662     129.692     
1 1 1 20 7  18 o 5  522.461 4.75587 4884.31     121.969  4809.43     126.978  478.539    324.187     205.473     324.187     
1 1 1 20 7  19 o 8  534.865 4.93368 5055.91     132.25   5105.7      132.235  426.532    295.982     82.3402     295.982     
1 1 1 20 7  20 o 15 136.88  2.56118 335.182     17.5611  329.657     17.5446  104.086    155.008     65.6289     155.008     
1 1 1 20 7  21 o 2  170.075 2.57308 516.236     22.4254  509.469     21.4307  74.431     212.727     86.8971     32.7272     
1 1 1 20 7  22 o 18 226.349 2.7922  922.126     32.3783  894.987     30.967   90.1087    227.252     140.483     47.2524     
1 1 1 20 7  23 o 7  160.528 2.59797 459.444     20.4267  454.396     21.3573  49.1589    355.146     125.463     175.146     
1 1 1 20 7  24 o 17 151.667 2.68389 400.79      20.8661  415.338     19.879   140.263    192.871     105.151     192.871     
1 1 1 20 7  25 o 8  400.113 4.1578  2870.53     85.3586  2813.96     81.3658  292.644    124.273     13.5816     124.273     
1 1 1 20 7  26 o 3  119.739 2.42628 253.275     14.5701  255.563     14.5177  84.9335    116.814     19.7872     116.814     
1 1 1 20 7  27 o 15 430.738 4.11764 3305.26     88.8635  3283.03     88.9031  361.397    202.257     109.271     202.257     
1 1 1 20 7  28 o 7  179.497 2.31945 579.146     20.8045  563.404     20.9192  104.721    1.81266     38.5399     181.813     
1 1 1 20 7  29 o 17 264.609 2.91672 1241.55     38.6355  1242.37     38.7197  190.483    83.3103     9.44993     83.3104     
1 1 1 20 7  30 o 11 127.7   2.36683 292.182     14.7016  286.528     15.5443  101.441    6.22066     48.0807     6.22066     
1 1 1 20 7  31 o 16 261.865 2.97209 1207.42     41.1993  1225.55     36.6373  214.915    160.114     64.9829     160.114     
1 1 1 20 7  32 o 8  88.8425 2.41507 139.155     10.5652  141.19      10.8992  46.4207    270.142     0.494318    270.142     
1 1 1 20 7  33 o 5  130.463 2.33877 308.622     14.8922  295.282     15.6432  48.8621    327.846     77.2071     147.846     
1 1 1 20 7  34 o 13 406.617 3.98092 2949.77     81.0945  2923.16     81.1446  303.847    41.8212     35.1739     41.8212     
1 1 1 20 7  35 o 13 202.351 2.44271 726.319     24.7074  725.985     24.8338  70.4337    217.709     139.771     37.7092     
1 1 1 20 7  36 o 14 252.543 2.78781 1121.61     34.5313  1141.26     36.0287  158.819    151.193     33.0384     331.193     
1 1 1 20 7  37 o 8  335.995 3.20907 1970.57     52.9611  2036.91     55.1112  262.28     195.785     56.1277     195.785     
1 1 1 20 7  38 o 7  83.6265 2.51215 121.009     10.1607  127.566     10.8489  15.0315    237.971     73.7822     57.9706     
1 1 1 20 7  39 o 9  292.019 3.17704 1455.27     45.3985  1573.17     47.5955  244.994    86.5889     86.576      86.5889     
1 1 1 20 7  40 o 8  79.1219 2.62954 103.065     10.1984  119.875     10.5758  41.3727    167.737     186.162     167.737     
1 1 1 20 7  41 o 2  95.2863 2.55156 159.994     11.4645  162.645     12.8313  64.8476    313.47      21.7317     313.47      
1 1 1 20 7  42 o 10 132.126 2.40169 311.821     15.433   307.826     16.3374  60.2285    122.536     56.455      302.536     
1 1 1 20 7  43 f 0  78.9614 2.73034 107.713     10.6211  114.204     10.9215  53.7289    265.775     0           0           
1 1 1 20 7  44 o 18 28.8455 5.19971 16.2741     7.61792  14.5659     7.4672   26.5803    314.244     76.7818     314.244     
1 1 1 20 7  45 o 7  107.975 2.57745 202.987     14.0776  211.459     13.7632  71.3368    130.57      2.7591      130.57      
1 1 1 20 7  46 o 11 290.881 3.17888 1447.74     46.3073  1561.44     46.3219  238.909    284.053     79.5177     284.053     
1 1 1 20 7  47 o 2  312.445 3.29488 1673.17     51.4109  1800.61     51.7299  275.038    344.151     123.071     344.151     
1 1 1 20 7  48 o 12 92.7776 2.73987 153.58      12.4717  152.858     12.9444  47.4388    233.873     24.7084     53.8732     
1 1 1 20 7  49 o 15 155.807 2.52006 402.2       19.4905  461.384     19.8147  90.1657    346.231     28.9548     166.231     
1 1 1 20 7  50 o 10 102.178 2.60839 177.528     13.1605  194.296     13.5011  88.135     342.427     50.2239     342.427     
1 1 1 20 7  51 o 15 96.7513 2.77085 179.772     12.8269  154.299     13.8281  54.258     66.5931     16.8728     246.593     
1 1 1 20 7  52 o 11 187.879 2.75179 654.044     25.8012  602.853     25.9772  132.525    163.168     13.1914     163.168     
1 1 1 20 7  53 o 5  118.049 2.63396 247.708     14.5962  248.825     16.4752  70.1068    214.992     14.7341     34.9924     
1 1 1 20 7  54 o 2  22.653  5.18748 2.1815      6.91529  14.497      7.65072  20.998     153.599     59.064      153.599     
1 1 1 20 7  55 o 16 60.4875 3.38499 63.5409     9.59964  68.0705     10.7519  17.0437    315.228     40.5245     135.228     
1 1 1 20 7  56 o 17 143.604 2.67995 358.456     19.262   377.256     19.2677  96.3096    218.727     2.87693     218.727     
1 1 1 20 7  57 o 4  139.173 2.58087 334.648     16.7544  356.487     19.1949  93.5122    226.457     3.1004      226.456     
1 1 1 20 7  58 o 19 72.4456 2.96338 88.9453     10.2787  99.4042     11.1528  47.9454    223.988     3.44928     223.988     
1 1 1 20 7  59 o 8  64.5794 3.27801 81.0634     10.138   69.421      10.8148  55.9401    176.907     35.2276     176.907     
1 1 1 20 7  60 o 4  18.6942 5.30556 0.897976    7.26179  5.41821     8.02838  2.37251    72.0192     13.8005     72.0192     
1 1 1 20 7  61 o 17 48.2514 4.0558  52.8112     9.60852  33.6355     9.24426  31.1379    243.345     5.39143     243.345     
1 1 1 20 7  62 o 9  46.2838 3.74005 36.3953     8.50524  42.0708     8.48704  14.965     183.048     27.2031     3.0478      
1 1 1 20 7  63 o 6  72.4051 3.00118 95.2936     10.483   93.6315     11.1814  53.0022    213.106     14.8397     213.106     
1 1 1 20 7  64 o 12 22.0942 5.30612 6.04138     6.17358  11.1817     7.93385  2.13088    151.278     12.1136     331.278     
1 1 1 20 7  65 f 0  48.9905 4.04699 47.951      10.1124  40.6421     9.37844  37.2639    335.082     0           0           
1 1 1 20 7  66 o 19 97.4338 2.81697 180.644     14.4073  161.291     13.0544  61.5056    118.656     1.60208     298.657     
1 1 1 20 7  67 o 11 43.5969 4.31313 36.6984     9.6887   34.214      8.63863  33.1452    57.0883     19.7597     57.0883     
1 1 1 20 7  68 f 0  46.3084 4.22523 38.73       9.88566  41.1975     9.21448  36.2493    336.559     0           0           
1 1 1 20 7  69 o 7  93.1757 2.88827 163.317     14.1463  150.854     12.7639  50.9934    91.8497     16.4028     271.85      
1 1 1 20 7  70 o 2  51.6994 4.21108 51.0893     11.6051  48.9627     9.74904  25.6582    81.44       12.4379     261.44      
1 1 1 20 7  71 o 8  27.8421 5.13275 20.0268     7.22625  10.3106     7.76259  11.0858    116.651     8.16256     296.651     
1 1 1 20 7  72 o 4  38.502  5.89746 22.2222     11.1465  38.1123     11.1294  22.5812    88.6659     0.915566    88.6659     
1 1 1 20 7  73 o 11 60.1224 4.17598 75.5108     12.6819  61.0546     12.0908  46.8606    77.1082     21.2671     77.1082     
1 1 1 20 7  74 o 14 42.0189 5.48359 34.8425     11.2559  35.4465     10.9844  27.3372    10.7807     6.8948      10.7807     
1 1 1 20 7  75 o 14 51.5424 4.90086 50.0806     12.1482  53.1186     12.5285  33.4662    30.9779     6.17209     30.9779     
1 1 1 20 7  76 o 18 36.6929 6.40432 38.7462     11.6064  17.6742     13.0533  10.8888    287.972     20.3866     107.972     
1 1 1 20 7  77 o 12 25.8631 6.83506 8.67872     11.9768  15.4928     12.1303  9.28133    297.438     5.84294     117.438     
1 1 1 20 7  78 o 15 36.2446 7.14612 31.8905     12.9651  24.8684     14.2804  17.2742    121.883     6.37348     301.883     
1 1 1 20 7  79 o 17 22.6254 6.66378 3.41993     12.4226  8.22128     12.722   3.37719    290.105     16.0814     110.105     
1 1 1 20 7  80 f 0  40.1006 7.04618 35.1069     14.5236  35.8779     13.6853  13.9151    167.863     0           0           
1 1 1 20 7  81 o 6  32.1255 7.55839 31.077      15.6735  17.1777     13.1469  14.7492    338.961     3.57623     158.961     
1 1 1 20 7  82 o 6  19.7721 6.37631 -14.0397    17.5881  3.13556     12.0894  1.52597    252.064     9.61717     72.0643     
1 1 1 20 7  83 o 17 26.8602 7.5776  9.74281     17.3745  19.2318     14.4041  7.57516    136.754     2.16446     316.754     
1 1 1 20 7  84 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 8  0  o 17 176.757 2.8652  554.63      25.3499  554.63      25.3499  127.418    180         4.13358     8.65098e-06 
1 1 1 20 8  1  o 7  327.407 3.76084 1900.18     58.5152  1902.99     64.745   272.481    227.919     77.0667     227.919     
1 1 1 20 8  2  o 19 181.664 3.01341 583.353     29.4907  587.388     25.1633  132.989    216.972     22.5278     216.972     
1 1 1 20 8  3  f 0  192.477 2.8031  656.783     27.702   656.914     26.3575  119.566    265.519     0           0           
1 1 1 20 8  4  o 4  189.308 2.68708 637.08      25.5297  633.661     25.4552  140.976    57.7827     26.3675     57.7827     
1 1 1 20 8  5  o 13 183.124 2.66694 609.098     24.484   580.141     24.4554  139.97     277.704     35.8828     277.704     
1 1 1 20 8  6  o 9  312.128 3.36514 1740.13     51.4886  1715.67     53.7444  239.117    263.457     32.4238     263.457     
1 1 1 20 8  7  o 3  280.938 3.22029 1375.81     46.3092  1423.79     44.3006  205.092    315.695     11.0259     315.695     
1 1 1 20 8  8  o 15 225.654 2.71009 916.678     30.0324  889.017     31.2263  190.243    95.0768     70.6738     95.0768     
1 1 1 20 8  9  o 12 162.496 2.52929 470.488     21.0268  465.75      20.162   85.1506    74.5089     49.4474     254.509     
1 1 1 20 8  10 o 13 261.688 2.96152 1205.41     38.0374  1223.24     39.6327  212.845    61.3004     57.7294     61.3004     
1 1 1 20 8  11 o 2  187.232 2.46252 642.806     23.5192  600.488     22.6929  131.79     221.93      8.38219     221.93      
1 1 1 20 8  12 o 5  393.1   3.69025 2718.54     72.7045  2764.41     72.6865  298.38     43.3947     30.1584     43.3947     
1 1 1 20 8  13 o 10 254.803 2.87114 1162.75     36.6431  1139.79     36.6785  203.743    229.215     48.8708     229.215     
1 1 1 20 8  14 o 10 349.817 3.32571 2150.74     58.2836  2190.36     58.3175  280.376    51.3765     59.1465     51.3765     
1 1 1 20 8  15 o 18 159.039 2.44854 454.344     19.1698  442.519     19.8431  108.323    191.002     3.61261     191.002     
1 1 1 20 8  16 o 13 335.189 3.55871 2053.55     59.7631  1933.7      59.7527  229.611    1.17718     22.0738     181.177     
1 1 1 20 8  17 o 3  180.667 2.70855 587.606     24.5502  569.985     24.4928  164.375    30.8219     89.6003     30.8219     
1 1 1 20 8  18 o 14 374.483 3.96636 2482.95     76.1894  2494.71     72.6314  304.949    100.459     72.0333     100.459     
1 1 1 20 8  19 o 7  292.784 3.33774 1500.6      48.9733  1540.85     48.9672  176.581    192.156     66.1754     12.1557     
1 1 1 20 8  20 o 13 253.353 3.09136 1133.9      38.3746  1143.08     40.1122  222.187    45.0603     86.7821     45.0603     
1 1 1 20 8  21 o 15 139.797 2.58603 343.182     18.1141  350.376     18.0876  64.3452    217.585     63.2925     37.5847     
1 1 1 20 8  22 o 19 62.9101 2.55991 72.4071     8.01695  68.4368     8.05     8.79424    41.7364     89.6695     41.7364     
1 1 1 20 8  23 o 11 130.43  2.36908 302.489     15.4128  301.15      15.5315  59.594     308.223     57.716      128.223     
1 1 1 20 8  24 o 8  347.689 3.38574 2151.2      58.9679  2138.62     59.0188  251.351    222.53      5.91813     222.53      
1 1 1 20 8  25 o 19 303.567 3.12434 1640.26     47.4981  1629.3      47.5623  141.642    14.4688     150.035     194.469     
1 1 1 20 8  26 o 18 132.859 2.42172 319.785     16.0261  306.674     16.1859  99.7056    95.2014     27.8362     95.2014     
1 1 1 20 8  27 o 6  167.364 2.24573 503.583     18.7791  489.726     18.8878  93.6775    134.882     43.3966     314.882     
1 1 1 20 8  28 o 16 25.333  4.55943 12.0935     5.6799   11.5832     5.92853  24.7138    312.396     57.2537     312.396     
1 1 1 20 8  29 o 14 185.921 2.3604  621.128     21.9399  604.801     22.0407  135.003    8.29215     14.6366     8.29214     
1 1 1 20 8  30 o 19 322.169 3.12434 1823.78     51.3034  1859.53     49.5471  243.486    338.057     31.9782     338.057     
1 1 1 20 8  31 o 4  346.753 3.47959 2137.71     61.6129  2130.71     59.2998  238.952    12.3362     12.4989     192.336     
1 1 1 20 8  32 o 18 309.346 3.12952 1733.81     48.4668  1662.69     48.547   234.385    198.486     33.8701     198.486     
1 1 1 20 8  33 o 17 65.2405 2.76601 76.444      9.28452  75.1075     8.71437  9.12921    92.303      5.17222     272.303     
1 1 1 20 8  34 o 15 164.898 2.55744 478.194     21.0665  486.392     21.2013  116.153    248.863     9.86037     248.863     
1 1 1 20 8  35 o 5  440.29  4.08978 3409.79     93.5606  3478.77     86.712   345.504    43.1794     70.6711     43.1794     
1 1 1 20 8  36 o 9  188.576 2.51797 640.332     24.6437  621.253     22.9385  141.923    319.158     27.069      319.158     
1 1 1 20 8  37 o 8  95.113  2.42552 154.91      11.6222  166.522     11.4436  58.7836    100.332     8.10332     100.332     
1 1 1 20 8  38 o 8  35.53   4.06028 26.695      7.07261  19.5813     6.81836  23.7333    209.33      71.941      209.33      
1 1 1 20 8  39 o 11 176.056 2.70615 534.297     24.1381  565.942     23.5797  134.902    282.517     31.7495     282.517     
1 1 1 20 8  40 o 3  153.904 2.47502 396.69      18.484   444.49      19.698   151.718    314.921     110.085     314.921     
1 1 1 20 8  41 o 1  197.28  2.56618 686.252     25.2203  695.101     25.521   139.138    37.6952     8.0169      37.6952     
1 1 1 20 8  42 o 15 100.448 2.5853  174.961     12.7349  183.727     13.2514  59.1999    232.037     11.6624     52.0367     
1 1 1 20 8  43 o 18 186.249 2.56489 601.511     23.7012  630.167     24.1778  143.872    76.0722     34.043      76.0722     
1 1 1 20 8  44 o 11 129.519 2.45341 301.678     15.6955  294.338     16.1148  74.8262    353.622     24.06       173.622     
1 1 1 20 8  45 o 16 106.546 2.50618 192.199     12.613   211.621     14.1199  80.9669    118.49      25.3716     118.49      
1 1 1 20 8  46 o 1  39.7247 4.39624 22.6963     7.99552  35.6698     8.78693  2.3651     41.2744     25.1301     221.274     
1 1 1 20 8  47 f 0  27.6356 5.41433 13.375      7.68117  14.8375     7.84114  50.162     92.446      0           0           
1 1 1 20 8  48 o 18 196.688 2.67767 660.504     25.6341  715.371     27.16    143.053    64.5272     19.3888     64.5273     
1 1 1 20 8  49 o 19 106.637 2.6288  192.412     13.4966  212.684     14.564   59.2747    91.9956     21.9109     271.996     
1 1 1 20 8  50 o 15 100.163 2.574   173.693     12.107   183.661     13.6785  43.9877    221.28      44.0283     41.2803     
1 1 1 20 8  51 o 9  125.224 2.55714 269.693     15.1371  288.844     16.921   93.4065    220.578     22.0274     220.578     
1 1 1 20 8  52 o 2  95.2124 2.65012 161.785     12.0526  161.475     13.1615  51.4785    349.607     20.6255     169.607     
1 1 1 20 8  53 o 6  67.4522 3.0661  86.438      9.53459  76.6951     10.9149  35.2648    95.7732     11.511      275.773     
1 1 1 20 8  54 o 16 19.5934 5.04968 8.57849     6.52351  1.5192      6.94672  17.0809    319.261     46.6676     319.261     
1 1 1 20 8  55 o 8  24.397  4.97615 17.3149     6.78659  2.17609     7.87214  15.6789    309.541     55.4697     309.541     
1 1 1 20 8  56 f 0  22.2156 5.34008 8.50191     6.91317  8.22981     7.29809  25.458     308.624     0           0           
1 1 1 20 8  57 o 11 56.108  3.37536 52.8586     9.2365   60.924      9.54584  27.4134    167.733     15.9867     347.733     
1 1 1 20 8  58 o 1  114.975 2.4964  233.075     13.8956  239.111     14.8328  82.2762    2.02706     13.3774     2.02706     
1 1 1 20 8  59 o 15 129.626 2.59897 302.574     16.0826  298.289     17.6019  100.063    21.4472     29.7494     21.4473     
1 1 1 20 8  60 o 17 113.346 2.63826 226.241     15.0709  233.805     14.8524  70.2557    54.8154     8.01553     234.815     
1 1 1 20 8  61 o 14 42.9718 4.49177 37.9233     10.2825  30.925      8.50555  27.3436    78.6944     5.98977     78.6944     
1 1 1 20 8  62 o 1  26.9496 6.00061 16.3645     9.20008  10.57       9.11088  10.1547    170.013     51.8005     170.013     
1 1 1 20 8  63 o 7  50.9329 3.89977 39.7173     9.30039  56.1982     10.1672  12.2922    133.404     39.5961     313.404     
1 1 1 20 8  64 o 12 68.0936 3.56165 71.9122     11.3242  97.7506     12.7692  31.7532    283.773     23.2496     103.773     
1 1 1 20 8  65 o 3  17.1552 5.10146 3.15183     7.63795  -1.16242    7.39816  0.794342   58.6446     8.42847     58.6446     
1 1 1 20 8  66 o 7  89.1422 2.9223  136.705     13.2428  150.193     12.7419  59.9441    255.122     5.99978     255.122     
1 1 1 20 8  67 o 16 23.3284 5.64003 11.3593     7.62298  7.73042     8.42774  4.4243     246.104     35.2469     246.104     
1 1 1 20 8  68 o 13 27.3961 5.48289 19.9549     7.96191  8.62187     8.64879  7.27896    109.01      16.1756     289.01      
1 1 1 20 8  69 o 2  65.3354 3.62204 84.1783     12.8332  73.1998     10.7013  45.2785    322.488     8.97836     322.488     
1 1 1 20 8  70 o 3  39.6652 5.19307 29.8456     10.6696  31.5569     9.14174  21.1258    277.671     4.9699      97.6714     
1 1 1 20 8  71 o 3  69.8651 3.49029 96.6387     13.1262  83.6932     11.1696  49.7499    305.009     12.6534     305.009     
1 1 1 20 8  72 o 10 42.8774 5.58752 35.0203     11.4     38.2571     11.7277  16.6211    271.247     18.4858     91.247      
1 1 1 20 8  73 o 12 61.5367 4.29414 61.4704     12.6862  82.7214     13.2697  35.0973    237.852     5.37254     57.8525     
1 1 1 20 8  74 o 10 28.6276 6.24389 25.3795     10.7773  6.78686     10.7547  12.2759    244.702     3.54585     244.702     
1 1 1 20 8  75 o 14 67.8146 4.2896  91.4703     14.4993  83.2444     14.3276  48.825     156.984     15.584      156.984     
1 1 1 20 8  76 o 1  28.7001 6.78619 13.3177     11.7395  20.2665     11.5256  8.67553    161.403     13.6288     341.403     
1 1 1 20 8  77 o 8  31.2577 7.25017 23.8588     13.8197  17.95       12.4629  8.91204    200.942     17.5038     20.9416     
1 1 1 20 8  78 o 2  21.2068 6.45648 -7.20141    14.3611  7.974       11.906   5.83213    292.387     4.31924     112.387     
1 1 1 20 8  79 o 14 17.3356 5.74805 -10.724     13.9886  -6.40476    11.2375  0.0870027  200.167     14.1213     20.1669     
1 1 1 20 8  80 o 11 21.0996 6.60797 0.522462    15.6345  2.26626     12.0937  3.09844    359.646     1.51849     179.646     
1 1 1 20 8  81 o 5  18.7281 5.96027 -0.885668   10.9698  -1.07743    12.5007  1.20421    233.708     6.82904     53.7085     
1 1 1 20 8  82 o 19 20.6821 6.53865 -9.92462    16.7614  6.61944     12.677   0.488186   80.9517     0.967346    260.952     
1 1 1 20 8  83 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 9  0  o 2  385.772 4.16714 2640.82     80.5195  2640.82     80.5195  273.652    180         19.6381     8.65176e-06 
1 1 1 20 9  1  o 11 185.851 2.84717 602.642     25.1839  622.369     27.8234  127.571    55.3207     0.815201    235.321     
1 1 1 20 9  2  o 13 258.306 3.11356 1175.29     40.3659  1191.29     40.2406  208.189    24.2314     50.513      24.2314     
1 1 1 20 9  3  o 16 352.2   3.76417 2184.55     66.4815  2217.13     66.3919  335.261    99.6242     165.627     99.6242     
1 1 1 20 9  4  o 19 369.26  3.7259  2375.65     66.0938  2463.01     71.7713  290.349    344.975     46.8976     344.975     
1 1 1 20 9  5  o 4  180.763 2.48802 588.497     22.5606  570.151     22.5128  146.923    66.1541     50.7805     66.1541     
1 1 1 20 9  6  o 13 414.949 3.81685 3059.81     77.8885  3050.31     80.821   352.263    154.977     103.497     154.977     
1 1 1 20 9  7  o 3  322.72  3.22951 1847.77     51.2563  1846.6      53.1857  185.21     277.895     96.1254     97.8954     
1 1 1 20 9  8  o 8  262.836 2.81031 1231.9      36.9967  1218.05     37.0358  153.649    210.841     69.5357     30.8407     
1 1 1 20 9  9  o 13 70.3865 2.65851 91.654      9.53836  84.6003     9.14882  12.4256    230.041     103.987     230.041     
1 1 1 20 9  10 o 9  111.293 2.52706 219.606     14.0732  220.045     14.0788  67.9947    199.254     8.23738     199.254     
1 1 1 20 9  11 o 14 32.8206 4.41124 22.8601     7.07313  16.8452     6.88604  48.7168    178.055     117.944     178.055     
1 1 1 20 9  12 o 9  282.088 3.55369 1425.44     48.8936  1398.09     51.5168  256.259    133.757     111.413     133.757     
1 1 1 20 9  13 o 8  231.322 3.12043 962.88      36.185   935.345     36.1569  167.6      355.271     6.99219     355.271     
1 1 1 20 9  14 o 16 195.766 2.93831 697.907     28.8267  661.654     28.8116  159.584    10.4435     46.901      10.4435     
1 1 1 20 9  15 f 0  338.643 3.98827 2029.42     69.4362  2041.45     65.8737  210.188    96.9548     0           0           
1 1 1 20 9  16 o 11 135.433 2.92893 337.707     20.4133  313.717     19.303   75.4901    241.918     33.9491     61.9177     
1 1 1 20 9  17 o 16 140.918 2.70307 334.558     17.8924  370.695     20.2605  35.8068    104.567     125.403     284.567     
1 1 1 20 9  18 o 14 228.512 3.04986 944.372     35.7055  908.226     34.1498  180.751    64.702      38.1521     64.702      
1 1 1 20 9  19 o 16 179.942 2.60614 596.738     23.4507  552.022     23.5222  127.595    121.867     4.43521     121.867     
1 1 1 20 9  20 o 10 111.285 2.53137 237.881     13.709   202.48      14.3584  23.5751    252.387     103.721     72.3873     
1 1 1 20 9  21 o 8  136.157 2.47854 337.982     16.7868  319.818     17.0049  102.199    315.561     24.9722     315.561     
1 1 1 20 9  22 o 1  152.13  2.512   423.401     19.4914  397.584     18.812   108.229    211.915     9.94977     211.915     
1 1 1 20 9  23 o 7  329.505 3.37846 1931.57     55.7362  1921.66     55.8395  238.966    288.173     6.51828     288.173     
1 1 1 20 9  24 o 1  135.7   2.55167 347.785     17.2329  306.246     17.3897  79.4009    340.64      24.0025     160.64      
1 1 1 20 9  25 o 3  188.731 2.57436 641.107     24.2491  622.334     24.4408  137.917    101.603     14.2801     101.603     
1 1 1 20 9  26 o 16 55.6816 2.91217 62.3458     7.93087  48.6815     8.08336  0.0609276  38.122      45.0637     38.122      
1 1 1 20 9  27 o 3  111.74  2.39014 227.531     13.2334  215.767     13.4889  9.29725    113.639     132.775     293.639     
1 1 1 20 9  28 o 18 69.4555 2.64032 85.0897     9.03371  86.5288     9.27897  48.7326    28.6908     187.357     28.6908     
1 1 1 20 9  29 o 12 289.122 2.98159 1486.5      43.1457  1479.66     43.2548  187.554    231.066     34.1475     51.0655     
1 1 1 20 9  30 o 5  398.401 3.93288 2851.53     81.7095  2786.77     75.2676  287.47     292.667     8.45178     292.667     
1 1 1 20 9  31 o 16 265.314 2.93118 1261.7      38.8902  1236.19     39.051   189.659    266.447     6.60822     266.447     
1 1 1 20 9  32 o 10 252.248 2.95786 1156.41     37.3244  1101.9      37.4382  145.344    37.6148     63.7513     217.615     
1 1 1 20 9  33 o 8  320.648 3.28477 1854.34     49.4175  1795.85     55.8383  254.333    160.586     57.4992     160.586     
1 1 1 20 9  34 o 13 157.271 2.49043 444.821     19.0998  432.653     20.1262  124.703    293.441     39.513      293.441     
1 1 1 20 9  35 f 0  333.103 3.23984 1990        53.0091  1949.56     55.1111  191.923    291.166     0           0           
1 1 1 20 9  36 o 10 205.564 2.58326 757.45      26.0239  741.93      27.1732  148.468    208.471     13.4981     208.471     
1 1 1 20 9  37 o 14 274.834 2.89895 1349.82     39.102   1331.48     40.7238  217.82     208.999     52.7478     208.999     
1 1 1 20 9  38 o 2  169.792 2.49764 526.969     20.254   496.285     22.1379  142.177    120.685     55.1417     120.685     
1 1 1 20 9  39 o 6  346.307 3.6349  2063.08     61.5567  2201.42     64.6223  275.267    131.619     66.4513     131.619     
1 1 1 20 9  40 o 8  264.355 2.82671 1232.89     36.6492  1248.65     38.2389  214.376    143.032     61.8125     143.032     
1 1 1 20 9  41 o 8  125.022 2.39979 274.671     14.5812  280.525     15.4572  106.848    213.61      50.5125     213.61      
1 1 1 20 9  42 o 11 192.37  2.55431 664.729     23.4596  649.313     25.709   160.386    119.589     57.7915     119.589     
1 1 1 20 9  43 o 16 125.774 2.44814 282.305     14.6091  279.83      16.1754  49.086     237.447     72.3596     57.4471     
1 1 1 20 9  44 o 4  29.9399 5.05688 11.5442     7.15845  22.1972     8.06747  7.82514    244.012     31.8593     244.012     
1 1 1 20 9  45 o 7  72.684  2.89159 91.1543     9.92318  97.3178     11.0547  36.3179    248.194     17.273      68.1937     
1 1 1 20 9  46 o 9  224.187 2.74075 878.054     29.977   908.97      31.6069  181.44     189.936     56.343      189.936     
1 1 1 20 9  47 o 14 238.394 2.77229 974.768     31.63    1047.29     34.6184  180.538    245.961     34.8716     245.961     
1 1 1 20 9  48 o 13 24.3281 5.54912 10.3703     7.50134  10.3922     7.89641  13.7152    62.0176     42.8515     62.0176     
1 1 1 20 9  49 o 9  82.5853 2.90789 112.591     11.3388  131.251     12.6674  49.7465    158.211     5.73951     338.211     
1 1 1 20 9  50 o 19 158.24  2.48758 424.82      19.082   466.567     20.3782  111.889    10.7711     11.0987     10.7711     
1 1 1 20 9  51 o 14 57.0439 3.37526 60.7308     9.20589  56.3423     9.86251  28.6143    12.2691     13.8951     12.2691     
1 1 1 20 9  52 o 2  41.8428 4.02994 23.5494     7.78507  41.6493     8.23079  9.65311    68.2544     1.31754     248.254     
1 1 1 20 9  53 o 13 65.2358 2.92108 70.7703     9.23681  81.8877     9.75634  26.6608    313.353     29.251      133.353     
1 1 1 20 9  54 o 16 83.8334 2.70792 128.737     11.1568  122.484     11.5184  53.7081    176.698     1.4345      356.698     
1 1 1 20 9  55 o 15 26.5687 5.14199 14.1375     7.01073  12.3274     7.1008   1.12432    17.1528     24.3127     197.153     
1 1 1 20 9  56 o 8  49.645  3.93804 45.9266     9.03111  43.9151     10.1474  30.5607    262.279     0.915519    262.279     
1 1 1 20 9  57 o 3  24.2904 5.22557 13.7825     6.93642  7.55991     7.28661  3.6792     170.628     32.4777     170.628     
1 1 1 20 9  58 o 15 128.199 2.53501 284.436     16.1889  303.343     16.3436  104.73     216.344     40.4042     216.344     
1 1 1 20 9  59 o 14 18.493  5.01785 7.98793     6.97831  -1.14957    6.87689  0.828766   18.202      7.70149     18.202      
1 1 1 20 9  60 o 7  45.8695 4.25657 37.9492     8.87591  39.824      10.1951  28.4942    346.252     2.34779     346.252     
1 1 1 20 9  61 o 3  37.7863 5.39271 37.8214     11.3233  18.3272     8.59146  15.7118    345.803     12.915      165.803     
1 1 1 20 9  62 o 5  33.8813 5.41056 27.433      9.63521  17.1961     8.4264   8.42174    192.438     22.8805     12.4379     
1 1 1 20 9  63 o 17 115.492 2.85282 245.217     17.247   234.68      15.7162  76.949     257.88      3.61284     257.88      
1 1 1 20 9  64 o 2  136.539 2.65113 317.105     17.5057  352.962     18.747   82.9697    156.92      11.9426     336.92      
1 1 1 20 9  65 o 10 38.8108 4.78965 40.5892     8.9744   18.3895     8.56297  11.8026    202.98      23.7233     22.9799     
1 1 1 20 9  66 o 15 22.6606 5.6441  7.15879     7.37876  10.6716     8.58281  2.88677    81.3195     17.7121     261.319     
1 1 1 20 9  67 o 3  32.2419 5.56562 21.5013     8.55819  19.4174     9.29589  15.9458    189.334     4.69631     9.33391     
1 1 1 20 9  68 o 10 43.4461 4.66556 30.9993     9.36395  41.3178     10.2667  35.6185    228.023     23.3699     228.023     
1 1 1 20 9  69 f 0  44.4465 4.53988 27.3061     9.51776  49.4209     9.32389  32.8468    161.926     0           0           
1 1 1 20 9  70 f 0  95.4962 3.23281 167.493     15.6394  166.662     15.2109  50.7671    99.0571     0           0           
1 1 1 20 9  71 o 18 27.5224 6.30642 13.5356     10.9102  16.532      9.19199  13.2288    152.55      2.21647     152.55      
1 1 1 20 9  72 o 5  28.6317 6.69483 16.2438     11.2185  17.1974     11.1317  13.588     77.7665     3.49053     77.7665     
1 1 1 20 9  73 o 14 27.076  6.85542 16.4438     13.1487  12.5012     10.428   10.8845    89.6473     1.74609     269.647     
1 1 1 20 9  74 o 11 25.6938 6.04331 -0.958249   11.0015  22.1807     10.3456  9.27048    301.239     3.48917     121.239     
1 1 1 20 9  75 o 4  62.1276 4.62498 73.6844     14.8096  74.6981     13.4969  39.6908    9.1146      3.80909     9.11461     
1 1 1 20 9  76 o 9  44.346  7.26202 46.0337     17.666   39.3269     13.9913  15.7078    43.9079     21.643      223.908     
1 1 1 20 9  77 o 15 37.1937 7.49853 22.9112     17.2059  37.9821     13.7118  18.0688    351.567     6.28849     171.567     
1 1 1 20 9  78 o 10 31.0208 7.57253 12.4174     17.8088  27.1213     13.2154  15.7427    66.0294     0.799768    246.029     
1 1 1 20 9  79 o 7  42.8403 7.03888 48.6286     15.3359  34.0674     14.4965  25.8654    57.4498     3.3041      57.4498     
1 1 1 20 9  80 o 6  31.8745 7.45189 16.7792     14.8496  30.7318     13.9984  14.959     119.942     6.33756     119.942     
1 1 1 20 9  81 o 15 23.4882 6.79216 -2.10008    14.4696  16.3995     12.9164  3.01944    1.47686     1.41726     181.477     
1 1 1 20 9  82 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 10 0  o 13 366.162 3.86038 2378.99     70.8021  2378.99     70.8021  211.851    180         115.144     8.65152e-06 
1 1 1 20 10 1  o 4  342.937 3.69868 2090.18     66.3836  2083.34     60.6256  215.427    165.297     67.972      345.297     
1 1 1 20 10 2  o 15 217.487 3.0025  862.326     31.8198  815.744     33.5403  120.707    270.954     69.9357     90.9544     
1 1 1 20 10 3  o 3  92.4237 2.62205 147.51      12.3356  155.957     11.8798  33.4499    313.923     46.4999     133.923     
1 1 1 20 10 4  o 11 46.7328 3.56501 33.5397     8.4094   45.3148     7.70667  8.73699    104.061     38.3785     104.061     
1 1 1 20 10 5  o 18 209.004 3.2551  788.016     35.0385  761.803     33.1482  174.09     310.656     54.1904     310.656     
1 1 1 20 10 6  o 15 133.867 2.81654 323.512     17.8638  312.674     19.7966  88.5934    256.292     1.75238     76.292      
1 1 1 20 10 7  o 17 446.504 5.13764 3558.29     111.535  3526.93     118.255  323.976    150.321     3.63703     330.321     
1 1 1 20 10 8  o 9  119.529 2.85219 261.009     16.6678  246.408     17.412   51.6557    317.455     58.5657     137.455     
1 1 1 20 10 9  o 13 102.602 3.01436 185.632     15.6407  188.44      15.2849  30.7024    98.0098     203.751     98.0098     
1 1 1 20 10 10 o 15 216.306 3.24352 830.014     33.1854  829.967     37.0283  170.219    226.948     32.9075     226.948     
1 1 1 20 10 11 o 2  153.344 3.01913 418.83      21.0856  415.949     25.082   53.4867    15.7094     109.616     195.709     
1 1 1 20 10 12 o 11 225.944 3.02101 898.329     31.6783  912.674     36.5952  167.301    6.83009     12.1227     6.83009     
1 1 1 20 10 13 o 4  114.743 2.48025 240.321     13.6059  227.102     14.8152  23.1526    205.104     111.549     25.1036     
1 1 1 20 10 14 o 13 136.485 2.48594 339.85      16.9145  321.111     17.0614  69.6386    198.019     48.8883     18.0186     
1 1 1 20 10 15 o 1  311.873 3.2644  1759.53     49.939   1691.98     52.0242  235.357    264.969     20.8775     264.969     
1 1 1 20 10 16 o 17 71.8991 2.73363 98.8596     9.81819  85.2779     9.7702   15.6799    182.282     0.516977    2.28158     
1 1 1 20 10 17 o 12 348.619 3.51639 2178.5      60.1556  2135.1      62.657   334.104    205.89      167.357     205.89      
1 1 1 20 10 18 o 10 82.2413 2.71883 136.389     10.7244  105.066     11.3795  0.462716   338.58      105.493     158.58      
1 1 1 20 10 19 f 0  66.4947 2.9636  78.665      10.3316  78.8207     9.28862  122.8      198.091     0           0           
1 1 1 20 10 20 o 13 147.944 2.53899 399.08      18.335   377.598     19.249   125.634    71.0989     56.4285     71.0989     
1 1 1 20 10 21 o 10 168.838 2.56622 511.729     21.2075  499.375     22.1933  94.574     312.516     46.5947     132.516     
1 1 1 20 10 22 o 15 308.177 3.2735  1684.42     50.5122  1686.15     50.5999  215.629    7.72229     10.2716     187.722     
1 1 1 20 10 23 o 3  64.5734 2.86434 71.5393     8.68882  77.0242     9.75489  2.71548    307.511     65.0622     127.511     
1 1 1 20 10 24 o 19 291.275 3.13768 1518.37     43.7514  1492.47     47.7264  203.176    242.198     9.27084     62.1976     
1 1 1 20 10 25 o 1  156.58  2.54198 436.843     18.9471  432.806     20.8894  87.5815    78.1395     40.8993     258.139     
1 1 1 20 10 26 o 7  168.051 2.57516 513.277     20.6391  488.65      22.6308  133.107    121.796     37.4627     121.796     
1 1 1 20 10 27 o 8  99.3699 2.65181 177.722     12.1186  173.086     14.1368  16.9374    243.801     97.6974     63.8012     
1 1 1 20 10 28 o 12 135.361 2.53874 328.876     16.3205  321.353     18.038   114.083    135.846     84.4267     135.846     
1 1 1 20 10 29 o 18 95.25   2.63764 158.227     12.3413  164.154     12.792   59.4865    50.9866     21.978      50.9866     
1 1 1 20 10 30 o 14 308.271 3.35569 1682.29     48.2021  1691.57     55.2574  221.781    61.8629     6.72034     61.863      
1 1 1 20 10 31 o 10 410.858 4.21749 3028.48     82.6926  2971.8      90.7123  309.436    27.5012     34.3968     27.5011     
1 1 1 20 10 32 o 18 135.691 2.57601 335.53      16.5501  318.087     18.3574  111.92     114.12      48.7832     114.12      
1 1 1 20 10 33 o 14 202.659 2.88016 747.471     27.7274  710.405     30.6151  166.344    92.7591     53.1817     92.7591     
1 1 1 20 10 34 o 18 233.648 2.88433 976.189     32.2007  961.534     35.2508  185.144    114.379     44.8311     114.379     
1 1 1 20 10 35 o 19 141.689 2.53402 366.126     16.9275  346.638     18.9183  71.4773    217.538     50.5034     37.5379     
1 1 1 20 10 36 o 19 255.813 2.9575  1204.27     36.1034  1120.06     39.489   175.389    358.783     7.5455      178.782     
1 1 1 20 10 37 f 0  89.6596 2.79313 148.826     11.6796  137.252     13.2287  54.7615    325.06      0           0           
1 1 1 20 10 38 o 10 122.329 2.67828 265.427     15.3878  266.353     17.3536  95.8353    239.969     30.0217     239.969     
1 1 1 20 10 39 o 19 174.191 2.65022 537.081     21.8494  540.268     24.3589  129.468    41.5739     19.2431     41.574      
1 1 1 20 10 40 o 9  246.266 2.87223 1082.8      33.0673  1071.79     37.6532  176.352    323.918     9.83621     323.918     
1 1 1 20 10 41 o 10 87.7679 2.77429 138.228     11.3049  136.003     12.9649  52.6486    42.6582     7.20463     222.658     
1 1 1 20 10 42 f 0  243.102 2.8408  1050.31     32.2316  1050.09     36.831   124.818    247.212     0           0           
1 1 1 20 10 43 o 18 84.6515 2.78368 134.9       10.9247  120.558     12.4582  64.0304    310.4       25.7022     310.4       
1 1 1 20 10 44 o 10 173.079 2.61254 539.475     22.3522  525.259     22.9536  84.3485    309.609     69.2498     129.609     
1 1 1 20 10 45 o 19 226.857 2.83716 919.528     30.6216  911.148     33.7938  151.393    31.0667     9.75906     211.067     
1 1 1 20 10 46 o 7  70.1835 2.97911 86.193      9.62706  89.8069     11.1998  17.4897    71.5896     55.7598     251.59      
1 1 1 20 10 47 o 4  122.405 2.5692  270.398     15.1295  263.042     16.3138  86.6354    29.7051     9.7252      29.705      
1 1 1 20 10 48 o 12 119.935 2.5437  257.812     14.3245  254.471     16.1497  69.7048    187.174     21.3158     7.17409     
1 1 1 20 10 49 o 3  200.943 2.64034 715.454     25.2405  722.317     27.8817  146.015    349.383     18.6968     349.383     
1 1 1 20 10 50 o 7  54.3115 3.26068 51.2653     8.7933   54.8613     8.77939  29.0265    6.40026     1.58286     6.40026     
1 1 1 20 10 51 o 18 49.7921 3.54326 45.418      8.90208  44.1875     8.54049  26.1362    211.531     3.49927     211.531     
1 1 1 20 10 52 o 5  57.5488 3.20282 59.1735     9.29568  59.9363     9.02492  31.4968    190.009     7.5142      10.0089     
1 1 1 20 10 53 o 13 76.7095 2.81984 91.4578     10.827   120.136     10.5832  56.6689    176.225     14.41       176.225     
1 1 1 20 10 54 o 14 67.9011 2.98901 78.3416     10.2607  87.2661     9.93447  55.6384    145.255     25.6219     145.255     
1 1 1 20 10 55 o 15 18.4893 5.16403 3.69034     7.32648  3.62979     6.81054  1.48584    18.041      9.03892     18.041      
1 1 1 20 10 56 o 8  72.077  3.19676 89.464      10.7418  97.7332     12.2353  37.971     109.933     18.1695     289.933     
1 1 1 20 10 57 o 8  63.0599 3.39547 66.8204     10.0851  77.2407     11.2244  37.4259    214.918     6.04214     34.9181     
1 1 1 20 10 58 o 9  57.2241 3.56422 68.8009     9.72823  50.8859     10.2084  43.4694    353.594     16.3733     353.594     
1 1 1 20 10 59 o 11 64.1106 3.20587 72.369      9.84303  76.3078     10.624   34.6392    211.074     13.1962     31.0743     
1 1 1 20 10 60 o 12 32.8831 5.06141 24.2754     7.88603  17.1549     8.36426  15.0291    75.9545     5.27509     255.955     
1 1 1 20 10 61 o 19 21.9295 5.51754 8.53298     7.7647   7.40032     7.49606  2.17782    281.564     13.2173     101.564     
1 1 1 20 10 62 o 11 73.8823 2.94517 94.9978     10.8351  102.051     10.8761  53.3038    86.8317     12.0647     86.8317     
1 1 1 20 10 63 o 3  48.3744 4.28299 42.0702     10.5625  44.8957     9.67171  28.5469    23.563      2.52453     203.563     
1 1 1 20 10 64 o 1  52.9805 4.05219 47.1378     11.2762  56.8406     9.48789  20.2873    321.672     26.6238     141.672     
1 1 1 20 10 65 o 14 67.3787 3.21092 82.2454     10.4463  82.978      11.1027  39.3631    76.5913     7.41766     256.591     
1 1 1 20 10 66 o 15 91.3489 2.91457 154.163     13.2909  148.201     13.3206  71.2796    230.142     25.36       230.142     
1 1 1 20 10 67 o 16 44.5068 4.19435 40.9415     8.34045  33.7481     9.59472  26.6937    342.742     1.12354     162.742     
1 1 1 20 10 68 o 2  50.9    4.10068 47.7176     10.5361  49.595      9.98141  36.0562    36.7661     9.58106     36.7662     
1 1 1 20 10 69 o 17 34.8891 6.23277 19.3364     11.4821  30.7245     10.7447  11.2257    356.73      19.2044     176.73      
1 1 1 20 10 70 o 10 23.7165 6.28621 6.7206      10.8198  11.9516     9.70813  8.31903    305.809     4.06287     125.809     
1 1 1 20 10 71 o 10 25.4524 6.53173 18.129      11.8535  5.42795     10.357   5.51111    143.339     16.0581     323.339     
1 1 1 20 10 72 o 2  30.2236 7.55867 18.6        13.4124  19.5659     15.2017  11.0117    344.421     10.4125     164.421     
1 1 1 20 10 73 o 18 21.0346 6.1004  14.5461     12.5387  -10.4724    10.098   3.20593    11.8315     2.80876     191.831     
1 1 1 20 10 74 o 15 33.9645 6.88829 33.9114     13.9456  16.3877     11.3263  17.131     248.81      3.37753     68.8099     
1 1 1 20 10 75 o 12 32.1024 7.48787 21.6734     15.4998  22.8372     12.6708  17.3175    253.804     0.0826092   253.803     
1 1 1 20 10 76 f 0  30.5194 7.25576 27.924      13.8104  11.1068     13.7962  10.5498    175.353     0           0           
1 1 1 20 10 77 o 10 53.9258 5.98625 57.6137     16.2045  62.6465     14.9459  37.3893    197.712     10.6609     197.712     
1 1 1 20 10 78 o 13 47.5892 6.36974 33.1358     14.2962  66.2621     14.7131  25.1064    279.999     5.83153     99.999      
1 1 1 20 10 79 f 0  19.5879 6.14381 -3.3002     12.0975  4.25389     12.1575  6.65389    306.347     0           0           
1 1 1 20 10 80 o 19 23.6365 6.87418 7.88214     13.5669  11.3144     12.7482  1.46994    112.511     0.451511    292.511     
1 1 1 20 10 81 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 11 0  o 11 67.2272 2.94274 81.0346     9.82618  81.0346     9.82618  37.4386    180         172.67      180         
1 1 1 20 11 1  o 18 182.878 2.92462 604.341     26.1779  582.127     27.3858  145.327    54.9421     33.3441     54.9421     
1 1 1 20 11 2  o 4  330.629 3.89247 1898.81     62.8444  1982.45     66.1523  267.075    60.6601     53.2514     60.6601     
1 1 1 20 11 3  o 12 260.234 3.61448 1170.81     45.7986  1233.18     48.4846  213.126    287.317     51.1823     287.317     
1 1 1 20 11 4  o 15 277.008 3.48951 1359.82     47.1534  1363.34     49.6992  183.76     89.2068     34.3531     269.207     
1 1 1 20 11 5  o 7  127.825 2.8244  279.677     17.0469  300.637     19.092   54.7879    166.781     67.3946     346.781     
1 1 1 20 11 6  o 9  187.717 2.95266 621.217     25.4575  628.817     29.9401  144.882    51.0269     24.7515     51.0269     
1 1 1 20 11 7  o 16 145.807 2.7507  381.908     18.9468  372.489     21.1382  130.601    287.879     70.2429     287.879     
1 1 1 20 11 8  o 1  74.4887 2.8682  99.2142     9.95002  98.1901     11.3284  27.8695    201.998     20.3292     21.9979     
1 1 1 20 11 9  o 5  96.9817 2.66802 159.641     12.8619  174.621     13.0089  58.3743    47.3549     0.111832    47.3556     
1 1 1 20 11 10 o 4  295.895 3.50068 1544.22     48.0954  1563.2      55.5024  271.871    99.7158     117.66      99.7158     
1 1 1 20 11 11 o 9  108.172 2.64385 211.495     14.035   204.047     14.5679  59.2072    264.597     40.0606     264.597     
1 1 1 20 11 12 o 19 203.838 2.92402 735.935     27.696   738.065     31.9001  113.481    71.4651     64.6231     251.465     
1 1 1 20 11 13 o 4  165.052 2.76412 476.308     21.2816  490.077     24.3804  130.548    81.8924     33.1908     81.8924     
1 1 1 20 11 14 o 3  178.619 2.65046 561.779     22.2247  569.887     25.155   138.474    310.847     27.5242     310.847     
1 1 1 20 11 15 o 15 115.473 2.48735 244.417     13.1758  229.049     15.4054  72.3077    131.977     6.31135     311.977     
1 1 1 20 11 16 o 19 220.647 2.95178 861.341     29.5531  865.951     35.4713  159.502    261.094     4.94617     261.094     
1 1 1 20 11 17 o 8  173.705 2.61862 544.706     21.75    525.631     23.755   97.3807    39.8874     49.9028     219.887     
1 1 1 20 11 18 f 0  141.435 2.53765 360.315     16.3134  349.513     19.4492  74.5965    241.77      0           0           
1 1 1 20 11 19 o 13 272.261 3.06057 1342.06     40.8742  1288.54     42.5781  235.743    112.896     83.0374     112.896     
1 1 1 20 11 20 o 18 74.108  2.66081 101.909     9.36111  93.5018     10.2619  21.0988    216.665     138.154     216.665     
1 1 1 20 11 21 o 8  151.687 2.45042 407.404     17.9069  408.68      19.3228  143.783    45.4186     98.5039     45.4186     
1 1 1 20 11 22 o 13 214.878 2.59404 828.975     27.3357  808.951     28.5022  115.088    170.152     75.37       350.152     
1 1 1 20 11 23 o 1  121.023 2.37095 264.646     13.9863  255.271     14.7191  49.6456    328.73      64.7609     148.73      
1 1 1 20 11 24 f 0  160.766 2.50459 471.46      19.2413  445.515     21.0144  172.906    242.45      0           0           
1 1 1 20 11 25 o 11 332.88  3.22993 1957.68     52.8241  1975.65     54.9274  269.229    185.344     62.5045     185.344     
1 1 1 20 11 26 o 2  229.616 2.68405 940.641     30.2159  929.92      31.5326  173.727    13.9416     23.7329     13.9416     
1 1 1 20 11 27 o 13 116.178 2.39385 247.959     13.5201  231.344     14.2752  75.1325    54.989      0.533733    234.989     
1 1 1 20 11 28 o 5  124.455 2.40819 277.959     14.8089  271.895     15.1943  73.8581    149.855     18.4518     329.855     
1 1 1 20 11 29 o 19 153.594 2.58702 409.386     18.8941  427.698     20.9172  101.069    148.406     8.25254     328.406     
1 1 1 20 11 30 f 0  221.075 2.84231 879.372     31.3929  855.23      31.5793  150.417    138.407     0           0           
1 1 1 20 11 31 o 4  123.34  2.49045 276.217     14.8837  264.03      15.8299  99.6769    36.127      42.5518     36.127      
1 1 1 20 11 32 o 13 357.963 3.71282 2281.19     63.704   2272.51     69.3719  286.328    320.859     64.4385     320.859     
1 1 1 20 11 33 o 6  276.175 3.09025 1357.35     43.5065  1351.16     42.0235  230.724    203.343     72.4797     203.343     
1 1 1 20 11 34 o 9  136.987 2.43194 327.264     16.552   338.904     16.8246  96.6776    231.341     7.73171     231.341     
1 1 1 20 11 35 o 11 69.0224 2.91726 91.7948     9.77368  78.2617     10.2217  35.3079    308.572     10.5167     308.572     
1 1 1 20 11 36 o 8  211.848 2.63582 803.207     27.8236  790.163     28.1385  130.674    65.4118     35.6293     245.412     
1 1 1 20 11 37 o 4  340.957 3.38231 2043.35     58.8154  2089.95     56.7219  256.198    331.991     31.541      331.991     
1 1 1 20 11 38 o 9  65.2346 3.17997 75.5073     10.0459  76.4883     10.6137  22.4687    284.812     35.5016     104.812     
1 1 1 20 11 39 o 19 68.571  3.13206 80.2964     10.5142  87.6586     10.8939  40.4557    117.57      2.4053      117.57      
1 1 1 20 11 40 o 10 225.865 2.67243 901.433     30.0755  911.144     30.4233  167.292    142.143     20.1544     142.143     
1 1 1 20 11 41 o 7  67.2796 3.03182 74.4373     9.89448  87.4667     10.4285  37.7871    107.651     4.1035      287.651     
1 1 1 20 11 42 o 10 370.063 3.68719 2434.1      69.5997  2447.59     67.1311  303.908    99.1093     90.9396     99.1093     
1 1 1 20 11 43 o 8  89.203  2.71826 144.537     11.6681  138.973     12.5402  52.2467    201.04      12.3096     21.0395     
1 1 1 20 11 44 o 11 130.192 2.545   303.353     15.894   299.779     17.2468  88.1185    80.7184     0.167909    260.719     
1 1 1 20 11 45 o 4  71.6395 2.96277 93.627      10.6344  89.7856     10.5445  43.8998    281.799     1.46536     101.799     
1 1 1 20 11 46 o 9  34.6621 4.69889 20.4034     7.66318  24.2338     8.06942  0.139575   347.628     29.5984     167.628     
1 1 1 20 11 47 o 19 158.265 2.5799  448.674     19.6953  442.99      21.1905  123.133    167.219     31.6106     167.219     
1 1 1 20 11 48 o 10 42.2915 4.33599 34.7745     8.15245  30.8102     9.50466  12.3819    252.269     13.8794     72.2695     
1 1 1 20 11 49 o 17 142.747 2.66955 357.259     18.1693  369.423     19.9741  105.727    172.474     19.1028     172.474     
1 1 1 20 11 50 o 15 63.9412 3.16901 67.7268     9.50373  79.3144     10.6885  45.3573    301.727     13.8146     301.727     
1 1 1 20 11 51 o 13 83.0576 2.7786  116.941     11.3303  129.958     11.7282  73.2479    167.313     40.728      167.313     
1 1 1 20 11 52 o 3  30.5869 5.34176 17.9261     7.85022  17.4594     8.43392  9.6464     60.8476     10.6031     240.848     
1 1 1 20 11 53 o 11 33.1693 5.35224 13.5258     8.53113  28.8746     9.24524  9.98027    264.763     17.2338     84.7626     
1 1 1 20 11 54 o 9  52.4119 3.91747 44.0549     10.0898  56.4815     10.0159  40.7063    183.225     19.2554     183.225     
1 1 1 20 11 55 o 13 20.1114 5.72068 1.25107     9.9736   5.60872     7.97996  0.264176   196.495     9.45611     196.495     
1 1 1 20 11 56 o 2  43.3703 4.25845 27.1987     8.24984  43.2722     9.64028  13.9952    314.751     26.3159     134.751     
1 1 1 20 11 57 o 8  53.6426 3.60286 47.6261     9.20574  57.4454     9.91921  32.1004    97.1389     3.512       277.139     
1 1 1 20 11 58 o 3  27.9937 5.4666  13.6233     7.61323  16.4306     8.24926  9.83939    267.372     2.1367      87.372      
1 1 1 20 11 59 o 17 85.6527 2.90602 137.558     12.0342  126.776     12.7794  56.6978    56.9764     1.31646     56.9766     
1 1 1 20 11 60 o 1  64.7995 3.31994 85.546      10.0837  67.3517     11.0472  41.3079    271.341     0.523886    91.3412     
1 1 1 20 11 61 o 14 26.0575 5.60001 9.74012     7.97686  15.8797     8.18477  4.69283    22.1471     18.3588     202.147     
1 1 1 20 11 62 o 7  48.3484 4.0524  43.9322     8.92456  42.5917     10.2389  27.1882    57.0402     5.94435     237.04      
1 1 1 20 11 63 o 2  22.3593 5.75971 11.0335     8.06769  3.99624     9.28444  3.90654    119.297     14.1149     299.297     
1 1 1 20 11 64 o 8  31.1732 6.07601 12.7502     10.9631  25.1002     9.54732  11.1587    166.758     14.2799     346.758     
1 1 1 20 11 65 o 5  45.2448 4.90381 46.2696     10.7979  32.5965     10.513   20.3022    37.2721     16.0164     217.272     
1 1 1 20 11 66 o 14 54.9386 3.87549 59.6467     10.3523  52.774      10.639   35.6405    18.2937     2.18938     18.2938     
1 1 1 20 11 67 o 3  30.5233 5.76478 21.5896     9.03617  15.9618     9.06808  8.65925    115.799     18.7779     295.799     
1 1 1 20 11 68 o 8  58.0231 4.54165 66.8422     14.6482  61.5855     11.1353  46.4413    141.035     21.3495     141.035     
1 1 1 20 11 69 o 13 17.4565 5.58673 -3.50873    11.9379  -2.80177    8.89828  0.65069    352.878     1.49054     172.878     
1 1 1 20 11 70 o 8  29.9356 6.54009 26.7353     13.0725  11.7016     8.84823  15.7644    91.8529     4.61084     91.8529     
1 1 1 20 11 71 o 8  36.564  6.83015 24.0226     13.9576  33.001      11.9268  21.8842    308.462     3.94149     308.462     
1 1 1 20 11 72 o 9  22.4021 6.41139 -2.50194    13.5112  11.4058     10.5082  5.59755    217.434     5.90459     37.4342     
1 1 1 20 11 73 o 14 28.0326 6.71177 20.9033     11.9642  11.1452     10.8589  13.6855    347.92      3.49724     347.92      
1 1 1 20 11 74 o 5  32.5651 6.91592 25.8236     12.7285  19.9209     11.7242  20.4764    78.921      11.0741     78.921      
1 1 1 20 11 75 o 15 23.2364 6.65788 7.64111     12.0424  8.1298      12.081   3.98327    335.587     1.08422     335.587     
1 1 1 20 11 76 f 0  21.0088 6.34954 3.01002     11.8401  4.42653     11.8765  6.11519    273.538     0           0           
1 1 1 20 11 77 o 3  28.8689 7.19033 22.4185     13.1437  14.3835     13.0596  11.9525    42.9607     5.89918     222.961     
1 1 1 20 11 78 o 7  27.1244 6.86489 2.86281     13.0208  26.3587     13.2385  7.04772    129.979     13.7912     309.979     
1 1 1 20 11 79 o 1  21.7167 6.59957 12.4709     12.7457  -9.90746    15.7779  3.21258    317.681     5.70511     137.681     
1 1 1 20 11 80 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 12 0  o 1  82.7843 2.93432 122.408     12.1034  122.408     12.1034  45.4109    180         19.2469     8.64512e-06 
1 1 1 20 12 1  o 3  119.355 2.84373 258.951     16.8951  247.044     17.0634  27.7306    149.039     110.709     329.039     
1 1 1 20 12 2  o 5  60.0976 3.14549 69.4112     9.35096  59.6317     9.41152  4.20429    203.48      5.14575     23.4802     
1 1 1 20 12 3  o 19 251.867 3.29601 1142.51     40.4403  1108.86     42.6933  162.363    35.3002     40.2206     215.3       
1 1 1 20 12 4  o 1  363.245 4.0303  2396.57     77.0202  2290.03     69.6662  296.767    307.061     63.4635     307.061     
1 1 1 20 12 5  o 13 76.5916 2.57605 101.387     9.78468  107.189     9.93176  10.2332    236.465     75.1079     56.4652     
1 1 1 20 12 6  o 5  114.857 2.56393 228.719     14.9929  239.71      14.4621  52.4444    167.986     50.8875     347.986     
1 1 1 20 12 7  o 3  357.252 3.69986 2285.66     64.7474  2245.67     67.6704  260.291    197.429     0.785484    17.4293     
1 1 1 20 12 8  o 6  56.2498 3.00159 61.4775     7.89155  51.6408     8.74786  0.162175   150.001     51.2637     150         
1 1 1 20 12 9  o 10 469.915 4.64656 3941.83     109.421  3906.93     109.425  354.912    7.07172     21.9081     7.07172     
1 1 1 20 12 10 o 3  203.465 2.77631 735.837     26.3552  732.743     30.1276  134.686    286.262     21.3467     106.262     
1 1 1 20 12 11 o 4  85.0471 2.73892 126.179     11.1836  130.958     12.0978  31.1761    314.264     177.915     314.264     
1 1 1 20 12 12 f 0  175.682 2.86689 554.244     23.8216  540.796     26.5488  139.727    249.166     0           0           
1 1 1 20 12 13 o 9  403.138 4.23895 2871.74     83.5405  2902.54     87.7073  276.863    217.456     34.1689     37.4559     
1 1 1 20 12 14 o 5  26.1702 5.02427 7.77073     6.62232  17.41       7.33702  41.6235    107.093     97.5845     107.093     
1 1 1 20 12 15 o 5  237.736 3.00515 1006.72     34.147   998.798     37.373   184.371    301.034     28.6338     301.034     
1 1 1 20 12 16 o 5  119.102 2.69816 244.483     15.371   259.368     16.7963  94.8738    10.3584     44.1594     10.3584     
1 1 1 20 12 17 o 5  56.5335 3.1181  59.0576     8.77878  55.0883     8.74198  5.4979     96.087      21.4122     276.087     
1 1 1 20 12 18 o 9  239.89  2.96116 994.844     34.8565  1047.55     36.346   172.723    12.6917     2.26703     12.6917     
1 1 1 20 12 19 o 19 112.177 2.64205 217.653     14.1494  229.327     15.511   45.808     240.463     59.4858     60.4635     
1 1 1 20 12 20 f 0  235.577 2.98682 989.05      35.3213  980.375     35.2019  160.343    331.831     0           0           
1 1 1 20 12 21 o 6  189.555 2.75227 639.25      24.4201  635.599     27.7533  90.2839    4.69582     88.5752     184.696     
1 1 1 20 12 22 o 4  342.929 3.57345 2085.96     58.8139  2090.21     63.9086  208.927    67.7543     77.1244     247.754     
1 1 1 20 12 23 o 1  191.387 2.68002 644.94      24.6764  654.647     26.7067  123.235    24.2193     23.3866     204.219     
1 1 1 20 12 24 o 1  180.444 2.60608 567.501     22.6297  587.743     24.4932  128.871    196.298     5.5578      196.298     
1 1 1 20 12 25 o 12 236.805 2.86545 997.36      32.5859  992.675     35.3606  183.056    282.002     30.366      282.002     
1 1 1 20 12 26 o 14 156.104 2.55701 435.387     19.1731  429.186     20.7889  91.4887    239.744     33.8466     59.7436     
1 1 1 20 12 27 o 4  169.19  2.66822 515.678     22.9417  500.121     22.3063  150.136    151.883     69.8164     151.883     
1 1 1 20 12 28 o 12 73.9365 2.88836 92.5758     10.1912  102.167     11.1361  14.9056    305.411     61.4153     125.411     
1 1 1 20 12 29 o 2  223.627 2.84643 867.864     31.7348  907.476     32.0589  195.124    46.3175     76.5188     46.3175     
1 1 1 20 12 30 o 16 188.339 2.53567 629.723     23.7571  629.029     24.1069  140.869    149.051     18.5028     149.051     
1 1 1 20 12 31 o 19 72.0319 2.84236 93.9307     10.1445  90.8649     10.2896  16.268     22.7924     58.1728     202.792     
1 1 1 20 12 32 o 7  47.0245 3.69638 43.1887     8.15581  36.5434     8.82927  5.7564     91.9016     13.733      271.902     
1 1 1 20 12 33 o 12 178.951 2.58547 550.851     23.3974  586.215     22.9421  119.633    328.823     11.3201     148.823     
1 1 1 20 12 34 o 8  113.626 2.47631 228.992     13.8514  229.743     14.3134  63.939     321.566     26.9813     141.566     
1 1 1 20 12 35 o 9  169.292 2.52786 500.856     21.2314  516.772     21.6617  137.926    117.673     41.1263     117.673     
1 1 1 20 12 36 f 0  230.18  2.87421 944.165     33.6136  938.478     32.692   142.664    205.862     0           0           
1 1 1 20 12 37 o 5  211.529 2.66094 800.608     26.8984  789.007     29.4393  173.59     59.6108     51.5907     59.6108     
1 1 1 20 12 38 o 18 146.366 2.47993 377.204     17.633   383.745     18.7392  72.9963    158.859     57.0419     338.859     
1 1 1 20 12 39 o 1  69.7399 3.03097 91.5209     9.84108  82.2491     11.1059  37.5368    188.39      11.1891     8.38951     
1 1 1 20 12 40 o 7  162.475 2.49784 474.888     19.7318  463.201     20.9101  98.7012    276.739     27.783      96.7387     
1 1 1 20 12 41 o 12 112.606 2.52751 239.915     13.7219  211.7       14.6507  60.8902    75.5945     31.3164     255.595     
1 1 1 20 12 42 o 6  37.2069 4.4576  27.3959     7.75542  23.5625     8.21471  0.370813   118.614     0.507634    298.614     
1 1 1 20 12 43 o 1  57.5597 3.30107 59.4656     9.19341  59.4371     9.6802   18.575     96.1061     34.4573     276.106     
1 1 1 20 12 44 o 11 97.7895 2.87263 162.072     13.9022  179.36      14.1768  53.1309    168.182     24.7464     348.182     
1 1 1 20 12 45 o 18 129.645 2.52692 309.793     16.1733  289.06      16.5975  100.532    335.24      26.0404     335.24      
1 1 1 20 12 46 o 2  70.395  2.94391 87.8719     10.1007  89.4688     10.5756  31.3462    338.682     27.8055     158.682     
1 1 1 20 12 47 o 9  169.186 2.59652 498.981     22.0247  520.862     21.9969  148.281    318.293     66.5756     318.293     
1 1 1 20 12 48 o 2  104.196 2.64743 201.222     13.7965  186.414     13.7913  82.2538    144.749     26.344      144.749     
1 1 1 20 12 49 o 17 37.675  5.01476 20.0747     8.56047  33.7237     9.66764  11.2811    139.01      18.6831     319.01      
1 1 1 20 12 50 o 4  192.078 2.89331 640.564     27.054   677.835     28.6525  168.475    356.943     74.6132     356.943     
1 1 1 20 12 51 o 19 60.5218 3.55189 65.16       10.5121  67.2632     10.8403  37.9558    57.0101     2.38941     237.01      
1 1 1 20 12 52 o 13 19.3984 5.27696 8.00504     7.10839  -0.983788   8.26139  2.78409    100.925     18.2269     100.925     
1 1 1 20 12 53 o 8  41.742  4.98719 42.9549     8.62114  23.4309     10.5379  14.8424    2.15441     22.199      182.154     
1 1 1 20 12 54 f 0  51.1503 3.75716 45.5995     9.31764  49.914      9.66057  21.8447    297.921     0           0           
1 1 1 20 12 55 o 15 52.1718 3.9926  47.6658     10.4243  52.1789     10.0762  29.6852    94.9932     6.88113     274.993     
1 1 1 20 12 56 o 14 50.8327 3.84269 48.3069     9.57553  46.3765     9.69168  7.92905    35.2464     50.2433     215.246     
1 1 1 20 12 57 o 2  39.8526 4.71567 27.903      9.0502   31.8944     9.09849  9.4892     231.523     30.9277     51.5229     
1 1 1 20 12 58 o 13 44.9868 4.18265 43.2327     8.59742  32.1582     9.4263   17.3326    184.806     22.116      4.80633     
1 1 1 20 12 59 o 5  59.1547 3.65944 65.5607     10.8516  62.326      10.6259  37.9342    272.458     0.214721    272.458     
1 1 1 20 12 60 o 2  15.6338 4.83462 2.12143     7.23245  -6.77917    7.7685   19.6036    271.215     55.9845     271.215     
1 1 1 20 12 61 o 2  39.1649 5.02927 28.5978     9.54352  30.0215     9.46804  19.1128    282.511     9.56572     102.511     
1 1 1 20 12 62 o 2  37.4691 4.94262 23.5342     8.84044  30.4909     9.00656  14.0503    244.955     18.1863     64.9548     
1 1 1 20 12 63 o 12 69.1463 3.24643 87.2173     11.381   87.1951     10.9866  48.8922    236.018     8.67137     236.018     
1 1 1 20 12 64 o 12 67.4717 3.73293 69.7067     12.6664  99.6391     11.8267  39.643     247.632     7.70562     67.6319     
1 1 1 20 12 65 o 13 67.6811 3.85194 81.1007     13.7481  89.1188     11.951   45.9207    191.613     5.11741     191.613     
1 1 1 20 12 66 o 9  27.7476 6.29514 20.5297     11.4836  10.8165     8.50388  14.5542    296.224     3.57248     296.224     
1 1 1 20 12 67 o 12 67.9163 3.93552 98.852      15.3295  74.8196     11.2755  51.306     268.327     16.6879     268.327     
1 1 1 20 12 68 o 5  41.9886 5.96673 36.6893     14.0785  35.0782     10.0269  21.2411    297.474     8.57579     117.474     
1 1 1 20 12 69 o 10 66.6847 3.96679 81.4407     14.3088  85.8627     11.6816  39.0361    171.478     6.01922     351.478     
1 1 1 20 12 70 o 2  39.3478 6.31232 31.7668     11.8052  32.9561     12.5163  22.3445    281.997     0.834506    101.997     
1 1 1 20 12 71 o 2  65.1028 4.49745 84.6366     14.0472  77.9764     14.8386  34.5493    170.977     12.367      350.977     
1 1 1 20 12 72 o 10 51.6617 5.32049 48.2752     13.0487  57.7429     13.6464  38.3694    141.83      14.5625     141.83      
1 1 1 20 12 73 o 4  28.313  7.25279 14.3833     12.2106  18.4336     14.2743  13.7524    194.132     1.96279     14.1317     
1 1 1 20 12 74 o 11 22.2488 6.71308 5.76587     11.6734  2.98576     14.9257  6.7721     359.41      0.33795     179.41      
1 1 1 20 12 75 o 13 23.2753 6.91337 5.67256     12.1497  8.6349      15.0812  8.04205    307.41      5.20597     127.41      
1 1 1 20 12 76 f 0  24.1047 6.99563 14.5349     12.8407  0.825374    15.7507  11.3347    337.69      0           0           
1 1 1 20 12 77 o 2  22.5759 6.83657 9.14375     12.6674  2.32866     15.4697  5.1092     233.952     4.14989     53.9525     
1 1 1 20 12 78 o 16 30.6889 7.37852 21.4796     13.3856  24.3493     13.7573  13.106     345.103     3.29403     345.103     
1 1 1 20 12 79 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 13 0  o 1  38.8108 4.05615 28.4094     7.38379  28.4094     7.38379  11.9933    360         41.8817     360         
1 1 1 20 13 1  o 13 309.735 3.38484 1686.85     53.6486  1718.62     51.3819  265.326    250.322     80.0658     250.322     
1 1 1 20 13 2  o 4  63.9737 2.97436 70.7526     9.46286  75.1239     9.49696  2.78481    324.116     80.3215     324.116     
1 1 1 20 13 3  o 5  227.839 2.94171 929.18      33.6047  912.746     33.5701  168.677    95.6293     9.07946     95.6293     
1 1 1 20 13 4  o 6  326.533 3.75096 1901.51     61.3697  1884.83     61.39    278.112    167.065     80.5428     167.065     
1 1 1 20 13 5  o 6  89.7904 2.6579  145.67      11.9366  140.851     11.9279  52.3056    343.759     14.8051     343.759     
1 1 1 20 13 6  o 8  62.7737 2.99728 65.7916     9.40446  74.817      9.3043   3.98828    293.582     80.6623     293.582     
1 1 1 20 13 7  o 5  259.487 3.15565 1201.97     41.0307  1187.71     41.0401  172.096    287.891     32.342      107.891     
1 1 1 20 13 8  o 4  185.873 2.7403  621.328     25.5229  604.415     25.5245  114.588    189.78      36.2204     9.7796      
1 1 1 20 13 9  o 7  97.1155 2.53844 164.474     12.2551  170.555     12.4101  36.4398    83.4659     55.0825     263.466     
1 1 1 20 13 10 o 19 70.1313 2.73852 91.776      9.42106  83.3486     9.71863  23.0695    350.88      9.02706     170.88      
1 1 1 20 13 11 o 3  214.266 2.75079 832.515     29.5014  796.483     29.561   124.875    13.8456     58.7297     193.846     
1 1 1 20 13 12 o 12 288.058 3.23805 1502.89     47.7323  1442.71     45.7602  182.873    134.741     52.8047     314.741     
1 1 1 20 13 13 f 0  138.186 2.56542 343.099     17.286   334.772     18.1898  77.807     309.313     0           0           
1 1 1 20 13 14 o 9  183.413 2.61109 600.574     23.9533  592.839     24.0455  104.182    154.847     52.9577     334.847     
1 1 1 20 13 15 o 14 305.953 3.36629 1663.01     50.4361  1660.25     52.7635  254.48     105.857     66.3975     105.857     
1 1 1 20 13 16 o 19 149.217 2.67636 378.103     18.5394  412.495     21.4601  101.946    180.189     2.5213      0.188865    
1 1 1 20 13 17 o 12 167.668 2.70587 507.701     21.5339  489.799     23.8331  110.899    39.7102     13.7109     219.71      
1 1 1 20 13 18 o 16 220.396 2.91699 864.859     30.6547  858.923     33.6981  134        231.559     47.975      51.5594     
1 1 1 20 13 19 o 7  245.294 3.08612 1068.81     36.2018  1066.86     39.5922  187.437    91.402      23.4118     91.402      
1 1 1 20 13 20 o 9  179.371 2.94339 586.686     23.0308  555.76      29.2946  117.009    205.833     19.264      25.8334     
1 1 1 20 13 21 o 13 321.138 3.61997 1823.09     56.9126  1840.06     59.5845  247.544    213.571     31.6214     213.571     
1 1 1 20 13 22 o 11 186.074 2.72056 605.788     23.7368  622.881     26.9407  102.231    201.888     59.75       21.8875     
1 1 1 20 13 23 o 7  274.318 3.0961  1335.31     40.8189  1336.13     44.2385  211.602    121.08      29.8256     121.08      
1 1 1 20 13 24 o 6  226.736 2.84986 901.156     30.4144  923.561     34.2776  168.829    318.641     14.9937     318.641     
1 1 1 20 13 25 o 2  223.597 2.74529 898.164     28.8779  876.285     32.4909  191.752    182.778     67.2952     182.778     
1 1 1 20 13 26 o 10 82.2101 2.67348 125.92      10.2838  114.581     11.5659  30.9858    189.973     42.6021     9.97268     
1 1 1 20 13 27 o 13 333.148 3.53745 1967.04     57.7337  1977.04     60.3616  249.82     291.135     21.1596     291.135     
1 1 1 20 13 28 o 7  24.4917 5.68499 8.61791     6.87235  12.093      9.25575  17.1767    237.29      43.2483     237.29      
1 1 1 20 13 29 o 16 263.648 3.05338 1263.91     36.7954  1205.43     43.4386  196.229    203.928     16.2435     203.928     
1 1 1 20 13 30 o 19 183.289 2.80672 591.874     22.8984  601.122     28.4074  115.464    281.296     28.101      101.296     
1 1 1 20 13 31 o 2  110.186 2.52922 220.606     13.1535  210.905     14.6601  32.1511    168.941     88.5959     348.941     
1 1 1 20 13 32 o 15 152.673 2.71548 433.618     19.3294  394.948     21.9565  90.9846    29.195      32.0043     209.195     
1 1 1 20 13 33 o 16 209.852 2.74504 780.474     27.6093  783.894     30.0796  168.583    233.116     41.2048     233.116     
1 1 1 20 13 34 o 11 165.273 2.58152 499.64      20.3784  470.78      22.2713  130.296    11.341      30.2042     11.341      
1 1 1 20 13 35 o 2  116.541 2.63023 250.544     15.1136  232.639     15.5349  108.518    251.841     64.7755     251.841     
1 1 1 20 13 36 o 8  37.5563 5.00057 31.9169     8.01152  20.5057     9.78532  1.6873     288.655     6.27701     108.655     
1 1 1 20 13 37 o 14 152.008 2.63143 397.543     20.5719  424.178     19.4302  109.654    285.223     8.44523     285.223     
1 1 1 20 13 38 o 19 283.841 3.04575 1397.42     43.0706  1470.29     43.5678  226.853    351.874     53.589      351.874     
1 1 1 20 13 39 o 19 70.4807 3.05017 90.5094     10.178   87.0143     11.2136  30.7281    86.7497     29.8209     266.75      
1 1 1 20 13 40 o 1  40.5639 4.28531 30.2929     8.38835  29.8538     8.49907  6.99572    359.282     26.0128     179.282     
1 1 1 20 13 41 o 14 110.181 2.51189 211.197     13.5559  221.103     14.1491  71.573     257.745     6.47702     77.7449     
1 1 1 20 13 42 o 13 58.3428 3.22947 63.5899     9.08999  58.6217     9.60013  31.6364    145.049     16.7349     145.049     
1 1 1 20 13 43 o 7  113.309 2.76641 235.153     15.7551  222.87      15.6102  82.7204    293.094     12.5899     293.094     
1 1 1 20 13 44 o 5  219.87  2.87693 856.773     30.8998  867.012     32.488   185.727    318.674     66.9802     318.674     
1 1 1 20 13 45 o 5  108.765 2.67253 208.949     14.4209  213.155     14.6692  66.2822    158.864     14.4181     338.864     
1 1 1 20 13 46 o 2  19.9    5.31186 5.6359      7.30055  5.014       7.17299  10.2591    251.087     31.1214     251.087     
1 1 1 20 13 47 o 12 44.8466 4.03337 34.9747     8.94663  38.5023     8.73831  14.186     271.92      26.5138     91.9199     
1 1 1 20 13 48 o 18 29.0799 5.18803 17.4349     7.46402  14.4819     7.69464  0.113435   185.28      32.0448     5.28038     
1 1 1 20 13 49 o 12 88.3671 2.68099 136.431     12.0631  142.941     11.6061  53.8593    263.277     11.6181     83.2772     
1 1 1 20 13 50 o 8  143.151 2.57244 357.832     17.9931  374.489     18.8882  116.699    269.167     38.2353     269.167     
1 1 1 20 13 51 o 17 110.619 2.72235 206.413     15.5913  232.134     14.4087  74.1858    280.886     1.48454     100.886     
1 1 1 20 13 52 o 13 40.8703 4.56545 27.9916     8.5333   34.3912     9.55462  6.87404    109.472     38.3313     289.472     
1 1 1 20 13 53 o 6  79.4859 2.99398 105.666     11.5276  122.087     12.2318  65.8103    174.031     27.14       174.031     
1 1 1 20 13 54 o 16 98.4867 3.02696 158.029     14.3889  192.08      15.3921  76.0114    184.791     20.5107     184.791     
1 1 1 20 13 55 o 9  77.4844 3.3096  104.034     11.9992  113.401     13.5837  39.0091    214.881     25.0057     34.8813     
1 1 1 20 13 56 o 3  39.1192 5.13291 29.7154     9.00292  28.5332     10.3334  21.1507    249.902     4.50532     69.9019     
1 1 1 20 13 57 o 18 23.6794 6.03642 3.13092     8.04479  15.2802     10.8435  2.7479     57.3766     18.0665     237.377     
1 1 1 20 13 58 o 2  63.4969 3.97123 69.687      12.7115  78.566      12.2186  49.1335    107.555     16.9529     107.555     
1 1 1 20 13 59 o 15 58.1824 4.03663 60.2895     12.274   64.6132     10.827   47.2225    113.396     21.1346     113.396     
1 1 1 20 13 60 o 10 36.5683 5.21605 29.8275     10.0076  22.0987     8.4879   21.6499    173.934     0.0428578   173.933     
1 1 1 20 13 61 o 4  22.4557 5.62345 1.51602     9.25111  13.1153     7.95384  6.78263    108.937     0.976776    288.937     
1 1 1 20 13 62 o 16 39.9312 5.2969  26.6498     10.9252  35.5598     9.25248  21.569     75.5956     6.24629     255.596     
1 1 1 20 13 63 o 13 28.2769 5.86109 11.0145     9.70457  20.1905     8.6598   13.8747    60.7881     3.32736     240.788     
1 1 1 20 13 64 o 14 42.8398 5.0343  33.2941     10.7203  38.1341     10.0456  14.9269    108.463     24.3178     288.463     
1 1 1 20 13 65 o 11 78.9405 3.44455 113.813     13.8769  116.202     13.2252  52.1476    22.8288     2.22176     22.8288     
1 1 1 20 13 66 o 15 106.618 3.07984 209.495     17.6147  206.898     15.1357  88.9641    82.8148     39.9993     82.8148     
1 1 1 20 13 67 o 8  83.6323 3.57629 138.573     15.4417  121.494     14.3974  49.5277    32.9032     8.53663     212.903     
1 1 1 20 13 68 o 7  27.748  6.53384 15.3649     11.1412  16.0911     10.1689  6.95967    73.2937     17.1429     253.294     
1 1 1 20 13 69 o 17 36.5937 6.23654 29.3151     11.7144  26.8305     10.8927  19.8691    336.993     2.07803     156.993     
1 1 1 20 13 70 o 7  54.4081 5.5097  52.321      13.1652  66.462      16.0693  36.3661    113.515     5.82598     113.515     
1 1 1 20 13 71 o 12 27.913  6.93888 9.40339     11.4956  22.0804     13.1459  5.35111    0.0588045   21.4159     180.059     
1 1 1 20 13 72 o 19 19.2317 6.00309 2.22193     11.5951  -2.80279    11.1516  2.67885    337.138     12.6573     157.138     
1 1 1 20 13 73 o 16 29.0577 6.95616 14.3078     12.2828  21.7722     12.1643  14.2665    25.4137     2.57759     205.414     
1 1 1 20 13 74 o 4  16.4872 5.47248 -9.57891    12.1159  -6.44801    10.8696  1.21292    194.669     7.30569     14.6691     
1 1 1 20 13 75 o 18 22.6431 6.74765 7.26663     12.1698  6.57611     14.0119  4.44099    35.219      0.454365    215.219     
1 1 1 20 13 76 o 3  30.3212 7.7866  16.2257     15.8106  28.1579     15.506   14.2003    204.119     2.74502     204.119     
1 1 1 20 13 77 o 4  25.8534 7.25166 16.5646     13.3151  11.4807     15.046   6.22457    168.864     0.597934    348.864     
1 1 1 20 13 78 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 14 0  o 1  727.999 6.45458 9426.82     235.4    9426.82     235.4    543.148    3.943e-06   8.46057     3.94301e-06 
1 1 1 20 14 1  o 6  116.97  2.49351 240.309     14.6029  245.472     14.5954  61.906     218.57      35.5297     38.5697     
1 1 1 20 14 2  o 3  150.706 2.59874 400.901     20.05    405.085     19.1725  126.457    132.197     46.6462     132.197     
1 1 1 20 14 3  o 15 208.29  2.74204 781.065     28.6132  758.309     28.6261  216.78     241.51      143.356     241.51      
1 1 1 20 14 4  o 1  310.255 3.46985 1719.39     53.9516  1698.44     53.9467  213.125    349.855     27.5076     169.855     
1 1 1 20 14 5  o 12 196.529 2.75682 683.003     27.7065  687.4       26.5811  146.157    167.032     11.2288     167.032     
1 1 1 20 14 6  o 12 277.544 3.19369 1378.83     45.3811  1355.52     43.4531  190.964    34.3155     22.524      214.315     
1 1 1 20 14 7  o 3  106.237 2.61042 210.865     13.8542  190.277     13.8702  39.4265    223.471     65.4532     43.4707     
1 1 1 20 14 8  o 19 220.759 2.91709 858.593     32.2487  870.867     32.295   175.7      36.1349     34.2945     36.135      
1 1 1 20 14 9  o 18 108.893 2.66468 211.945     14.197   209.257     14.8304  54.8127    186.86      36.5486     6.86041     
1 1 1 20 14 10 o 6  134.796 2.6081  328.48      17.6085  316.676     17.5906  74.8844    253.925     37.6875     73.9251     
1 1 1 20 14 11 o 2  321.117 3.54906 1834.77     57.1066  1827.17     57.1197  243.096    156.383     17.9447     156.383     
1 1 1 20 14 12 o 8  111.547 2.5692  221.227     13.9959  220.663     14.6805  37.6511    351.591     78.1196     171.591     
1 1 1 20 14 13 o 12 322.21  3.47375 1845.38     54.8317  1841.33     57.3209  258.293    132.142     47.6044     132.142     
1 1 1 20 14 14 o 15 346.376 3.5951  2132.04     59.7379  2129.16     64.9581  299.699    343.273     95.2864     343.273     
1 1 1 20 14 15 o 14 211.882 2.76687 814.832     29.3377  778.433     29.4081  145.89     228.464     12.3765     48.4635     
1 1 1 20 14 16 o 4  113.368 2.62072 224.088     14.8856  232.44      14.8482  91.9578    171.181     58.2357     171.181     
1 1 1 20 14 17 o 4  158.347 2.6741  462.101     21.1378  427.933     21.2736  121.504    318.968     22.3557     318.968     
1 1 1 20 14 18 o 8  140.343 2.50674 347.454     17.5095  351.786     17.723   77.7303    22.3799     40.6916     202.38      
1 1 1 20 14 19 o 14 69.359  2.88261 86.0583     9.82903  85.2775     10.118   28.0876    333.884     10.7477     153.884     
1 1 1 20 14 20 o 4  202.345 2.85988 722.867     27.5527  730.412     30.3919  120.795    58.9183     48.1969     238.918     
1 1 1 20 14 21 o 3  285.642 3.35589 1465.3      49.1426  1432.87     46.9291  201.367    307.153     10.0237     127.152     
1 1 1 20 14 22 o 9  248.658 3.1505  1095.53     38.2416  1100.23     40.2552  206.947    80.4828     57.4245     80.4828     
1 1 1 20 14 23 o 1  51.8118 3.63236 49.2706     9.10728  47.0811     9.48823  8.13268    348.915     25.0418     168.915     
1 1 1 20 14 24 o 19 49.0398 3.74753 38.7411     8.61064  48.0018     9.50782  6.31831    147.317     24.3657     327.317     
1 1 1 20 14 25 o 18 107.039 2.60358 198.968     13.7313  208.261     14.1604  56.6311    51.7748     32.7597     231.775     
1 1 1 20 14 26 o 1  172.521 2.69512 524.811     23.264   531.922     23.3384  101.283    21.2206     42.6251     201.221     
1 1 1 20 14 27 o 1  215.715 2.95556 848.239     28.829   804.942     34.6359  200.757    126.441     95.4705     126.441     
1 1 1 20 14 28 o 18 151.543 2.64967 408.654     19.3619  407.069     20.8352  106.879    106.031     0.617235    106.031     
1 1 1 20 14 29 o 3  136.604 2.53459 341.218     15.9013  321.758     18.5831  87.7849    31.0419     15.6022     211.042     
1 1 1 20 14 30 o 17 141.882 2.59056 363.374     17.6769  351.866     19.0892  100.875    196.325     3.4825      196.325     
1 1 1 20 14 31 o 7  56.1253 3.49634 58.731      8.9026   54.2796     10.4158  15.667     52.9831     36.2406     232.983     
1 1 1 20 14 32 o 18 31.9594 5.25069 15.263      7.6208   23.0604     8.96514  8.48683    307.346     40.9341     307.346     
1 1 1 20 14 33 o 2  243.617 2.91694 1064.44     34.1432  1045.83     36.9952  205.121    45.8684     64.3882     45.8684     
1 1 1 20 14 34 o 6  198.919 2.72109 715.758     25.9597  690.945     28.1986  136.073    215.065     9.24847     35.0653     
1 1 1 20 14 35 o 17 256.576 3.01348 1175.09     35.3802  1167.42     41.8209  214.122    356.178     64.5999     356.178     
1 1 1 20 14 36 o 5  206.407 2.72429 748.283     26.4569  767.008     29.8387  162.365    232.61      33.8644     232.61      
1 1 1 20 14 37 o 2  37.8128 4.60717 23.6232     7.76322  29.1706     9.08705  5.7472     218.092     10.6433     38.0919     
1 1 1 20 14 38 o 19 76.0671 3.03097 105.156     10.7301  101.623     12.2048  52.5646    212.696     7.76034     212.696     
1 1 1 20 14 39 o 5  187.997 2.80982 646.319     24.3515  612.455     28.3187  159.994    73.4026     57.4896     73.4026     
1 1 1 20 14 40 o 13 161.32  2.76924 477.775     20.2375  449.713     24.1954  110.246    132.837     4.15764     312.837     
1 1 1 20 14 41 o 15 62.0034 3.47731 76.6267     9.84618  62.0192     11.2637  39.9981    309.833     7.08863     309.833     
1 1 1 20 14 42 o 19 55.0512 3.68168 51.8897     9.23335  57.6431     10.8369  28.3174    181.679     7.74925     1.67938     
1 1 1 20 14 43 o 7  77.9077 2.99777 110.739     11.555   106.569     11.7566  64.5721    139.978     32.8462     139.978     
1 1 1 20 14 44 o 6  42.8701 4.11826 34.8329     8.27435  32.4244     8.90936  19.3386    230.534     4.3417      50.5336     
1 1 1 20 14 45 o 9  19.259  5.11882 1.35841     6.9392   7.79638     6.9118   8.03988    304.28      27.2698     304.28      
1 1 1 20 14 46 o 11 151.6   2.43354 417.47      18.6196  401.84      18.3561  112.831    105.18      16.1918     105.18      
1 1 1 20 14 47 f 0  37.2221 4.53671 22.9626     8.12079  28.6957     8.14287  27.8901    103.777     0           0           
1 1 1 20 14 48 f 0  40.8145 4.15954 35.5923     8.10222  26.1396     8.2261   37.0906    222.278     0           0           
1 1 1 20 14 49 o 13 92.9303 2.686   159.467     12.081   149.935     12.8384  72.2167    91.5738     19.0005     91.5738     
1 1 1 20 14 50 o 10 32.9404 5.14305 17.8298     7.79644  23.6325     8.76518  8.15579    308.848     3.65495     308.848     
1 1 1 20 14 51 o 1  32.0183 4.9362  32.8394     8.21421  7.13195     8.36221  9.59757    58.3485     18.1908     238.349     
1 1 1 20 14 52 o 12 26.3495 5.58861 13.4208     7.78791  12.778      8.15022  12.3036    109.639     56.8419     109.639     
1 1 1 20 14 53 o 1  50.9691 3.76494 54.1186     9.30081  41.4405     9.45883  23.0076    66.3109     20.2355     246.311     
1 1 1 20 14 54 o 6  54.1636 3.99819 58.7011     10.228   49.3664     10.9793  33.3108    318.955     3.26953     138.955     
1 1 1 20 14 55 o 1  47.2141 4.28512 40.7725     9.63303  42.0053     10.1761  24.9252    47.7608     10.3049     227.761     
1 1 1 20 14 56 o 11 98.352  2.88106 163.592     14.3177  185.385     13.9502  67.3378    46.8686     3.20164     46.8685     
1 1 1 20 14 57 o 16 73.7691 3.32205 93.1053     12.3524  104.822     12.0219  63.2373    0.781736    30.4685     0.781736    
1 1 1 20 14 58 o 5  51.3744 4.59323 47.9421     11.1334  51.0358     11.9919  38.7235    322.307     12.787      322.307     
1 1 1 20 14 59 o 10 18.1327 5.15177 9.51507     8.42127  -11.409     8.35057  1.75053    33.4274     9.97133     213.427     
1 1 1 20 14 60 o 12 25.7631 6.20739 14.4147     10.0468  10.377      9.20859  9.46194    242.012     9.19019     62.0119     
1 1 1 20 14 61 o 1  26.5503 6.2559  18.713      9.83786  6.73151     10.8336  12.2732    38.564      3.38461     218.564     
1 1 1 20 14 62 o 13 93.4208 3.09221 138.009     13.6762  182.057     15.1521  71.9571    355.851     21.2278     355.851     
1 1 1 20 14 63 o 3  34.8616 5.62102 31.7367     9.34112  17.4394     10.2174  25.2546    357.104     13.8289     357.104     
1 1 1 20 14 64 o 9  48.4302 4.80443 43.3623     10.08    47.5219     12.5276  25.7404    292.884     9.89668     112.884     
1 1 1 20 14 65 o 7  51.0057 4.90824 50.315      12.8087  50.9296     11.57    20.0809    199.743     24.8983     19.7425     
1 1 1 20 14 66 f 0  67.8871 4.37109 89.917      14.102   85.7621     15.2377  35.68      261.799     0           0           
1 1 1 20 14 67 f 0  52.2667 4.78025 53.3178     13.0373  52.9777     11.3266  37.6838    203.393     0           0           
1 1 1 20 14 68 o 16 37.7436 6.01971 41.484      12.3514  19.2363     10.363   11.9735    286.283     21.8869     106.283     
1 1 1 20 14 69 o 19 38.4673 6.11275 39.9284     12.1967  22.575      11.0772  18.9148    183.582     8.34802     3.58225     
1 1 1 20 14 70 o 14 58.4519 5.09341 72.4184     13.7639  62.0411     15.1272  44.7157    276.156     16.8508     276.156     
1 1 1 20 14 71 o 3  34.7734 6.9593  18.4031     13.1071  34.7891     13.1848  21.3891    201.712     3.40407     201.712     
1 1 1 20 14 72 o 19 18.4671 5.85777 -12.4701    11.5762  4.83483     11.9038  3.27319    180.323     8.08948     0.323066    
1 1 1 20 14 73 o 15 17.9432 5.81934 -3.47281    11.6635  -4.43615    12.083   1.17682    354.457     12.7282     174.457     
1 1 1 20 14 74 o 6  23.566  6.84381 11.2159     12.7942  7.23021     13.2385  7.10975    249.502     1.88706     69.5018     
1 1 1 20 14 75 o 14 18.3972 5.91509 -8.95032    11.9192  3.43869     12.3694  1.03717    147.151     6.0535      327.151     
1 1 1 20 14 76 x 18 ?       ?       ?           ?        ?           ?        5.46198    245.889     0           0           
1 1 1 20 14 77 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 15 0  o 15 285.456 3.18372 1446.15     45.5187  1446.15     45.5187  213.959    180         4.57306     180         
1 1 1 20 15 1  o 3  378.913 3.7979  2563.19     72.1214  2537.75     72.113   340.114    25.827      123.908     25.827      
1 1 1 20 15 2  o 7  150.626 2.55369 416.274     19.2764  388.879     19.2604  73.3738    291.941     67.9398     111.941     
1 1 1 20 15 3  o 11 306.255 3.46891 1683.34     55.6238  1647.59     50.7927  212.344    62.7776     24.2863     242.778     
1 1 1 20 15 4  f 0  251.493 2.94907 1130.64     37.1584  1114.2      37.1762  180.399    207.588     0           0           
1 1 1 20 15 5  o 13 140.177 2.59909 347.096     17.8445  350.547     18.6354  61.3024    36.4414     76.307      216.441     
1 1 1 20 15 6  o 1  154.787 2.67411 427.037     20.7435  423.087     20.7423  110.066    181.934     2.04022     181.934     
1 1 1 20 15 7  o 13 223.148 2.79188 897.113     31.2479  870.076     31.1902  196.465    23.301      72.0246     23.301      
1 1 1 20 15 8  o 13 132.967 2.58173 313.224     17.5581  314.539     16.8061  53.3566    226.145     81.2659     46.1454     
1 1 1 20 15 9  o 3  322.246 3.57645 1838.07     55.0976  1850.58     60.3135  293.133    339.622     116.019     339.622     
1 1 1 20 15 10 o 12 83.8601 2.7098  129.087     11.361   121.05      11.3464  48.351     237.114     0.908964    237.114     
1 1 1 20 15 11 o 2  220.44  2.87936 852.003     32.4863  872.785     31.0955  204.915    251.026     94.4277     251.026     
1 1 1 20 15 12 o 8  56.4166 3.37648 54.4083     9.45043  59.4918     9.44642  3.08828    113.935     53.1546     293.935     
1 1 1 20 15 13 f 0  78.9497 2.9119  109.697     11.4368  112.157     11.5251  84.7101    341.153     0           0           
1 1 1 20 15 14 o 13 60.422  3.63968 65.3304     10.9316  65.3216     10.9006  14.7642    43.0842     29.7349     223.084     
1 1 1 20 15 15 o 12 331.911 3.62798 1966.98     60.3519  1947.57     60.3386  205.403    7.3763      74.523      187.376     
1 1 1 20 15 16 f 0  17.2032 5.04906 -2.91577    7.30965  3.9934      7.40806  31.5356    208.437     0           0           
1 1 1 20 15 17 o 19 102.574 2.68927 201.748     13.3145  172.758     14.1433  19.6073    121.423     103.309     301.423     
1 1 1 20 15 18 o 3  177.811 2.63922 564.572     22.4441  557.598     24.531   133.952    310.807     14.7358     310.807     
1 1 1 20 15 19 o 7  120.29  2.61122 273.948     14.9008  240.648     16.3627  53.5648    161.384     61.3113     341.384     
1 1 1 20 15 20 o 8  117.724 2.59139 257.185     14.5587  235.451     15.8703  61.0639    216.813     41.8321     36.8128     
1 1 1 20 15 21 o 4  80.6705 2.93969 124.878     10.8042  107.194     12.6139  45.0032    137.334     12.559      317.334     
1 1 1 20 15 22 o 6  157.899 2.63522 439.226     21.2761  445.922     20.4123  67.5596    237.79      90.9857     57.7902     
1 1 1 20 15 23 f 0  173.427 2.71186 541.873     23.0068  526.181     24.0989  118.674    13.5927     0           0           
1 1 1 20 15 24 o 6  130.662 2.5973  307.272     16.8999  299.402     17.0758  81.8481    348.36      20.2937     168.36      
1 1 1 20 15 25 o 10 193.106 2.73441 663.378     25.7892  661.051     27.1152  139.508    177.921     2.38988     177.921     
1 1 1 20 15 26 f 0  68.5773 3.39891 85.0494     11.1658  83.0442     12.0188  69.6351    182.269     0           0           
1 1 1 20 15 27 o 13 214.015 2.89227 812.76      30.9445  815.007     31.0958  190.458    270.399     75.3594     270.399     
1 1 1 20 15 28 o 6  84.2103 3.00999 126.469     12.0502  126.295     13.2421  44.8831    22.2498     23.0407     202.25      
1 1 1 20 15 29 o 3  35.0009 5.16003 23.1428     8.4496   22.3084     9.06069  5.41493    37.5181     40.9991     37.5181     
1 1 1 20 15 30 f 0  51.1457 3.96754 54.0692     9.49365  40.7969     10.1886  24.4888    190.739     0           0           
1 1 1 20 15 31 f 0  122.238 2.65513 274.531     16.0605  257.215     16.4042  104.71     207.504     0           0           
1 1 1 20 15 32 o 3  169.425 2.66455 509.998     22.7288  510.536     22.5179  120.105    88.8568     0.453917    88.8568     
1 1 1 20 15 33 o 10 118.041 2.71947 255.049     15.6055  241.128     16.4787  82.6624    182.595     1.90873     182.595     
1 1 1 20 15 34 o 1  245.665 2.9118  1084.09     33.6633  1064.2      37.8655  157.919    74.6375     34.4903     254.637     
1 1 1 20 15 35 o 1  228.71  2.80474 919.283     31.592   942.705     32.7021  201.669    142.369     79.2599     142.369     
1 1 1 20 15 36 o 13 79.6243 3.02884 106.948     11.2845  119.807     12.8076  42.6721    35.3371     21.3254     215.337     
1 1 1 20 15 37 o 14 64.0038 3.38936 74.4396     10.0481  72.6299     11.4639  34.2083    86.1579     12.9366     266.158     
1 1 1 20 15 38 o 5  58.929  3.63625 57.616      10.1579  67.7192     11.1064  37.6997    259.461     9.07065     259.461     
1 1 1 20 15 39 o 6  94.3095 3.03507 173.406     13.0172  145.228     15.2156  59.1935    225.657     9.32025     45.657      
1 1 1 20 15 40 o 11 168.009 2.73848 514.562     21.4033  492.144     24.5027  132.169    81.0416     30.0949     81.0416     
1 1 1 20 15 41 o 14 21.9781 5.41938 8.45676     7.24337  7.31387     7.43747  5.07271    61.5592     18.1655     61.5592     
1 1 1 20 15 42 o 15 118.461 2.66549 262.418     15.7164  238.812     15.8568  94.997     222.776     27.4112     222.776     
1 1 1 20 15 43 f 0  37.8816 4.48518 28.146      8.16609  25.0465     8.24085  27.5694    70.6484     0           0           
1 1 1 20 15 44 o 5  108.079 2.57891 207.999     13.2714  209.23      14.596   66.9879    7.0698      15.4747     187.07      
1 1 1 20 15 45 o 14 120.269 2.58404 258.989     14.789   257.851     16.2831  78.0499    233.708     10.4369     53.7075     
1 1 1 20 15 46 o 11 25.9718 5.40825 9.67999     7.2544   15.5475     7.93833  0.867333   55.3475     26.405      235.348     
1 1 1 20 15 47 o 14 66.2726 3.25616 78.0401     10.2501  80.469      11.2332  54.019     32.7742     21.0838     32.7742     
1 1 1 20 15 48 o 18 37.0201 5.29634 34.2951     9.12718  18.4739     9.80717  21.629     172.896     2.42165     172.896     
1 1 1 20 15 49 o 15 75.6871 3.1554  106.449     11.7919  100.293     12.0213  44.7097    299.936     12.755      119.936     
1 1 1 20 15 50 f 0  85.1434 2.96471 130.313     12.56    130.773     12.6623  52.5641    34.8555     0           0           
1 1 1 20 15 51 o 9  91.2944 2.92723 154.212     13.9308  145.996     12.7832  56.8122    294.019     10.1404     114.019     
1 1 1 20 15 52 f 0  31.8605 5.47312 20.8822     9.07991  18.4177     8.2289   16.8562    246         0           0           
1 1 1 20 15 53 o 8  27.5218 5.60845 20.5153     8.99355  8.56674     7.95836  9.85573    33.8171     8.4676      213.817     
1 1 1 20 15 54 o 4  67.3555 3.38928 80.0528     11.7098  84.9722     10.974   46.8465    191.512     4.7602      191.512     
1 1 1 20 15 55 o 13 77.9134 3.15368 103.072     12.6948  117.135     11.6954  55.9703    191.428     8.32197     191.428     
1 1 1 20 15 56 o 5  45.2553 4.87255 34.8149     9.99309  43.0055     11.4268  29.2208    153.878     1.41489     153.878     
1 1 1 20 15 57 o 4  78.3221 3.39526 108.537     11.8328  115.275     14.6065  61.4147    128.176     19.1325     128.176     
1 1 1 20 15 58 o 6  69.0539 3.59375 83.4852     10.9219  91.7856     13.7138  44.012     125.551     3.26057     305.551     
1 1 1 20 15 59 o 4  73.7875 3.52742 91.9378     11.3446  108.552     14.5779  66.2623    310.377     36.2202     310.377     
1 1 1 20 15 60 o 10 22.5539 6.09986 7.9593      8.14218  7.79156     11.189   7.30059    82.0686     8.02716     262.069     
1 1 1 20 15 61 o 5  45.1432 4.82426 36.0754     9.87284  42.8201     11.2912  19.1227    173.227     19.7816     353.227     
1 1 1 20 15 62 o 8  67.8437 3.65094 77.6001     11.6982  93.9589     12.943   45.7686    162.617     3.14348     162.617     
1 1 1 20 15 63 o 15 60.2016 4.22507 71.0697     12.5073  66.4492     12.6297  50.8941    45.8496     25.4494     45.8496     
1 1 1 20 15 64 o 15 26.4023 6.29789 9.63248     9.22327  18.3305     10.7963  1.56199    162.897     28.0905     342.897     
1 1 1 20 15 65 o 16 21.9916 6.31948 -3.51035    13.2396  11.1369     10.3485  0.852938   172.089     25.7878     172.089     
1 1 1 20 15 66 o 7  30.4517 6.54292 25.4032     11.865   14.2277     10.2094  13.5473    75.3956     6.4659      255.396     
1 1 1 20 15 67 o 9  50.4528 5.17676 51.7202     14.0389  49.147      11.2144  30.268     25.3577     2.42151     205.358     
1 1 1 20 15 68 o 7  25.3172 6.42869 16.5096     11.3923  8.39847     9.55296  10.6646    23.2925     4.31003     203.293     
1 1 1 20 15 69 o 13 20.2899 6.17209 3.08081     11.7392  1.88056     10.921   2.69196    331.892     15.5426     151.892     
1 1 1 20 15 70 o 14 67.58   4.55006 89.6711     15.6506  87.5978     14.7903  53.0155    89.784      21.0062     89.784      
1 1 1 20 15 71 o 6  16.5149 5.4525  -7.5075     11.44    -6.30336    10.8345  1.07467    26.0225     10.4337     206.023     
1 1 1 20 15 72 o 2  27.3354 7.00455 22.5862     12.8164  8.67021     13.0401  12.8161    33.2551     0.870105    213.255     
1 1 1 20 15 73 f 0  23.5111 6.7412  7.87215     12.6873  11.6857     12.1907  9.3143     49.667      0           0           
1 1 1 20 15 74 o 8  24.3938 6.92722 14.4185     12.8214  8.84974     13.2687  6.79026    272.255     2.93544     92.2549     
1 1 1 20 15 75 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 16 0  o 13 201.05  2.7311  717.532     27.4942  717.532     27.4942  168.15     8.73296e-06 37.6093     8.73296e-06 
1 1 1 20 16 1  o 5  280.507 3.27736 1396.32     46.0579  1398.19     46.0842  191.127    258.179     29.5247     78.179      
1 1 1 20 16 2  o 12 217.651 2.84888 837.906     31.7568  843.62      30.3704  177.678    217.892     39.9956     217.892     
1 1 1 20 16 3  o 11 100.074 2.6128  175.427     13.0954  180.467     13.0642  44.4073    337.853     47.5322     157.853     
1 1 1 20 16 4  o 19 58.1262 3.23178 55.7076     9.3031   65.2085     9.32683  1.79549    334.325     63.5083     154.325     
1 1 1 20 16 5  o 4  100.285 2.6785  172.56      13.094   184.983     13.7833  55.3586    253.247     23.9213     73.2466     
1 1 1 20 16 6  o 14 156.509 2.63784 442.779     21.0995  426.607     20.2811  97.8015    75.0177     28.144      255.018     
1 1 1 20 16 7  o 3  303.122 3.37116 1650.36     52.3383  1613.77     50.0778  251.873    167.087     59.4714     167.087     
1 1 1 20 16 8  o 5  69.0279 3.10306 84.2732     10.7417  85.6142     10.6138  31.0996    256.483     10.6283     76.4829     
1 1 1 20 16 9  o 11 54.6645 3.40357 51.525      9.04014  55.4925     9.41796  10.6552    208.371     28.5554     28.3714     
1 1 1 20 16 10 o 8  120.526 2.58376 251.211     15.5618  264.895     15.607   35.4736    326.002     100.233     146.002     
1 1 1 20 16 11 o 9  137.824 2.566   339.449     17.7029  335.179     17.7121  77.4473    292.154     40.9285     112.154     
1 1 1 20 16 12 o 4  165.431 2.62554 484.83      21.7617  486.563     21.7722  119.888    44.8444     3.07844     44.8444     
1 1 1 20 16 13 o 12 126.685 2.60785 282.962     16.8174  287.188     16.2504  114.152    152.448     57.8204     152.448     
1 1 1 20 16 14 o 7  270.817 3.13929 1300.81     43.5042  1304.6      41.6846  170.893    134.116     54.4919     314.116     
1 1 1 20 16 15 o 2  160.618 2.6479  449.387     20.8551  466.551     21.7739  99.9845    99.4029     30.6762     279.403     
1 1 1 20 16 16 o 15 199.302 2.79541 698.359     28.5152  712.188     27.2978  156.695    162.287     25.5679     162.287     
1 1 1 20 16 17 o 6  20.6093 5.62801 6.42215     7.95167  2.98985     8.68642  13.7179    80.0766     33.0759     80.0766     
1 1 1 20 16 18 o 6  124.612 2.71273 266.051     16.914   286.057     16.9096  86.9368    142.725     1.1727      322.725     
1 1 1 20 16 19 o 14 216.198 2.84732 830.714     30.125   829.561     31.5562  149.321    295.966     15.179      115.966     
1 1 1 20 16 20 o 16 113.01  2.65642 218.462     14.6309  235.736     15.4195  50.1658    168.631     59.5297     348.631     
1 1 1 20 16 21 o 5  164.728 2.72862 494.289     21.4006  470.003     23.5147  114.016    328.282     8.33262     148.282     
1 1 1 20 16 22 o 13 136.916 2.66426 342.868     17.2775  323.638     19.1348  111.421    102.612     30.1751     102.612     
1 1 1 20 16 23 o 4  135.515 2.67122 331.543     17.6177  321.401     18.5962  83.0002    192.891     26.6095     12.8914     
1 1 1 20 16 24 o 2  110.544 2.59955 223.192     13.9883  211.478     14.7351  90.5959    338.654     30.0074     338.654     
1 1 1 20 16 25 o 7  108.939 2.83743 218.837     14.5683  203.724     16.2368  62.4442    295.051     27.3874     115.051     
1 1 1 20 16 26 o 13 119.408 2.61563 249.193     15.5824  257.993     15.6819  84.1163    237.3       1.28481     237.3       
1 1 1 20 16 27 o 1  74.519  2.95143 104.48      10.7468  93.7917     11.1563  6.70222    97.8255     89.01       277.826     
1 1 1 20 16 28 o 8  123.59  2.54551 277.028     15.3046  266.342     16.1599  96.6122    269.541     20.9003     269.541     
1 1 1 20 16 29 o 11 75.7563 2.89138 102.876     10.5695  101.899     11.2869  41.0908    312.786     18.5242     132.786     
1 1 1 20 16 30 o 4  19.4119 5.34416 6.77175     7.0149   -0.128479   8.56154  21.9949    209.298     55.7195     209.298     
1 1 1 20 16 31 o 15 88.8195 3.05466 136.058     12.9589  145.654     14.1552  49.5497    325.49      22.4613     145.49      
1 1 1 20 16 32 o 4  111.718 2.98765 222.13      15.9785  223.068     17.3869  88.9092    266.722     23.7621     266.722     
1 1 1 20 16 33 o 15 217.109 3.21881 866.238     34.1436  815.22      35.8034  182.799    357.442     56.1846     357.442     
1 1 1 20 16 34 o 7  126.9   2.94215 281.458     18.6453  293.149     18.7208  59.2354    277.525     60.394      97.5247     
1 1 1 20 16 35 o 13 206.502 3.11996 780.043     31.4669  741.802     33.0327  182.811    337.768     73.0482     337.768     
1 1 1 20 16 36 o 1  52.6478 3.84133 46.0656     10.0048  54.4478     9.89709  28.0227    217.638     3.64502     37.638      
1 1 1 20 16 37 f 0  66.1032 3.25278 75.1642     10.467   81.7991     10.9499  17.9587    261.865     0           0           
1 1 1 20 16 38 o 6  124.915 2.66727 280.506     16.6501  276.249     16.7048  92.4887    351.8       11.5597     351.8       
1 1 1 20 16 39 o 10 114.454 2.58821 234.712     14.6158  232.73      15.0317  82.3088    240.085     6.10419     240.085     
1 1 1 20 16 40 o 4  31.1638 5.05924 19.3563     7.75458  17.2565     7.72135  6.54684    48.5657     8.58553     228.566     
1 1 1 20 16 41 o 5  157.451 2.621   441.296     20.8533  443.282     20.5066  109.909    51.9203     1.35773     231.92      
1 1 1 20 16 42 o 18 17.4469 5.01707 0.277362    7.07406  3.98171     6.83895  2.1705     281.032     10.4966     281.032     
1 1 1 20 16 43 o 9  147.792 2.71933 402.918     20.6506  378.444     19.601   124.456    140.222     42.5513     140.222     
1 1 1 20 16 44 o 14 36.8281 4.81846 26.4629     8.84341  24.4545     8.29072  15.229     20.2909     8.48574     20.2909     
1 1 1 20 16 45 o 3  54.1664 3.66913 51.586      10.0686  55.1911     9.56919  34.1736    265.664     2.82554     85.6644     
1 1 1 20 16 46 f 0  79.6883 3.09134 105.308     12.2255  123.821     12.3127  48.9374    271.238     0           0           
1 1 1 20 16 47 o 8  19.023  4.99566 -9.05167    8.29657  10.956      7.27829  0.0756824  23.6601     8.65053     23.6599     
1 1 1 20 16 48 o 9  33.3239 5.36052 17.258      9.05714  25.5311     8.55713  17.0792    80.0138     6.46701     80.0138     
1 1 1 20 16 49 o 18 65.5833 3.45459 80.333      11.2817  75.9986     11.2565  38.2752    170.287     11.5702     350.287     
1 1 1 20 16 50 o 19 17.9399 5.33936 2.23651     7.87638  0.333806    8.50334  6.61368    65.5446     30.3262     65.5446     
1 1 1 20 16 51 o 14 33.4519 5.69947 22.9144     8.99165  20.6043     9.92173  14.8385    154.795     10.0015     334.795     
1 1 1 20 16 52 o 4  55.3949 4.14687 58.762      11.4147  54.6721     11.2522  34.5383    233.317     3.63093     53.3168     
1 1 1 20 16 53 o 5  19.8703 5.60739 2.51192     7.92657  6.23446     8.95865  0.935949   295.551     15.0747     115.551     
1 1 1 20 16 54 o 4  59.0192 4.09141 69.4021     10.2186  59.5551     13.0981  40.0445    48.2037     2.42171     48.2036     
1 1 1 20 16 55 o 18 29.3014 5.65978 14.2267     8.20799  19.5678     8.96307  12.7035    234.976     8.70389     54.9762     
1 1 1 20 16 56 o 6  100.142 2.91781 169.664     13.8689  194.082     15.3675  74.5621    340.61      14.2633     340.61      
1 1 1 20 16 57 o 9  19.8338 5.48224 7.15282     8.04934  3.01717     7.88939  3.75136    196.53      1.59837     16.53       
1 1 1 20 16 58 o 9  47.2393 4.85312 42.8609     9.60108  42.8765     12.443   28.8729    312.035     3.20685     132.035     
1 1 1 20 16 59 o 3  44.0245 4.9773  31.6348     9.65826  44.2248     11.5856  31.5935    109.746     7.74548     109.746     
1 1 1 20 16 60 o 2  26.1561 6.17912 17.3881     9.37863  8.52579     10.4035  8.60244    244.942     12.9593     64.942      
1 1 1 20 16 61 o 2  26.4413 6.07971 17.205      8.84693  10.0174     10.2354  10.7704    307.396     7.96705     127.396     
1 1 1 20 16 62 o 5  19.5835 5.68679 5.7135      8.27303  1.81816     9.85562  3.55685    335.016     2.32196     155.016     
1 1 1 20 16 63 o 13 24.5337 6.12263 6.61308     8.74445  16.4032     10.4024  8.75513    288.362     1.16053     288.362     
1 1 1 20 16 64 o 2  38.8698 6.07165 42.4405     11.7046  21.4584     11.7416  8.12507    14.1281     32.481      194.128     
1 1 1 20 16 65 o 12 19.5976 6.02962 -2.62739    10.3941  4.77301     11.8491  2.29187    240.468     12.0693     60.4677     
1 1 1 20 16 66 o 9  21.0034 6.27821 3.73662     11.6717  4.15049     11.0735  2.02639    157.876     0.227891    337.876     
1 1 1 20 16 67 o 5  26.2638 6.83067 6.62487     13.6543  17.8875     11.2805  10.0993    160.026     8.92598     340.026     
1 1 1 20 16 68 o 4  41.7315 6.37682 39.2198     13.3762  34.7983     12.5259  28.4866    152.187     6.58794     152.187     
1 1 1 20 16 69 o 9  20.3808 6.17966 -2.6496     12.3567  6.88624     10.9121  5.4605     297.209     1.4044      117.209     
1 1 1 20 16 70 o 10 19.1256 6.04425 1.55842     12.0398  -2.57921    11.7079  2.76353    241.31      11.9683     61.3098     
1 1 1 20 16 71 o 18 30.8494 7.30531 25.5789     13.6084  19.5428     13.1061  15.8896    192.88      0.939577    12.8798     
1 1 1 20 16 72 o 6  21.3362 6.26633 -8.71962    12.5205  14.8271     12.0344  4.40857    190.38      5.11703     10.3802     
1 1 1 20 16 73 o 8  37.7205 7.11105 42.4911     14.2789  26.7409     13.6344  22.4946    186.618     13.3835     186.618     
1 1 1 20 16 74 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 17 0  f 0  130.654 2.57564 303.423     16.8347  303.423     16.8347  51.2171    5.78981e-06 0           0           
1 1 1 20 17 1  o 2  99.4631 2.8352  184.811     13.8075  167.277     14.3392  73.1964    82.2095     13.4611     82.2095     
1 1 1 20 17 2  o 5  91.0484 2.78743 150.611     12.9752  144.327     12.403   30.4861    36.1353     65.3706     216.135     
1 1 1 20 17 3  o 11 90.802  2.72863 154.371     12.3674  139.097     12.3821  53.0201    95.1942     16.2647     275.194     
1 1 1 20 17 4  o 2  295.074 3.39344 1545.94     47.866   1548.87     52.395   217.236    110.718     0.667978    290.717     
1 1 1 20 17 5  o 18 118.503 2.58141 248.446     15.2614  250.54      15.3624  58.6476    112.746     51.3196     292.746     
1 1 1 20 17 6  o 9  87.7934 2.87205 135.482     12.4937  138.849     12.7105  6.94073    36.9567     138.087     36.9567     
1 1 1 20 17 7  o 7  86.0162 2.83962 130.136     12.453   133.203     11.9477  54.3835    43.8309     4.6748      223.831     
1 1 1 20 17 8  o 17 17.8405 5.1305  -3.26759    7.70883  5.4119      7.37242  20.1498    326.823     45.9156     326.823     
1 1 1 20 17 9  o 3  160.738 2.65952 449.78      20.9324  467.679     21.9156  114.313    53.1885     3.55523     233.189     
1 1 1 20 17 10 o 11 81.4889 2.83049 113.379     11.5084  123.136     11.5242  60.3834    358.037     35.433      358.037     
1 1 1 20 17 11 o 16 212.69  2.81232 790.972     29.9627  815.833     29.984   160.879    188.761     11.0516     188.761     
1 1 1 20 17 12 o 3  300.928 3.45883 1606.04     52.1934  1614.38     52.1297  254.716    164.536     67.0091     164.536     
1 1 1 20 17 13 o 15 143.861 2.61459 369.184     18.8546  366.216     18.8138  74.4216    176.215     59.1957     356.215     
1 1 1 20 17 14 o 1  185.072 2.70879 610.173     25.1288  606.368     25.1177  127.157    355.572     14.9494     175.572     
1 1 1 20 17 15 o 18 203.398 2.86879 725.526     30.4292  744.443     27.9667  160.64     51.2007     25.2992     51.2007     
1 1 1 20 17 16 f 0  104.862 2.74306 183.884     13.7676  207.65      15.0217  57.6843    351.682     0           0           
1 1 1 20 17 17 o 4  59.6696 3.39193 68.7746     9.91303  58.9021     10.1305  14.4951    264.599     48.1307     84.5987     
1 1 1 20 17 18 o 3  80.199  2.9546  114.502     12.0287  114.756     11.6352  51.3228    248.354     3.58327     68.3535     
1 1 1 20 17 19 f 0  164.315 2.59446 486.524     21.3052  472.717     21.4179  81.6607    62.89       0           0           
1 1 1 20 17 20 f 0  86.5389 2.92997 128.073     12.9722  138.914     12.3144  46.4739    77.1194     0           0           
1 1 1 20 17 21 o 6  88.0732 2.99086 137.722     13.2708  138.78      13.0516  47.689     87.1124     25.8299     267.112     
1 1 1 20 17 22 o 16 72.4199 3.07547 96.0838     10.7556  91.2053     11.4293  26.5367    271.443     44.8472     91.4434     
1 1 1 20 17 23 f 0  48.5633 4.31938 39.863      10.1222  45.7945     10.4119  4.32178    134.784     0           0           
1 1 1 20 17 24 o 4  112.801 2.93713 239.025     14.9793  214.597     17.8462  103.327    51.4497     52.5255     51.4497     
1 1 1 20 17 25 f 0  147.466 2.77543 385.486     20.4859  388.558     20.499   99.2693    109.199     0           0           
1 1 1 20 17 26 o 13 54.0085 3.86816 52.6524     9.92223  52.5457     10.7091  28.4791    285.783     1.95506     105.783     
1 1 1 20 17 27 o 7  103.855 2.84703 198.339     13.9105  186.215     15.556   59.3096    265.594     27.0758     85.5943     
1 1 1 20 17 28 o 17 80.6913 3.062   124.31      12.1648  108.584     12.4423  54.7052    95.97       1.09982     95.97       
1 1 1 20 17 29 o 9  63.3394 3.576   76.325      10.5974  67.9586     11.7723  44.0284    69.487      25.0965     69.487      
1 1 1 20 17 30 o 8  73.2167 3.38043 96.573      11.9258  95.5927     12.7264  60.7181    355.728     34.4621     355.728     
1 1 1 20 17 31 o 15 148.974 2.75392 394.438     19.5895  396.414     21.4695  110.349    160.541     9.17753     160.541     
1 1 1 20 17 32 o 6  40.9795 4.45168 29.96       8.32577  31.7578     9.36726  12.3598    233.96      4.63747     53.9598     
1 1 1 20 17 33 o 12 135.209 2.62715 334.58      17.3051  317.312     18.2173  113.871    285.173     38.2055     285.173     
1 1 1 20 17 34 o 2  94.1181 2.80815 160.537     12.8009  155.952     13.6026  92.3292    186.697     67.7146     186.697     
1 1 1 20 17 35 o 19 103.012 2.71285 189.332     13.1675  189.57      14.7473  62.9036    107.41      17.4077     287.41      
1 1 1 20 17 36 o 10 60.7242 3.74603 66.9715     11.6219  66.3041     10.941   19.5522    214.364     42.1951     34.364      
1 1 1 20 17 37 o 4  92.3994 2.85773 147.41      13.4404  158.131     12.9241  66.8467    109.135     6.33109     109.135     
1 1 1 20 17 38 o 3  59.9    3.87554 73.3957     11.3869  57.1897     11.4518  41.6187    145.802     4.82638     145.802     
1 1 1 20 17 39 o 13 140.598 2.89781 360.445     20.0816  346.962     20.6882  110.245    313.126     22.135      313.126     
1 1 1 20 17 40 o 15 138.685 2.92785 350.916     20.8545  337.972     19.7982  104.399    194.469     13.387      194.469     
1 1 1 20 17 41 o 10 133.177 2.69476 319.046     17.7103  315.551     18.2158  93.8856    181.971     0.507518    181.971     
1 1 1 20 17 42 o 14 16.9432 5.13115 2.94779     8.36962  -3.62291    7.39438  8.00148    45.2682     29.7617     45.2682     
1 1 1 20 17 43 o 15 33.4352 5.34394 20.1647     9.21278  22.5079     8.28533  15.9898    333.532     5.73349     153.532     
1 1 1 20 17 44 o 13 19.2188 5.26651 -4.78988    7.87198  9.77629     8.15505  0.107994   78.518      7.04984     258.518     
1 1 1 20 17 45 o 12 66.6301 3.46586 85.0435     11.3031  76.2075     11.6282  49.4697    21.7484     9.25467     21.7484     
1 1 1 20 17 46 o 18 66.3688 3.50241 76.8368     11.3717  83.3422     11.7561  37.9663    251.265     14.2225     71.2651     
1 1 1 20 17 47 o 2  86.8585 3.10458 135.818     13.2215  136.667     13.7149  64.0673    290.033     9.23072     290.033     
1 1 1 20 17 48 o 19 19.7495 5.32361 9.30159     7.5744   -1.13107    8.09523  0.637305   48.9075     13.8616     228.908     
1 1 1 20 17 49 o 10 64.1155 3.42807 77.7487     10.7279  71.9655     11.1037  48.2669    45.7344     11.0322     45.7344     
1 1 1 20 17 50 f 0  47.9377 4.02729 42.6726     9.79155  42.3671     9.16917  38.8107    62.1799     0           0           
1 1 1 20 17 51 o 3  115.276 2.66374 238.215     15.1705  239.951     15.5635  85.0315    32.4891     12.1058     32.4891     
1 1 1 20 17 52 o 3  22.8842 5.36157 0.942703    8.23585  15.3423     7.81033  5.40795    345.745     12.5214     165.745     
1 1 1 20 17 53 o 1  82.1478 3.05919 127.755     12.3704  117.199     12.6922  75.296     319.062     40.5151     319.062     
1 1 1 20 17 54 o 17 27.5853 5.72041 12.6559     8.30105  17.2113     8.63838  15.2027    284.516     1.91859     284.516     
1 1 1 20 17 55 o 11 20.5803 5.60422 5.96201     8.14807  6.23655     8.16655  5.98888    89.5419     4.05924     269.542     
1 1 1 20 17 56 o 17 19.6872 5.48543 0.708046    7.9492   8.42567     8.4175   2.19321    175.17      16.3199     355.17      
1 1 1 20 17 57 o 10 61.2535 3.66474 68.4642     10.7712  70.9156     11.5137  50.3435    298.054     20.2714     298.054     
1 1 1 20 17 58 o 13 95.2173 2.93751 158.359     13.7169  172.815     14.2476  62.7574    114.573     2.30869     294.573     
1 1 1 20 17 59 o 9  19.4164 5.61096 6.30782     8.38037  1.06056     9.23573  3.07967    211.783     12.7531     31.7828     
1 1 1 20 17 60 o 14 32.5992 6.22835 25.822      10.2768  18.6227     10.8067  17.4146    357.415     4.0161      177.415     
1 1 1 20 17 61 o 15 50.4661 4.69617 50.491      10.9077  48.425      12.1689  22.2586    137.502     20.9267     317.502     
1 1 1 20 17 62 o 6  30.5021 6.03032 10.3321     9.28293  29.1304     10.9804  14.009     354.699     7.0798      174.699     
1 1 1 20 17 63 o 7  18.3747 5.75611 -0.305451   10.5831  -1.00076    10.4306  0.627832   104.713     1.2165      284.713     
1 1 1 20 17 64 o 1  51.4253 5.41504 40.6345     13.1647  66.6098     13.1335  44.4427    260.547     26.2577     260.547     
1 1 1 20 17 65 o 8  31.9051 6.76654 29.906      11.7556  12.678      13.4188  20.6484    199.294     11.0991     199.294     
1 1 1 20 17 66 o 9  34.1333 7.33341 28.6712     14.5592  23.6919     12.7509  19.2465    242.113     1.82048     62.1131     
1 1 1 20 17 67 o 7  27.3038 6.886   15.3743     11.9041  15.8826     11.8711  14.8899    321.202     2.64717     321.202     
1 1 1 20 17 68 o 15 19.2979 6.01365 1.81794     11.3751  -0.192688   11.2909  3.1814     95.0568     0.921143    275.057     
1 1 1 20 17 69 o 13 19.132  6.01995 2.89717     12.0213  -2.44088    11.2785  3.50777    255.304     3.87698     75.3042     
1 1 1 20 17 70 f 0  20.6314 6.30217 6.2233      11.9723  1.87252     11.9516  6.07756    317.388     0           0           
1 1 1 20 17 71 o 7  22.3527 6.58744 7.94419     12.3575  8.39327     12.1376  4.87439    247.784     3.5851      67.7838     
1 1 1 20 17 72 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 17 73 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 18 0  o 11 143.836 2.59487 367.681     18.6768  367.681     18.6768  145.395    180         76.3102     180         
1 1 1 20 18 1  o 7  77.3565 3.00887 110.51      11.3423  102.874     11.8591  45.0744    337.064     13.2534     157.064     
1 1 1 20 18 2  o 10 72.4964 3.1597  95.8283     12.0444  91.7489     10.7908  23.172     189.751     52.6983     9.75087     
1 1 1 20 18 3  o 19 146.787 2.80174 374.804     20.1139  391.341     21.0706  90.7481    296.858     31.9547     116.858     
1 1 1 20 18 4  o 13 219.479 2.85712 856.937     32.0999  854.694     30.7377  121.528    286.933     80.8547     106.933     
1 1 1 20 18 5  o 15 137.899 2.64286 342.48      18.6064  333.487     17.8879  54.2992    279.272     92.4369     99.2716     
1 1 1 20 18 6  f 0  77.0499 3.02227 105.23      11.2902  106.444     11.9518  54.1816    18.1531     0           0           
1 1 1 20 18 7  o 11 145.217 2.63092 382.485     19.5388  367.155     18.7244  97.6912    261.019     15.1264     81.0194     
1 1 1 20 18 8  o 13 215.669 2.86278 832.744     31.6307  820.303     30.2452  151.619    341.465     13.9357     161.465     
1 1 1 20 18 9  o 8  35.6953 5.00102 35.4087     8.49536  13.2385     8.77382  2.92446    40.2547     35.4133     40.2547     
1 1 1 20 18 10 o 16 91.9851 2.74836 153.465     12.6489  147.763     12.6294  63.1814    329.395     0.152648    149.396     
1 1 1 20 18 11 o 4  233.364 2.91815 957.729     34.1076  978.338     34.1445  137.348    313.879     69.1254     133.879     
1 1 1 20 18 12 o 7  103.046 2.84996 195.716     15.3898  182.428     13.9901  100.718    217.292     74.1417     217.292     
1 1 1 20 18 13 o 3  65.274  3.2796  80.3195     10.397   72.1692     10.8616  42.4055    66.9151     18.2144     66.9151     
1 1 1 20 18 14 o 12 84.8345 2.87301 113.7       12.0741  143.636     12.1643  32.5867    243.754     53.5224     63.7538     
1 1 1 20 18 15 o 18 151.803 2.63034 394.611     19.9843  424.871     19.9991  144.514    250.297     72.333      250.297     
1 1 1 20 18 16 o 10 89.0425 2.86411 148.956     12.9561  133.767     12.5292  53.9519    18.7965     15.3043     198.797     
1 1 1 20 18 17 o 7  114.892 2.82056 240.811     15.8949  229.229     16.5069  79.2791    67.8822     4.50023     247.882     
1 1 1 20 18 18 o 5  50.707  4.00167 45.0286     10.1381  47.8874     9.82915  17.9008    296.163     23.6135     116.163     
1 1 1 20 18 19 o 1  116.91  2.75488 229.377     16.0639  257.654     16.1341  88.304     138.246     11.1714     138.246     
1 1 1 20 18 20 o 8  146.52  2.60364 372.677     19.0646  390.977     19.1483  116.202    6.1536      21.9867     6.1536      
1 1 1 20 18 21 o 3  82.4035 2.9714  130.08      12.0016  112.573     12.3767  49.4074    46.7056     14.1805     226.706     
1 1 1 20 18 22 o 12 173.221 2.88017 533.601     25.0187  534.438     24.9857  141.594    139.308     32.9489     139.308     
1 1 1 20 18 23 o 18 30.1292 5.8069  14.8534     8.67952  19.0513     9.37939  4.04112    34.3537     30.4784     34.3537     
1 1 1 20 18 24 o 6  171.399 3.46433 522.003     26.27    527.295     32.8379  155.555    280.786     64.7834     280.786     
1 1 1 20 18 25 o 7  95.1171 3.0162  170.268     13.7773  153.014     14.7964  73.1222    229.921     14.8301     229.921     
1 1 1 20 18 26 o 6  24.4463 5.91261 9.48148     8.46469  10.5517     8.95654  23.8468    171.23      71.802      171.23      
1 1 1 20 18 27 f 0  72.0843 3.35658 96.8818     11.9345  89.546      12.1555  59.3647    318.312     0           0           
1 1 1 20 18 28 o 6  98.8605 2.90472 180.357     14.0002  168.805     14.6749  89.5622    135.159     45.0591     135.159     
1 1 1 20 18 29 f 0  27.5272 5.82507 13.4117     8.25075  14.5176     9.06989  61.4619    121.952     0           0           
1 1 1 20 18 30 o 15 87.2604 3.1257  136.539     13.4622  136.1       13.7834  70.0371    357.642     22.4834     357.642     
1 1 1 20 18 31 o 7  16.5941 5.16916 -4.00217    7.38717  0.0188003   9.26795  15.8766    88.8554     39.265      88.8554     
1 1 1 20 18 32 f 0  132.867 2.74628 312.506     17.3023  317.756     19.1951  87.0416    106.174     0           0           
1 1 1 20 18 33 o 8  83.444  2.89765 120.865     12.0705  128.425     12.0813  58.1124    133.535     1.63592     133.535     
1 1 1 20 18 34 o 17 24.5515 5.64532 9.72869     7.98383  11.6629     7.96364  16.0515    215.701     59.2283     215.701     
1 1 1 20 18 35 o 18 58.576  3.52376 61.2419     10.2897  62.7463     10.1991  41.8497    84.9189     6.79848     84.9189     
1 1 1 20 18 36 o 3  140.171 2.81261 350.02      20.2372  352.723     19.2194  96.7265    63.5193     6.23652     243.519     
1 1 1 20 18 37 o 9  55.8872 3.78407 50.2864     10.4037  63.5719     10.4011  29.9542    156.198     16.0524     336.198     
1 1 1 20 18 38 o 18 107.309 3.18344 205.858     16.3698  207.976     17.7694  89.6666    74.2764     28.6237     74.2764     
1 1 1 20 18 39 o 2  100.183 3.01949 186.909     14.2686  173.736     15.8587  93.7452    79.4939     48.2222     79.4939     
1 1 1 20 18 40 o 12 99.6142 3.05008 183.615     15.0702  173.283     15.2923  81.6789    328.001     24.2879     328.001     
1 1 1 20 18 41 o 5  64.7336 3.66825 74.0663     11.79    78.3185     11.8034  38.6911    302.236     11.3053     122.236     
1 1 1 20 18 42 o 19 69.2721 3.56636 83.3115     12.1145  91.0788     12.4713  48.6364    146.142     2.50785     146.142     
1 1 1 20 18 43 o 4  82.3517 3.12759 115.131     12.4695  129.985     13.2505  64.0564    164.679     14.6421     164.679     
1 1 1 20 18 44 o 14 41.7861 4.39372 33.9796     9.23318  31.2219     8.61287  18.1294    309.835     18.3598     129.835     
1 1 1 20 18 45 o 9  45.3949 3.98784 39.348      8.83346  36.8211     8.90702  20.1545    42.1639     19.8713     222.164     
1 1 1 20 18 46 o 19 57.063  3.42096 57.6027     9.71564  61.1169     9.65597  46.6913    120.279     18.2874     120.279     
1 1 1 20 18 47 o 19 74.5598 3.06658 99.7947     11.2484  101.396     11.569   49.5916    201.995     2.78997     21.9954     
1 1 1 20 18 48 o 14 27.9384 5.62604 15.1183     8.09588  15.1179     8.41732  7.76129    274.619     17.2461     94.6192     
1 1 1 20 18 49 o 9  83.4152 2.95108 130.675     12.3393  121.048     12.2442  69.4529    192.02      25.3281     192.02      
1 1 1 20 18 50 o 12 34.7806 5.22092 15.5252     8.88763  32.2224     8.94922  23.3244    331.032     6.24049     331.032     
1 1 1 20 18 51 o 6  17.4765 5.14106 -5.075      7.63495  6.20275     8.11165  1.32097    214.496     10.0498     34.4957     
1 1 1 20 18 52 o 17 87.6994 2.92276 141.012     12.7807  138.004     12.8361  66.6897    172.979     13.8069     172.979     
1 1 1 20 18 53 o 2  80.023  3.0938  112.518     12.477   121.006     12.217   65.4615    166.732     22.6569     166.732     
1 1 1 20 18 54 o 3  64.992  3.51583 75.5443     11.6247  80.4137     11.0642  47.3621    250.078     7.58513     250.078     
1 1 1 20 18 55 o 18 24.1987 5.70967 17.0103     8.92113  4.21517     8.42525  7.15841    159.245     13.8525     339.245     
1 1 1 20 18 56 o 13 29.5233 5.88091 18.8692     9.237    16.7379     8.91635  9.36515    4.49114     17.8759     184.491     
1 1 1 20 18 57 o 15 26.5548 6.01241 10.8524     9.16819  17.3894     9.22244  5.91559    3.11404     20.3259     183.114     
1 1 1 20 18 58 o 8  93.7626 2.96277 170.975     14.0165  151.526     13.732   68.2334    260.484     10.5931     260.484     
1 1 1 20 18 59 o 13 62.1242 3.91471 82.3487     11.5719  63.7919     12.2361  44.1548    91.7445     6.75034     91.7445     
1 1 1 20 18 60 f 0  28.1429 6.13778 11.5129     10.2684  20.8705     9.46811  25.9389    201.149     0           0           
1 1 1 20 18 61 o 5  41.8116 5.63588 51.3509     10.4863  21.9352     11.8416  23.347     297.92      5.50359     117.92      
1 1 1 20 18 62 o 11 28.5545 6.76486 17.118      11.1549  17.3327     11.6449  12.0747    163.575     8.13825     343.575     
1 1 1 20 18 63 o 7  53.1168 5.08808 55.7674     13.1182  55.9104     13.2733  43.5863    60.4708     20.1508     60.4708     
1 1 1 20 18 64 o 17 20.1438 6.07137 2.77299     10.6788  3.38035     10.8899  5.71584    85.5628     1.13556     265.563     
1 1 1 20 18 65 o 17 63.6665 4.97306 57.986      14.1047  105.557     16.4562  50.8499    354.884     19.8894     354.884     
1 1 1 20 18 66 o 7  49.0044 6.80728 40.1736     16.6019  66.2729     15.3982  40.63      109.868     21.3999     109.868     
1 1 1 20 18 67 o 3  23.9    6.87183 3.34157     11.8561  16.0304     14.2852  8.95977    2.85762     1.33507     2.85762     
1 1 1 20 18 68 o 12 33.9385 7.05298 35.8123     13.1916  18.7361     13.6923  21.9912    67.6021     8.97412     67.6021     
1 1 1 20 18 69 o 1  23.3543 7.11145 7.26008     15.676   8.96224     14.5344  5.59781    340.395     1.25165     160.395     
1 1 1 20 18 70 o 6  31.5483 7.69742 37.741      15.7693  11.1445     17.3408  9.00092    329.602     4.63441     329.602     
1 1 1 20 18 71 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 19 0  o 10 27.2689 6.83469 17.4477     8.49633  17.4477     8.49633  0.0966997  179.997     0.418695    179.997     
1 1 1 20 19 1  o 1  31.5548 5.39425 20.0985     8.62918  17.0705     8.25871  2.56018    215.765     22.1013     215.765     
1 1 1 20 19 2  o 15 31.2343 5.32243 13.8851     8.39487  22.5672     8.27543  1.96208    139.927     17.6238     139.927     
1 1 1 20 19 3  o 10 116.258 2.61053 238.228     15.1704  242.613     15.2094  62.1891    139.808     43.7004     319.808     
1 1 1 20 19 4  o 6  29.1099 5.54115 11.3778     8.28298  20.0403     8.55997  5.45574    79.5229     26.6654     79.5229     
1 1 1 20 19 5  o 4  93.1446 2.85721 158.177     12.8994  150.969     13.6751  28.7217    86.4141     75.9989     266.414     
1 1 1 20 19 6  o 16 85.6159 2.91889 132.654     12.6527  128.682     12.3216  63.1898    92.0222     9.92986     92.0222     
1 1 1 20 19 7  o 9  276.641 3.23113 1352.59     43.8327  1371.97     45.7486  219.366    92.036      28.9699     92.036      
1 1 1 20 19 8  o 12 73.5796 3.21896 91.3968     12.2831  102.228     11.2205  45.6803    250.188     6.93896     70.1877     
1 1 1 20 19 9  o 15 76.7718 3.03145 102.863     11.3828  107.546     11.852   5.66139    75.1452     97.5675     255.145     
1 1 1 20 19 10 o 6  122.968 2.77683 277.028     17.0813  261.399     17.0877  93.3488    68.7174     10.2445     68.7174     
1 1 1 20 19 11 o 11 63.5097 3.48143 66.1727     10.9344  78.7073     10.9888  31.4922    127.348     20.1858     307.348     
1 1 1 20 19 12 o 6  134.195 2.59361 312.303     17.4261  328.518     17.4167  88.82      265.039     16.9311     85.0385     
1 1 1 20 19 13 o 9  183.137 2.83707 590.375     26.0765  602.972     25.9964  181.332    116.747     96.617      116.747     
1 1 1 20 19 14 o 15 128.978 2.6555  292.337     17.1386  299.824     17.1513  102.788    129.183     20.2987     129.183     
1 1 1 20 19 15 o 14 170.398 2.83851 521.967     24.756   511.383     23.7198  140.046    327.997     31.8196     327.997     
1 1 1 20 19 16 o 9  162.997 2.89633 448.504     23.671   498.281     23.5682  122.805    179.876     8.17543     179.876     
1 1 1 20 19 17 o 8  177.91  3.11025 563.318     27.8668  564.495     27.593   151.767    218.056     44.4116     218.056     
1 1 1 20 19 18 o 2  42.196  5.55203 25.554      10.9287  41.4623     11.5975  3.0395     303.965     58.899      303.965     
1 1 1 20 19 19 o 2  188.323 3.29342 635.722     30.0492  629.82      32.0439  129.171    213.302     17.0521     33.3018     
1 1 1 20 19 20 o 17 202.176 3.18385 728.229     32.2634  729.589     32.2533  197.857    175.752     101.699     175.752     
1 1 1 20 19 21 o 12 119.019 3.11145 264.327     18.5619  241.805     18.4667  68.1325    335.492     35.0119     155.492     
1 1 1 20 19 22 o 17 226.143 3.17428 895.01      34.2379  930.11      37.6825  190.875    336.43      51.5583     336.43      
1 1 1 20 19 23 f 0  69.6988 3.79246 90.3928     13.105   84.5989     13.1699  36.5863    331.203     0           0           
1 1 1 20 19 24 o 5  26.7622 6.17113 12.5567     9.47982  12.7916     9.53088  2.6794     245.744     17.424      245.744     
1 1 1 20 19 25 o 16 58.2911 3.81829 61.6653     11.0151  61.1404     11.0391  21.8695    80.3457     14.5187     80.3457     
1 1 1 20 19 26 o 6  34.1137 5.18957 23.6275     8.21371  20.0667     9.00395  15.7824    16.2161     73.0721     16.2161     
1 1 1 20 19 27 o 6  40.1514 4.59851 27.8287     8.49449  31.7991     9.38706  12.7437    151.198     4.71671     331.198     
1 1 1 20 19 28 o 6  41.1576 4.45254 31.726      8.24704  30.6747     9.46485  15.5868    243.109     11.4522     63.1092     
1 1 1 20 19 29 o 4  87.739  2.9602  137.097     12.275   138.518     13.6501  73.4672    194.732     26.5673     194.732     
1 1 1 20 19 30 o 15 48.9136 4.09886 34.9429     9.71766  53.3153     9.5049   30.0807    184.428     1.11215     184.428     
1 1 1 20 19 31 o 6  74.5749 3.15674 104.048     12.4039  95.7952     11.0851  43.8842    324.712     16.0992     144.712     
1 1 1 20 19 32 o 2  69.886  3.71025 82.0021     13.0743  94.7761     12.6259  39.5551    307.547     18.2826     127.547     
1 1 1 20 19 33 o 14 131.634 3.0522  311.62      20.115   309.443     20.0995  89.8492    14.7788     9.19363     194.779     
1 1 1 20 19 34 o 6  24.4845 5.80839 15.3365     8.69082  3.91347     9.19938  2.05413    161.859     20.6472     341.859     
1 1 1 20 19 35 o 16 101.018 3.03083 185.496     15.2968  180.957     15.318   88.034     239.369     33.5583     239.369     
1 1 1 20 19 36 o 6  51.6918 4.11348 49.0083     10.5047  48.9477     10.4375  38.5464    260.601     9.07059     260.601     
1 1 1 20 19 37 o 10 61.1297 3.43446 67.1122     10.0332  68.3209     10.8263  41.3413    259.315     1.03833     79.3147     
1 1 1 20 19 38 o 5  30.8407 5.31816 18.1384     8.02951  18.3219     8.25983  14.7032    97.8932     1.38158     97.8932     
1 1 1 20 19 39 o 2  43.5142 4.27108 29.2689     9.11202  41.4485     8.65518  18.009     297.315     21.9662     117.315     
1 1 1 20 19 40 o 14 49.0749 3.93208 32.322      8.9884   58.0687     9.36521  39.2425    335.886     15.5449     335.886     
1 1 1 20 19 41 o 8  47.6929 3.92131 43.2704     9.00794  40.5217     9.35767  40.0794    2.18525     20.9504     2.18525     
1 1 1 20 19 42 o 11 80.7678 2.9839  121.482     11.9761  114.062     12.0819  55.9381    284.287     0.426475    104.287     
1 1 1 20 19 43 o 13 31.5479 5.40721 22.5167     8.50123  16.1375     8.52457  17.4568    246.559     5.01318     246.559     
1 1 1 20 19 44 o 2  91.1819 3.07759 147.136     13.9777  153.546     14.0639  72.2389    122.366     17.9051     122.366     
1 1 1 20 19 45 o 6  45.0089 4.79827 44.0453     10.697   32.822      10.1653  34.5126    280.017     12.0993     280.017     
1 1 1 20 19 46 o 6  58.274  3.92047 62.482      11.3587  62.6827     11.2636  36.4528    343.531     6.05083     163.531     
1 1 1 20 19 47 o 10 80.3802 3.34189 134.94      13.2439  101.419     13.3218  64.6548    46.7476     18.9968     46.7476     
1 1 1 20 19 48 o 9  17.1638 5.12334 -0.0936194  7.73709  2.36326     7.43796  1.02736    215.034     5.23063     35.034      
1 1 1 20 19 49 o 1  19.9045 5.55189 2.39779     8.73359  6.84564     7.84774  0.0146186  149.517     22.0238     149.514     
1 1 1 20 19 50 o 1  39.5172 4.85205 32.8207     9.21339  27.4014     9.26324  33.3045    116.037     19.5008     116.037     
1 1 1 20 19 51 o 19 19.8163 5.4954  8.4322      8.07688  0.562117    8.4241   5.39668    25.5864     6.38649     205.586     
1 1 1 20 19 52 o 13 25.2141 5.92284 13.9792     8.96854  10.5337     8.57724  3.24847    39.4495     24.6466     219.45      
1 1 1 20 19 53 o 4  30.1013 5.82024 19.6469     8.9889   17.2004     9.10433  14.2203    20.6585     8.71014     200.659     
1 1 1 20 19 54 o 16 87.4074 3.12905 144.919     13.598   135.617     13.7085  63.8541    57.5564     8.79057     57.5564     
1 1 1 20 19 55 o 4  19.3766 5.40298 9.87135     8.3879   -2.36553    8.18761  2.01114    296.679     16.547      116.679     
1 1 1 20 19 56 o 10 30.5751 5.85203 15.8116     9.3698   22.8861     9.22996  14.7908    341.944     9.61002     341.944     
1 1 1 20 19 57 o 1  23.8027 5.88854 13.7904     8.856    7.62973     8.76505  9.57893    244.665     0.603958    244.665     
1 1 1 20 19 58 o 16 17.2775 5.25775 -2.11746    8.27878  3.49931     8.40142  0.546381   204.844     16.6211     204.844     
1 1 1 20 19 59 o 11 33.6488 5.69871 15.723      9.82365  31.7251     9.73929  19.8705    214.598     0.406888    214.598     
1 1 1 20 19 60 o 9  42.1951 5.53347 30.2318     11.5518  42.6086     10.7799  17.0018    88.1737     20.2037     268.174     
1 1 1 20 19 61 o 4  77.7527 4.08637 100.497     16.0927  130.07      15.0938  59.7565    110.75      16.7487     110.749     
1 1 1 20 19 62 o 3  54.7245 5.28463 45.2199     13.7204  75.9413     13.4281  43.1367    335.052     15.8449     335.052     
1 1 1 20 19 63 o 3  27.1262 6.87377 15.7473     11.859   14.8854     11.8636  11.5916    151.85      8.03343     331.85      
1 1 1 20 19 64 f 0  24.6687 6.57747 3.79455     11.934   17.6707     11.5154  3.08895    290.008     0           0           
1 1 1 20 19 65 o 6  24.1379 7.00624 14.1016     13.6711  4.3618      13.9945  10.4794    232.693     0.665845    232.693     
1 1 1 20 19 66 o 13 53.1988 6.58476 72.6562     16.3391  53.6214     17.1043  45.5853    240.787     26.1876     240.787     
1 1 1 20 19 67 f 0  21.7837 6.84056 -4.23302    15.0658  9.98525     15.3899  9.25899    222.979     0           0           
1 1 1 20 19 68 o 18 37.2275 7.96957 32.033      16.5578  41.1959     16.1069  22.6424    171.253     13.4239     171.253     
1 1 1 20 19 69 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 20 0  o 3  16.9057 7.219   4.93414     11.1889  4.93414     11.1889  33.3537    8.62258e-06 72.8209     8.62258e-06 
1 1 1 20 20 1  f 0  125.327 2.63349 279.559     16.5069  279.559     16.5069  55.3971    210         0           0           
1 1 1 20 20 2  o 13 91.474  2.72469 149.345     12.4398  149.345     12.4398  92.3892    240         48.5164     240         
1 1 1 20 20 3  o 15 10.5698 5.05488 -3.80766    7.87824  -3.80766    7.87824  27.9166    90          59.7035     90          
1 1 1 20 20 4  o 17 314.63  3.55723 1761.5      56.0561  1761.5      56.0561  302.384    120         133.928     120         
1 1 1 20 20 5  o 2  15.4586 6.42759 4.96932     8.436    4.96932     8.436    3.19234    150         7.54123     150         
1 1 1 20 20 6  o 10 117.723 2.7742  246.902     16.3253  246.902     16.3253  127.125    360         78.2301     360         
1 1 1 20 20 7  o 2  55.4167 3.84937 56.1933     10.4368  56.1933     10.4368  28.6124    210         23.7252     30          
1 1 1 20 20 8  o 9  83.39   3.31362 124.765     13.7469  124.765     13.7469  63.3366    60          2.13566     60.0001     
1 1 1 20 20 9  o 4  237.592 3.24327 1004.44     38.5842  1004.44     38.5842  157.291    270         40.3325     90          
1 1 1 20 20 10 o 15 130.087 2.93689 301.538     19.102   301.538     19.102   119.708    120         45.1941     120         
1 1 1 20 20 11 o 7  125.536 2.88152 280.825     18.0847  280.825     18.0847  115.175    330         43.0316     330         
1 1 1 20 20 12 o 5  33.345  7.43345 25.0421     10.9125  25.0421     10.9125  2.71775    1.19229e-05 6.26307     180         
1 1 1 20 20 13 o 16 31.0234 7.3507  22.1841     10.1944  22.1841     10.1944  2.78313    30          38.7192     30          
1 1 1 20 20 14 o 9  40.0989 6.06272 32.3684     10.7014  32.3684     10.7014  15.2339    60          14.3634     240         
1 1 1 20 20 15 o 18 23.1558 7.75491 14.1829     10.2057  14.1829     10.2057  9.72525    270         34.4258     270         
1 1 1 20 20 16 o 1  170.054 2.95261 514.898     25.1282  514.898     25.1282  125.629    300         1.54228     120         
1 1 1 20 20 17 o 11 13.1881 5.91696 1.12783     8.4843   1.12783     8.4843   12.343     150         28.0459     150         
1 1 1 20 20 18 o 18 27.581  7.06987 18.1215     8.97379  18.1215     8.97379  28.4032    180         93.9015     180         
1 1 1 20 20 19 o 14 260.978 3.085   1212.32     40.3223  1212.32     40.3223  199.686    30          12.5286     30          
1 1 1 20 20 20 o 10 65.3975 3.27934 77.2402     10.621   77.2402     10.621   35.1604    60          26.3321     240         
1 1 1 20 20 21 f 0  143.189 2.63153 365.07      18.8545  365.07      18.8545  90.0778    90          0           0           
1 1 1 20 20 22 o 2  136.323 2.88107 331.335     19.6428  331.335     19.6428  108.656    120         15.9291     120         
1 1 1 20 20 23 o 7  101.817 2.70805 185.056     13.7734  185.056     13.7734  99.778     330         49.354      330         
1 1 1 20 20 24 o 18 14.5518 6.12279 4.19468     7.81941  4.19468     7.81941  5.88288    180         14.3656     180         
1 1 1 20 20 25 o 3  15.8187 6.64456 5.05794     9.18002  5.05794     9.18002  36.0595    210         88.7328     210         
1 1 1 20 20 26 o 10 47.1808 4.84607 42.2665     10.7541  42.2665     10.7541  35.4261    60          17.7175     60          
1 1 1 20 20 27 f 0  106.438 3.14319 202.799     16.6993  202.799     16.6993  89.4677    270         0           0           
1 1 1 20 20 28 o 9  43.728  4.87258 36.6797     9.88585  36.6797     9.88585  36.1565    300         14.2603     300         
1 1 1 20 20 29 o 16 14.3992 6.29363 2.92033     8.95744  2.92033     8.95744  8.04137    330         24.8172     330         
1 1 1 20 20 30 o 14 121.268 2.77667 262.571     16.8345  262.571     16.8345  114.768    180         52.4396     180         
1 1 1 20 20 31 o 15 15.9112 6.48059 5.88038     8.29561  5.88038     8.29561  11.2026    30          37.9698     30          
1 1 1 20 20 32 o 18 15.6839 6.31927 5.88353     7.76533  5.88353     7.76533  4.8719     60          19.1315     60          
1 1 1 20 20 33 o 3  14.1551 5.97367 3.98163     7.48508  3.98163     7.48508  11.5959    90          35.2807     90          
1 1 1 20 20 34 o 16 102.166 2.75373 186.767     14.0524  186.767     14.0524  89.0657    300         29.983      300         
1 1 1 20 20 35 o 9  66.8599 3.26311 80.9683     10.8118  80.9683     10.8118  51.9967    150         7.22668     150         
1 1 1 20 20 36 o 2  91.6057 2.95292 150.655     13.4918  150.655     13.4918  87.824     180         43.326      180         
1 1 1 20 20 37 o 6  14.4792 6.30289 3.28819     8.89726  3.28819     8.89726  3.52186    210         13.5128     210         
1 1 1 20 20 38 o 16 96.6567 3.21171 168.124     15.4786  168.124     15.4786  79.4988    60          19.9495     60          
1 1 1 20 20 39 o 5  109.852 2.81388 216.198     15.4447  216.198     15.4447  73.055     90          11.5852     270         
1 1 1 20 20 40 o 16 19.4938 6.91517 10.3535     8.28642  10.3535     8.28642  0.689906   300         1.6845      120         
1 1 1 20 20 41 o 11 22.8829 6.98866 13.712      8.24779  13.712      8.24779  6.50594    150         13.0876     330         
1 1 1 20 20 42 f 0  23.5282 6.90252 14.2469     8.10122  14.2469     8.10122  32.089     180         0           0           
1 1 1 20 20 43 o 5  112.26  2.63035 225.62      14.761   225.62      14.761   120.007    210         80.3165     210         
1 1 1 20 20 44 o 4  63.5691 3.34517 73.6257     10.5179  73.6257     10.5179  37.247     240         15.72       60          
1 1 1 20 20 45 o 13 69.4241 3.20011 87.4475     11.0236  87.4475     11.0236  42.7249    90          12.8311     270         
1 1 1 20 20 46 o 1  25.6014 7.13245 16.625      8.78572  16.625      8.78572  11.5273    120         11.2337     300         
1 1 1 20 20 47 o 12 18.6049 6.8129  9.54518     8.1954   9.54518     8.1954   1.83407    330         0.990097    150         
1 1 1 20 20 48 o 1  13.0497 5.9416  0.742128    8.94935  0.742128    8.94935  1.24537    180         8.84163     180         
1 1 1 20 20 49 f 0  67.0906 3.98461 83.2333     13.1715  83.2333     13.1715  54.5001    210         0           0           
1 1 1 20 20 50 o 14 14.4141 6.34464 3.22116     9.26285  3.22116     9.26285  2.32385    60          19.4834     60          
1 1 1 20 20 51 o 9  16.5721 6.95177 6.47045     10.024   6.47045     10.024   4.71932    90          30.8622     90          
1 1 1 20 20 52 o 13 51.0631 4.55358 49.9135     11.1497  49.9135     11.1497  49.2593    120         27.5939     120         
1 1 1 20 20 53 o 5  43.2451 4.99202 36.977      9.9535   36.977      9.9535   28.5943    330         25.0503     330         
1 1 1 20 20 54 o 12 16.4181 6.8654  6.56541     9.72073  6.56541     9.72073  0.197149   180         17.2264     8.65168e-06 
1 1 1 20 20 55 o 7  16.5105 6.70659 7.14884     8.84887  7.14884     8.84887  1.61782    30          9.98419     210         
1 1 1 20 20 56 o 18 10.8602 5.19386 -3.15429    8.31821  -3.15429    8.31821  0.0316375  59.9989     0.103223    59.9989     
1 1 1 20 20 57 o 3  17.1985 6.87552 8.09223     9.09539  8.09223     9.09539  0.505593   90.0001     1.39502     270         
1 1 1 20 20 58 o 9  13.6891 6.10493 2.53751     8.87897  2.53751     8.87897  3.73295    120         19.1039     120         
1 1 1 20 20 59 o 7  32.7642 7.06751 25.1468     10.1339  25.1468     10.1339  19.6375    330         5.06044     150         
1 1 1 20 20 60 o 1  13.8918 6.5692  -2.23919    12.6252  -2.23919    12.6252  1.79187    360         17.0078     360         
1 1 1 20 20 61 o 4  17.2253 7.5453  6.2087      12.9429  6.2087      12.9429  3.65835    210         3.70351     30          
1 1 1 20 20 62 o 8  10.8763 5.42809 -12.0175    11.8686  -12.0175    11.8686  1.58262    60          6.56482     60          
1 1 1 20 20 63 o 4  26.2642 8.99798 21.4477     13.8279  21.4477     13.8279  14.9564    270         3.41915     90          
1 1 1 20 20 64 o 12 18.1225 7.84455 8.44462     13.6047  8.44462     13.6047  0.77963    120         0.664377    300         
1 1 1 20 20 65 o 6  13.6318 6.53229 -3.14552    13.2874  -3.14552    13.2874  1.59931    330         9.3062      330         
1 1 1 20 20 66 o 5  18.4121 8.20214 8.46444     15.9781  8.46444     15.9781  1.79837    360         5.87487     180         
1 1 1 20 20 67 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 20 20 68 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 0  0  o 16 321.714 4.10896 1835.85     66.1976  1835.85     66.1976  199.845    180         152.738     180         
1 1 1 21 0  1  o 4  395.991 3.2638  2779.95     64.7494  2779.95     64.7494  265.225    60          47.1034     240         
1 1 1 21 0  2  o 3  587.818 4.81786 6126.89     141.882  6126.89     141.882  398.686    120         59.893      300         
1 1 1 21 0  3  o 3  232.804 2.68092 961.153     31.259   961.153     31.259   170.17     360         2.35071     360         
1 1 1 21 0  4  o 16 351.625 3.25332 2192.17     57.3059  2192.17     57.3059  266.468    60          20.3039     59.9999     
1 1 1 21 0  5  o 4  1289.14 9.84786 29503.3     636.044  29503.3     636.044  1041.33    120         203.686     120         
1 1 1 21 0  6  o 2  178.263 2.31409 563.662     20.6572  563.662     20.6572  29.1406    360         18.6429     360         
1 1 1 21 0  7  o 7  80.9514 2.2697  116.666     9.17481  116.666     9.17481  11.1664    240         60.5902     240         
1 1 1 21 0  8  f 0  333.031 3.27101 1966.61     54.568   1966.61     54.568   288.839    300         0           0           
1 1 1 21 0  9  o 1  90.4506 2.24834 145.507     10.1628  145.507     10.1628  10.9277    9.34631e-06 108.229     9.34632e-06 
1 1 1 21 0  10 o 4  105.19  2.21686 196.591     11.6628  196.591     11.6628  20.7915    240         47.4002     60          
1 1 1 21 0  11 o 12 167.996 2.50863 500.777     21.0988  500.777     21.0988  76.6362    120         88.5575     300         
1 1 1 21 0  12 o 13 220.313 2.62791 860.844     28.9956  860.844     28.9956  157.29     180         4.89798     8.71127e-06 
1 1 1 21 0  13 o 9  154.657 2.32881 424.417     18.031   424.417     18.031   43.7921    240         135.222     60          
1 1 1 21 0  14 o 3  237.26  2.87224 998.443     34.1286  998.443     34.1286  171.358    300         1.32254     120         
1 1 1 21 0  15 o 5  443.961 4.03367 3495.24     89.7106  3495.24     89.7106  362.615    180         81.707      180         
1 1 1 21 0  16 o 2  783.967 6.58353 10905.1     258.57   10905.1     258.57   669.423    60          203.457     60          
1 1 1 21 0  17 o 8  568.568 4.77585 5733.27     136.036  5733.27     136.036  443.103    300         63.5219     300         
1 1 1 21 0  18 o 7  88.2818 2.39968 138.72      10.5809  138.72      10.5809  109.703    8.67768e-06 345.194     8.67768e-06 
1 1 1 21 0  19 o 16 218.561 2.58071 847.229     28.2487  847.229     28.2487  72.801     60          170.013     240         
1 1 1 21 0  20 o 18 27.4435 4.71083 15.4861     5.61433  15.4861     5.61433  53.4221    120         115.442     120         
1 1 1 21 0  21 o 6  381.226 3.56443 2577.33     68.0709  2577.33     68.0709  319.896    180         90.4933     180         
1 1 1 21 0  22 o 5  73.2394 2.34873 95.6409     8.58012  95.6409     8.58012  3.16051    240         67.2841     240         
1 1 1 21 0  23 o 1  238.822 2.69095 1011.58     32.1879  1011.58     32.1879  198.713    120         54.1882     120         
1 1 1 21 0  24 o 14 378.156 3.92686 2536.7      74.3816  2536.7      74.3816  273.714    8.06578e-07 4.58099     8.06583e-07 
1 1 1 21 0  25 o 12 441.771 4.40254 3462.38     97.4242  3462.38     97.4242  372.118    240         110.927     240         
1 1 1 21 0  26 o 17 210.869 2.97262 789.052     31.3851  789.052     31.3851  109.979    120         81.9067     300         
1 1 1 21 0  27 o 9  23.2768 5.92684 12.7277     6.33041  12.7277     6.33041  11.6496    8.64979e-06 24.7852     8.64979e-06 
1 1 1 21 0  28 o 9  115.456 2.62517 236.981     15.1535  236.981     15.1535  24.5613    240         10.6369     240         
1 1 1 21 0  29 o 1  69.4071 2.71672 86.1628     9.38284  86.1628     9.38284  9.33567    300         86.0368     300         
1 1 1 21 0  30 o 16 20.9303 5.59864 10.5053     5.50618  10.5053     5.50618  92.8579    180         196.154     180         
1 1 1 21 0  31 o 13 175.582 2.56578 547.096     22.5549  547.096     22.5549  136.506    240         23.9422     240         
1 1 1 21 0  32 o 11 102.24  2.49476 185.921     12.7477  185.921     12.7477  56.4457    120         22.0773     300         
1 1 1 21 0  33 o 4  424.564 4.0708  3198.2      86.5773  3198.2      86.5773  374.463    1.68139e-11 148.041     1.68139e-11 
1 1 1 21 0  34 o 18 103.359 2.40832 189.958     12.4438  189.958     12.4438  62.9592    60          37.4144     60          
1 1 1 21 0  35 o 12 188.55  2.72327 630.94      25.7079  630.94      25.7079  131.857    300         2.13877     120         
1 1 1 21 0  36 o 9  142.34  2.59722 359.833     18.4987  359.833     18.4987  84.5321    4.03398e-07 31.1728     180         
1 1 1 21 0  37 o 14 151.108 2.48084 405.368     18.7636  405.368     18.7636  98.3168    60          15.5304     240         
1 1 1 21 0  38 o 4  31.8029 4.97035 20.3541     6.92779  20.3541     6.92779  13.895     120         35.8011     120         
1 1 1 21 0  39 o 3  44.1492 3.22131 35.647      6.93818  35.647      6.93818  7.78858    2.32467e-05 33.1975     2.32467e-05 
1 1 1 21 0  40 o 8  71.7862 2.66673 92.1028     9.53277  92.1028     9.53277  23.6857    240         28.6829     60          
1 1 1 21 0  41 o 18 156.342 2.54798 433.967     19.9394  433.967     19.9394  159.766    300         107.136     300         
1 1 1 21 0  42 o 7  383.77  4.5747  2615.67     87.9257  2615.67     87.9257  316.314    2.47594e-07 99.5159     2.47594e-07 
1 1 1 21 0  43 o 3  331.574 3.90258 1951.77     64.8069  1951.77     64.8069  296.525    60          133.528     60          
1 1 1 21 0  44 o 4  268.899 3.20158 1283.24     43.1158  1283.24     43.1158  205.161    120         38.5535     120         
1 1 1 21 0  45 o 12 441.305 5.0166  3460.29     110.881  3460.29     110.881  368.157    9.42408e-07 127.685     9.42408e-07 
1 1 1 21 0  46 o 19 60.8146 3.6105  66.9747     10.8185  66.9747     10.8185  13.4485    240         22.9541     60          
1 1 1 21 0  47 o 17 100.207 2.67392 178.791     13.3844  178.791     13.3844  39.0095    300         27.3077     300         
1 1 1 21 0  48 o 1  29.5003 5.56    18.3851     7.10181  18.3851     7.10181  6.28551    180         17.387      180         
1 1 1 21 0  49 o 16 26.2052 6.47643 15.9688     7.69502  15.9688     7.69502  24.1384    240         62.2402     240         
1 1 1 21 0  50 o 18 138.749 2.57512 342.078     17.8777  342.078     17.8777  43.3747    120         102.112     300         
1 1 1 21 0  51 o 9  292.826 3.67937 1523.49     53.9553  1523.49     53.9553  258.397    360         119.317     360         
1 1 1 21 0  52 o 6  143.721 2.91507 367.356     20.9565  367.356     20.9565  118.682    60          42.8372     60          
1 1 1 21 0  53 o 14 239.722 2.97434 1020.66     35.7074  1020.66     35.7074  197.846    300         72.1628     300         
1 1 1 21 0  54 o 3  9.50413 4.52908 -2.77641    6.21666  -2.77641    6.21666  3.55107    180         7.38386     180         
1 1 1 21 0  55 o 4  96.5804 2.593   166.215     12.5091  166.215     12.5091  73.2442    240         17.1432     240         
1 1 1 21 0  56 o 11 79.9749 2.79658 114.36      11.1455  114.36      11.1455  8.74438    300         89.4705     120         
1 1 1 21 0  57 f 0  16.8416 6.1351  7.41961     6.6228   7.41961     6.6228   7.99213    180         0           0           
1 1 1 21 0  58 o 1  73.3404 2.99345 96.5022     10.9175  96.5022     10.9175  18.4014    240         60.6426     60          
1 1 1 21 0  59 o 18 67.5452 3.13523 82.1335     10.5063  82.1335     10.5063  52.5199    300         27.4116     300         
1 1 1 21 0  60 o 18 106.644 2.45253 202.578     13.0759  202.578     13.0759  75.1433    5.82913e-07 9.47406     5.82913e-07 
1 1 1 21 0  61 f 0  40.9577 4.14464 31.6713     8.00294  31.6713     8.00294  24.0888    60          0           0           
1 1 1 21 0  62 o 5  19.5794 7.57846 9.79873     10.6355  9.79873     10.6355  10.6272    300         36.5055     300         
1 1 1 21 0  63 o 1  146.327 2.79997 381.615     20.4983  381.615     20.4983  102.683    4.39779e-11 14.1138     4.39779e-11 
1 1 1 21 0  64 o 17 164.263 3.04796 481.416     25.0515  481.416     25.0515  82.5323    60          48.8776     240         
1 1 1 21 0  65 o 12 148.674 2.82138 394.303     20.9869  394.303     20.9869  100.704    120         8.45932     120         
1 1 1 21 0  66 o 7  23.6199 6.68466 13.9561     7.67495  13.9561     7.67495  2.16487    180         17.6181     8.65146e-06 
1 1 1 21 0  67 o 2  153.531 2.78411 420.731     21.3894  420.731     21.3894  102.794    60          7.78278     60          
1 1 1 21 0  68 o 8  84.6835 3.21937 129.125     13.5717  129.125     13.5717  71.5782    120         34.4595     120         
1 1 1 21 0  69 o 12 58.8395 3.88866 63.6287     11.2231  63.6287     11.2231  24.9793    1.97493e-06 25.2802     180         
1 1 1 21 0  70 o 13 22.4048 7.1192  13.2924     8.54429  13.2924     8.54429  2.21919    240         17.8427     60          
1 1 1 21 0  71 o 7  170.35  2.98149 519.109     25.4177  519.109     25.4177  121.099    300         26.0467     300         
1 1 1 21 0  72 o 7  21.5367 7.04669 12.4627     8.39081  12.4627     8.39081  1.44794    360         21.174      180         
1 1 1 21 0  73 o 19 19.0545 6.89864 9.93535     8.34134  9.93535     8.34134  14.2252    60          51.9608     60          
1 1 1 21 0  74 o 11 35.054  6.0724  26.0286     9.23848  26.0286     9.23848  25.8232    120         9.3741      120         
1 1 1 21 0  75 o 4  21.8431 5.8465  11.7664     6.00273  11.7664     6.00273  8.04584    180         4.73667     2.23156e-05 
1 1 1 21 0  76 o 2  12.9945 6.1458  -2.83366    11.0575  -2.83366    11.0575  1.25721    60          5.82871     60          
1 1 1 21 0  77 o 11 13.7525 6.41134 -1.07517    11.3341  -1.07517    11.3341  3.62259    300         16.2893     300         
1 1 1 21 0  78 o 19 25.1518 8.61748 18.2654     12.6834  18.2654     12.6834  8.76469    4.9419e-06  10.12       180         
1 1 1 21 0  79 o 12 15.5036 6.98794 2.57802     11.9955  2.57802     11.9955  0.00913128 239.999     0.0794558   239.999     
1 1 1 21 0  80 o 9  57.8148 4.72795 63.6212     13.2223  63.6212     13.2223  36.4812    120         2.30828     120         
1 1 1 21 0  81 o 1  56.8378 5.05972 62.1304     13.7928  62.1304     13.7928  42.1786    360         15.2068     360         
1 1 1 21 0  82 o 3  34.0915 8.89172 29.9511     14.0626  29.9511     14.0626  7.99002    60          25.2867     240         
1 1 1 21 0  83 o 16 18.6474 7.85004 8.74222     12.8657  8.74222     12.8657  0.0389367  120         0.0320372   300         
1 1 1 21 0  84 o 17 68.9968 5.36283 92.1092     17.9731  92.1092     17.9731  44.7857    180         6.76627     180         
1 1 1 21 0  85 o 19 28.8796 9.22017 24.8216     14.3338  24.8216     14.3338  11.7485    60          9.09647     240         
1 1 1 21 0  86 o 2  60.1574 8.67581 81.2552     23.1358  81.2552     23.1358  49.2503    300         27.0946     300         
1 1 1 21 0  87 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 1  0  o 16 298.08  3.014   1575.51     45.0025  1575.51     45.0025  277.952    2.13866e-05 120.987     2.13866e-05 
1 1 1 21 1  1  o 8  476.787 4.17111 4014.55     99.6587  4046.24     99.6675  423.776    0.0205395   167.463     0.0205395   
1 1 1 21 1  2  o 15 354.259 3.3844  2221.88     58.9547  2227.24     61.1962  237.978    354.111     25.7397     174.111     
1 1 1 21 1  3  o 7  412.26  3.81607 3041.3      80.2949  2984.79     77.3809  284.144    65.7391     20.2048     245.739     
1 1 1 21 1  4  o 15 262.806 2.87746 1235.29     37.8914  1212.99     37.9001  152.93     8.5789      58.7141     188.579     
1 1 1 21 1  5  o 18 758.261 6.27443 10158.1     233.976  10247.2     242.829  626.91     314.486     155.97      314.486     
1 1 1 21 1  6  o 17 272.449 2.8698  1325.93     39.1866  1305.32     39.1776  187.634    3.33301     1.45919     183.333     
1 1 1 21 1  7  o 15 232.664 2.64114 960.632     30.7861  958.139     30.8039  147.463    315.766     21.2663     135.766     
1 1 1 21 1  8  o 15 259.63  2.8059  1183.36     36.5028  1206.13     36.5107  241.219    191.52      144.813     191.52      
1 1 1 21 1  9  o 15 216.952 2.64772 853.746     28.2093  814.877     29.3165  177.843    349.916     79.4415     349.916     
1 1 1 21 1  10 o 13 244.319 2.62852 1045.75     31.5663  1070.19     32.7993  128.379    159.915     81.5669     339.915     
1 1 1 21 1  11 o 11 329.939 3.34504 1946.68     55.2995  1912.83     55.315   196.052    133.328     74.9134     313.327     
1 1 1 21 1  12 o 6  198.616 2.63107 703.708     24.5207  694.64      27.7354  99.8437    225.529     68.1245     45.5294     
1 1 1 21 1  13 o 19 81.9661 2.31983 116.974     9.46089  121.564     9.55768  12.4281    107.601     96.5354     107.601     
1 1 1 21 1  14 o 4  371.387 3.48254 2415.61     64.7896  2475.08     64.8361  277.434    20.6946     28.6963     20.6945     
1 1 1 21 1  15 o 18 56.8344 2.70482 54.8679     7.87822  60.2197     7.39409  41.7435    154.768     122.559     154.768     
1 1 1 21 1  16 o 6  118.766 2.37027 249.172     13.7762  251.211     14.4058  41.6568    251.761     239.6       251.761     
1 1 1 21 1  17 o 18 314.948 3.0393  1742.65     47.945   1774.18     47.9931  289.76     169.381     143.461     169.381     
1 1 1 21 1  18 o 13 336.506 3.32737 2015.49     53.928   1999.72     58.1968  309.943    229.696     150.578     229.696     
1 1 1 21 1  19 o 6  356.346 3.40888 2225.74     59.7514  2277.3      61.999   233.043    156.014     39.2223     336.014     
1 1 1 21 1  20 o 4  357.755 3.41612 2258.8      60.1198  2279.97     62.3618  254.07     152.694     1.95096     152.693     
1 1 1 21 1  21 o 10 529.649 4.96908 4962.7      129.013  4994.3      134.729  449.066    326.755     142.759     326.755     
1 1 1 21 1  22 o 4  370.902 3.7773  2435.23     68.683   2444.47     71.7106  262.328    20.6012     0.167575    20.6        
1 1 1 21 1  23 o 1  295.648 3.40317 1522.03     49.2372  1578.22     51.6093  161.026    315.414     93.291      135.415     
1 1 1 21 1  24 o 12 110.234 2.56338 206.177     13.873   225.318     14.4078  25.4881    336.462     193.782     336.462     
1 1 1 21 1  25 o 14 112.08  2.57914 219.581     14.2     226.296     14.735   43.289     95.3359     40.3926     275.336     
1 1 1 21 1  26 o 16 683.714 6.44246 8286.11     215.449  8336.05     225.941  526.497    281.478     78.9498     281.478     
1 1 1 21 1  27 o 13 319.021 3.30827 1798.49     51.8374  1811.4      53.9305  219.311    128.719     7.20818     308.719     
1 1 1 21 1  28 o 10 466.721 4.31715 3873.62     98.9423  3858.18     102.96   373.441    192.047     87.9445     192.047     
1 1 1 21 1  29 o 5  256.116 2.86183 1152.16     36.746   1174.09     36.7147  147.156    343.034     61.1911     163.034     
1 1 1 21 1  30 o 10 310.502 3.11231 1715.76     47.5354  1703.84     49.3003  199.603    321.101     35.0579     141.101     
1 1 1 21 1  31 o 13 144.585 2.35302 361.653     16.768   379.646     17.3323  80.7498    187.529     28.4438     7.5288      
1 1 1 21 1  32 o 3  391.351 3.60571 2712.02     69.4126  2722.5      72.0001  248.08     323.225     54.3516     143.225     
1 1 1 21 1  33 o 9  177.32  2.5615  554.697     22.7896  560.297     22.7338  125.567    103.982     11.992      103.982     
1 1 1 21 1  34 o 1  93.6575 2.5128  156.613     11.8019  154.894     11.7432  47.9347    81.0293     18.9713     81.0293     
1 1 1 21 1  35 o 3  84.0828 2.65256 121.344     10.9107  129.964     11.3888  25.4651    180.464     46.9213     0.464202    
1 1 1 21 1  36 o 4  140.503 2.59354 346.396     17.7981  354.223     18.6913  74.4996    194.847     36.3762     14.8472     
1 1 1 21 1  37 o 13 121.226 2.72454 272.605     16.085   249.43      16.9047  91.1328    300.16      50.6424     300.16      
1 1 1 21 1  38 o 13 230.757 3.47858 923.095     40.1145  967.099     40.3277  149.271    252.9       16.9558     72.9        
1 1 1 21 1  39 f 0  374.389 4.27911 2495.13     75.6423  2484.23     84.6529  233.746    165.064     0           0           
1 1 1 21 1  40 f 0  341.741 4.03265 2033.4      68.9824  2114.95     69.127   244.445    326.102     0           0           
1 1 1 21 1  41 o 11 161.219 2.71257 452.168     20.7547  469.946     23.0545  127.202    104.023     46.3369     104.023     
1 1 1 21 1  42 o 13 250.7   3.13578 1140.96     38.4177  1089.8      40.2944  98.8219    82.7289     145.663     262.729     
1 1 1 21 1  43 o 8  339.651 3.70151 2033.07     62.9346  2063.68     63.0728  329.015    276.298     196.209     276.298     
1 1 1 21 1  44 o 13 244.284 3.04939 1053.44     36.3623  1064.41     38.2837  159.857    257.21      11.4146     77.2095     
1 1 1 21 1  45 o 6  675.4   6.92615 8051.21     234.396  8247.73     234.438  521.426    166.751     113.434     166.751     
1 1 1 21 1  46 o 15 234.571 3.02591 965.525     34.6869  987.679     36.449   134.289    286.03      48.5884     106.03      
1 1 1 21 1  47 o 5  169.253 2.57292 492.512     21.3882  524.222     22.2614  104.574    62.776      15.3067     242.776     
1 1 1 21 1  48 o 2  104.923 2.53919 190         13.0713  201.211     13.5938  76.8226    293.721     28.6153     293.721     
1 1 1 21 1  49 o 6  94.547  2.70139 170.681     12.3208  147.586     13.1028  70.6415    74.6569     43.7611     74.6569     
1 1 1 21 1  50 o 6  70.1674 2.90545 98.1104     9.70436  77.9331     10.4307  1.93558    262.241     83.6565     82.2409     
1 1 1 21 1  51 o 18 60.8305 3.21481 69.3886     9.3202   62.9551     10.0641  19.0171    219.794     30.2977     39.7943     
1 1 1 21 1  52 o 15 21.0863 5.16828 10.1185     6.58219  2.7942      7.42122  9.73806    178.753     24.3446     178.753     
1 1 1 21 1  53 o 6  156.371 2.58094 431.278     19.7399  437.355     20.7051  156.409    127.274     116.055     127.274     
1 1 1 21 1  54 o 14 97.4884 2.58608 171.764     11.9418  166.444     13.2254  60.7535    202.647     0.96992     22.647      
1 1 1 21 1  55 o 15 82.8401 2.75877 124.916     10.9727  119.685     11.8288  63.3835    57.9825     34.3157     57.9825     
1 1 1 21 1  56 o 12 25.8867 5.07504 16.4537     6.93868  7.98712     7.17143  13.9698    223.413     45.7086     223.413     
1 1 1 21 1  57 o 2  53.5275 3.27159 56.4276     8.60305  46.7156     8.69865  18.7262    7.96026     21.7328     187.96      
1 1 1 21 1  58 o 1  138.899 2.58988 338.592     18.5812  348.559     17.4025  82.4004    55.079      15.5182     235.079     
1 1 1 21 1  59 o 5  126.061 2.66019 272.332     16.5555  294.326     17.0137  79.3984    156.342     3.23792     336.342     
1 1 1 21 1  60 o 2  83.8387 2.72313 132.815     11.6882  118.406     11.1299  47.37      158.778     10.0268     338.778     
1 1 1 21 1  61 o 12 39.1514 4.5167  29.4262     9.43527  27.1877     7.64323  1.44381    284.28      48.4744     284.28      
1 1 1 21 1  62 o 16 180.485 2.79229 567.848     26.9989  594.948     23.2723  119.711    121.776     4.17894     121.776     
1 1 1 21 1  63 o 1  159.877 2.66623 456.866     22.4509  455.573     20.2164  99.92      201.319     7.59139     21.3187     
1 1 1 21 1  64 o 6  145.558 2.90145 396.351     21.7135  362.639     20.5777  116.465    13.4748     45.6611     13.4748     
1 1 1 21 1  65 o 11 70.7947 3.47181 92.2942     12.1588  88.8489     12.3156  37.2624    292.379     14.1413     112.379     
1 1 1 21 1  66 o 14 15.8334 5.04274 -3.12892    7.22397  -3.85252    9.51162  8.48866    4.36352     27.4682     4.36353     
1 1 1 21 1  67 o 6  67.9552 3.75168 92.925      11.5427  75.4506     13.3886  34.6743    251.539     15.2322     71.539      
1 1 1 21 1  68 o 3  127.514 3.02785 293.934     18.1137  291.086     20.4413  87.2075    300.35      12.4969     300.35      
1 1 1 21 1  69 o 15 26.6068 5.52874 18.1431     8.37321  8.54208     7.85163  4.50658    143.302     17.5891     323.302     
1 1 1 21 1  70 o 9  90.9668 3.03029 134.541     13.9873  164.686     13.3778  56.1414    152.148     1.51725     332.147     
1 1 1 21 1  71 o 8  137.59  2.85207 360.108     20.5214  321.943     18.7801  92.6263    134.287     11.8933     134.287     
1 1 1 21 1  72 o 10 75.6205 3.27922 109.706     12.653   98.2922     12.078   49.9513    179.637     6.49278     179.637     
1 1 1 21 1  73 o 19 87.8048 3.0353  142.492     13.7152  137.084     12.9153  54.3613    356.124     0.231372    176.124     
1 1 1 21 1  74 o 12 52.2149 4.03322 45.3812     10.4456  56.5057     10.1451  36.1666    357.329     10.338      357.329     
1 1 1 21 1  75 o 5  16.0956 5.12089 -6.33009    10.4733  -0.574648   7.08284  0.35257    218.307     4.0149      38.307      
1 1 1 21 1  76 f 0  40.8969 6.00142 39.6972     12.8083  28.2101     11.0472  22.486     156.513     0           0           
1 1 1 21 1  77 f 0  57.1259 4.86244 59.896      14.3777  65.603      12.6728  30.463     148.92      0           0           
1 1 1 21 1  78 f 0  39.5245 6.46718 34.5615     13.3533  30.343      11.7666  12.5755    282.91      0           0           
1 1 1 21 1  79 o 17 26.7363 6.5836  2.97266     12.9816  20.9251     11.0343  7.00678    25.9995     11.7635     206         
1 1 1 21 1  80 o 11 25.4268 6.57502 12.4668     10.8706  11.4656     10.9821  6.88229    289.486     10.6517     109.486     
1 1 1 21 1  81 o 4  51.4758 5.79407 48.0381     14.6716  58.2619     14.021   25.9327    179.795     8.30291     359.795     
1 1 1 21 1  82 o 12 18.7263 5.87658 -12.4997    11.5064  5.22771     11.6633  1.7599     58.8665     1.68201     238.866     
1 1 1 21 1  83 o 1  63.1957 5.48001 84.7671     17.0762  75.2116     16.8552  34.4897    345.443     5.18888     165.443     
1 1 1 21 1  84 o 17 32.3978 7.39164 27.9786     13.5905  19.5129     14.1705  16.5585    359.281     7.27771     359.281     
1 1 1 21 1  85 o 5  31.383  7.39944 14.5834     14.3159  30.5637     14.2084  13.713     160.258     4.22488     160.258     
1 1 1 21 1  86 o 13 24.7017 7.63458 -0.202993   18.5953  13.8097     17.9587  3.47471    331.083     1.88228     151.083     
1 1 1 21 1  87 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 2  0  o 11 525.783 4.49234 4902.38     118.331  4902.38     118.331  413.252    180         58.4101     180         
1 1 1 21 2  1  o 12 308.518 3.07048 1676.36     47.4648  1697.95     47.4798  197.808    252.97      39.8701     72.9701     
1 1 1 21 2  2  o 11 821.799 6.77351 11973.1     273.748  12006       284.086  633.594    252.299     73.1544     252.299     
1 1 1 21 2  3  o 13 164.97  2.4547  491.398     21.0806  473.336     19.5006  32.2144    316.93      157.048     136.93      
1 1 1 21 2  4  o 16 415.822 3.9035  3036.21     81.3352  3095.19     81.3458  271.003    40.3499     54.3326     220.35      
1 1 1 21 2  5  o 5  346.48  3.38746 2133.36     57.7074  2122.84     59.9031  251.342    204.671     11.5331     204.671     
1 1 1 21 2  6  o 12 228.508 2.61352 925.867     29.9354  925.019     29.9218  135.628    59.411      42.387      239.411     
1 1 1 21 2  7  o 12 589.025 4.96092 6145.85     146.433  6162.54     146.445  391.902    201.439     68.132      21.4391     
1 1 1 21 2  8  o 11 330.676 3.14316 1932.64     52.0783  1943.95     52.0953  201.222    80.7574     67.2427     260.757     
1 1 1 21 2  9  o 4  571.048 4.80565 5832.76     137.52   5735.71     137.525  516.931    280.702     212.291     280.702     
1 1 1 21 2  10 o 12 175.907 2.30141 561.591     20.2764  535.358     20.2905  134.051    253.608     66.4838     253.608     
1 1 1 21 2  11 o 7  578.139 5.08844 5898.36     147.416  5961.43     147.435  480.349    300.703     127.839     300.703     
1 1 1 21 2  12 o 1  350.14  3.35531 2179.41     57.7639  2167.52     59.9601  274.289    227.843     52.993      227.843     
1 1 1 21 2  13 o 10 28.722  4.08365 13.6779     5.6596   16.6851     5.6862   21.3593    43.3205     46.415      43.3205     
1 1 1 21 2  14 o 11 171.605 2.35664 524.215     20.2371  519.637     20.2957  16.167     135.845     203.696     315.845     
1 1 1 21 2  15 o 19 275.217 3.14219 1345.58     42.3997  1340.02     44.2524  277.939    162.383     188.353     162.383     
1 1 1 21 2  16 o 8  150.283 2.4843  408.93      17.8252  391.782     19.5142  82.9022    205.827     26.2225     25.8271     
1 1 1 21 2  17 o 14 354.718 3.47511 2257.17     59.3238  2205.06     64.0726  200.673    121.534     104.225     301.534     
1 1 1 21 2  18 o 14 434.276 4.14737 3361.67     90.2458  3328.9      90.2741  353.101    264.529     87.123      264.529     
1 1 1 21 2  19 o 10 726.674 6.70816 9352.67     244.266  9416.49     244.31   535.039    12.4737     24.0525     12.4737     
1 1 1 21 2  20 o 7  756.62  7.32863 10221.9     263.537  10141.2     291.404  555.617    342.866     22.8396     342.866     
1 1 1 21 2  21 o 18 284.655 3.26513 1429.72     46.5509  1443.88     46.6042  170.215    157.714     59.3672     337.714     
1 1 1 21 2  22 o 19 188.383 2.66543 635.7       25.1242  622.583     25.1997  139.752    158.175     32.0983     158.175     
1 1 1 21 2  23 o 19 433.948 4.41666 3322.67     98.2521  3360.83     93.7648  342.624    263.027     69.5619     263.027     
1 1 1 21 2  24 o 13 500.974 4.69763 4478.5      117.904  4431.5      117.97   357.208    96.4839     0.980269    96.4838     
1 1 1 21 2  25 o 17 331.482 3.34236 1937.32     55.4836  1960.19     55.5616  285.571    127.443     108.873     127.443     
1 1 1 21 2  26 o 18 499.902 4.65543 4452.39     111.645  4420.27     121.372  440.491    133.526     172.567     133.526     
1 1 1 21 2  27 o 14 346.812 3.56066 2118.75     56.5071  2148.47     66.8945  191.509    24.1992     106.586     204.199     
1 1 1 21 2  28 o 1  60.4345 2.62745 66.8684     7.42101  63.1566     8.35464  0.126863   168.194     10.143      168.194     
1 1 1 21 2  29 o 14 236.865 2.82372 1006.53     32.076   983.233     34.8663  127.484    188.026     74.5761     8.02616     
1 1 1 21 2  30 o 5  45.9169 3.04851 37.4559     6.46995  37.9849     7.36885  35.1089    212.502     111.367     212.502     
1 1 1 21 2  31 o 5  105.525 2.41    204.72      11.9146  190.661     13.4287  56.4075    195.949     17.762      15.949      
1 1 1 21 2  32 o 8  510.96  4.92252 4633.87     114.002  4642.79     137.049  450.123    141.006     179.604     141.006     
1 1 1 21 2  33 o 14 89.4855 2.57218 147.045     10.9276  137.481     12.0199  34.1958    141.732     37.7776     321.732     
1 1 1 21 2  34 o 3  94.8953 2.74909 152.606     12.8697  167.496     13.2143  40.1041    309.994     34.2492     129.994     
1 1 1 21 2  35 o 17 167.177 2.83413 497.422     23.0409  493.942     24.4221  134.198    88.8587     48.5579     88.8587     
1 1 1 21 2  36 o 1  240.979 3.43893 1020.41     39.2239  1040.58     43.7533  129.781    1.68459     73.4016     181.685     
1 1 1 21 2  37 o 16 51.6298 3.48014 49.4088     9.72824  46.0861     8.02696  12.5481    101.16      69.1268     101.16      
1 1 1 21 2  38 o 14 280.012 3.52217 1336.61     50.5537  1447.69     48.1089  173.713    92.8477     39.3978     272.848     
1 1 1 21 2  39 f 0  348.664 3.77898 2120.79     65.9925  2196.19     66.0537  224.473    341.92      0           0           
1 1 1 21 2  40 o 15 98.9797 2.73619 176.637     13.4678  171.463     13.6195  55.2271    110.328     26.6958     110.328     
1 1 1 21 2  41 o 13 194.348 2.70809 649.049     25.1193  691.247     27.6318  150.944    304.9       42.7388     304.9       
1 1 1 21 2  42 o 15 178.043 2.66014 536.964     22.5753  588.163     24.9066  142.155    190.757     50.0837     190.757     
1 1 1 21 2  43 o 6  177.75  2.65338 558.914     23.0894  562         24.1725  96.5474    6.61037     45.3436     186.61      
1 1 1 21 2  44 o 1  288.162 3.26736 1446.23     47.1525  1502.02     47.2033  215.308    175.14      37.8774     175.14      
1 1 1 21 2  45 o 8  417.786 4.36611 3030.17     91.2825  3178.06     91.5102  310.267    339.308     47.415      339.308     
1 1 1 21 2  46 o 7  261.162 3.25927 1176.54     44.509   1246.16     40.5734  193.149    99.422      32.3126     99.422      
1 1 1 21 2  47 o 1  155.653 2.56576 442.574     20.3393  417.436     19.6897  88.6679    290.842     29.4631     110.842     
1 1 1 21 2  48 o 9  139.266 2.46792 350.723     17.116   337.876     17.3087  100.641    188.861     19.4706     188.861     
1 1 1 21 2  49 o 8  279.715 3.20817 1411.13     42.0071  1369.27     47.6619  227.547    272.374     77.1093     272.374     
1 1 1 21 2  50 o 10 59.84   3.2286  61.5138     9.075    66.5617     10.1437  22.7629    80.4498     18.2382     260.45      
1 1 1 21 2  51 o 13 112.531 2.69837 227.004     14.9626  223.353     15.4197  89.975     179.852     39.256      179.852     
1 1 1 21 2  52 o 11 147.755 2.63143 394.594     18.6463  381.343     20.2387  97.4866    2.45391     0.57554     2.45389     
1 1 1 21 2  53 o 14 76.7407 2.94966 107.937     10.7938  102.151     11.7524  29.3075    8.36993     36.7498     188.37      
1 1 1 21 2  54 o 5  132.707 2.54639 328.081     16.5522  298.653     17.2189  77.2559    129.026     19.1829     309.026     
1 1 1 21 2  55 o 4  57.3822 3.19495 63.1146     8.91652  55.0347     9.24589  30.1017    191.769     3.41628     191.769     
1 1 1 21 2  56 o 10 66.2627 2.93051 81.1432     9.53845  75.8665     9.80626  30.2969    182.008     18.5176     2.00842     
1 1 1 21 2  57 o 1  160.394 2.51664 452.526     20.1277  462.857     20.3296  118.386    279.056     27.3562     279.056     
1 1 1 21 2  58 o 2  165.863 2.62235 494.29      21.8471  485.311     21.7468  114.927    257.588     13.2238     257.588     
1 1 1 21 2  59 o 8  20.746  4.52174 14.29       6.18115  -5.0395     7.10272  8.22747    61.0279     24.9007     61.0279     
1 1 1 21 2  60 o 7  164.544 2.54246 479.795     21.3712  484.801     20.5459  115.019    213.219     15.1629     213.219     
1 1 1 21 2  61 o 14 62.0928 3.09027 66.0805     9.59693  72.4701     9.48967  27.0334    8.33222     23.8663     188.332     
1 1 1 21 2  62 o 16 189.309 3.07312 627.968     31.4175  654.707     26.5361  136.593    283.073     26.1755     283.073     
1 1 1 21 2  63 o 18 83.7262 2.87549 130.117     12.6946  121.262     11.3618  56.3553    319.725     6.68361     319.725     
1 1 1 21 2  64 o 10 76.2289 2.86635 106.178     11.4669  102.421     10.3415  60.3437    268.571     26.2515     268.571     
1 1 1 21 2  65 o 5  70.891  3.01112 97.3069     11.7519  83.8558     9.54773  32.2619    294.123     24.8151     114.123     
1 1 1 21 2  66 o 12 40.4858 4.50048 25.609      9.60464  35.7914     7.34406  24.5241    229.721     6.00212     229.721     
1 1 1 21 2  67 o 6  22.479  5.4612  13.054      7.97928  3.21422     7.67687  2.19568    230.541     4.35305     50.5414     
1 1 1 21 2  68 o 3  72.022  3.31684 91.8573     12.0789  95.9719     11.7171  52.7618    55.1265     16.7808     55.1265     
1 1 1 21 2  69 o 5  27.1071 5.7039  12.2025     8.48995  15.7044     8.25083  8.81746    60.1125     2.91098     240.112     
1 1 1 21 2  70 o 14 96.9931 3.08391 176.892     15.7223  163.04      14.1849  51.8079    343.953     18.499      163.953     
1 1 1 21 2  71 o 7  53.6309 4.39463 62.4707     10.5195  45.2137     11.9854  30.3671    298.911     4.3557      118.911     
1 1 1 21 2  72 o 16 30.7975 6.02905 20.0817     9.05851  17.2819     10.2981  6.72769    202.645     21.7258     22.6448     
1 1 1 21 2  73 o 5  59.2733 4.60247 71.6304     13.2926  60.8557     13.4848  39.1615    100.512     6.45308     100.512     
1 1 1 21 2  74 o 4  48.3882 4.21993 34.1168     9.45134  55.1231     10.2211  14.4235    19.3228     29.9146     199.323     
1 1 1 21 2  75 o 4  30.7526 6.41927 16.3962     11.7635  21.7374     9.78147  12.1641    258.35      9.13393     78.35       
1 1 1 21 2  76 o 15 27.1294 6.82482 18.1157     12.2816  9.86371     11.3492  11.0379    267.543     2.19011     267.543     
1 1 1 21 2  77 o 11 39.1957 6.98764 25.0628     13.6826  40.462      14.1908  20.44      223.864     2.76512     43.8643     
1 1 1 21 2  78 o 17 20.3022 5.9379  -5.63671    9.63378  10.6207     11.1858  3.66167    19.2616     26.9146     19.2616     
1 1 1 21 2  79 o 12 22.4745 6.37368 2.77183     10.6934  10.5395     11.4592  4.09259    135.152     1.85658     315.152     
1 1 1 21 2  80 o 13 48.7167 5.78889 35.5301     12.9206  61.1745     13.9841  24.9488    6.57911     6.84774     186.579     
1 1 1 21 2  81 o 1  69.2439 4.81461 92.2451     15.9462  92.8207     17.0139  48.2725    265.343     14.5334     265.343     
1 1 1 21 2  82 o 18 37.1246 6.95559 37.9447     13.1243  22.0999     14.0297  15.8278    194.665     9.77424     14.6651     
1 1 1 21 2  83 f 0  26.7335 7.29028 7.4864      13.0642  19.9265     14.9988  5.53591    102.851     0           0           
1 1 1 21 2  84 o 7  27.7331 7.4288  10.1262     13.0572  22.8154     15.6123  10.3724    313.061     2.81472     133.061     
1 1 1 21 2  85 o 14 23.1233 7.23203 6.25439     17.971   3.08444     14.9753  3.5119     158.766     10.1822     338.766     
1 1 1 21 2  86 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 3  0  o 14 267.898 2.84068 1272.72     38.1182  1272.72     38.1182  140.971    6.81724e-06 109.768     180         
1 1 1 21 3  1  o 16 330.082 3.25545 1939.23     52.8482  1923.72     54.827   233.752    323.561     1.4555      143.56      
1 1 1 21 3  2  o 2  387.637 3.59937 2704.72     71.2334  2623.73     68.6132  364.611    61.7804     179.857     61.7804     
1 1 1 21 3  3  o 16 393.184 3.45855 2702.38     68.1356  2779.37     68.1495  347.042    270.764     134.277     270.764     
1 1 1 21 3  4  f 0  486.002 4.22673 4191.62     102.941  4185.86     102.948  311.715    199.64      0           0           
1 1 1 21 3  5  o 3  566.507 4.9466  5744.9      145.783  5642.04     134.965  392.593    96.9652     35.3215     276.965     
1 1 1 21 3  6  o 11 279.358 2.88072 1386.06     39.555   1380.59     41.0863  188.793    314.152     15.2876     134.152     
1 1 1 21 3  7  o 16 431.227 3.85169 3281.48     83.2284  3313.27     83.2445  421.608    66.7046     229.332     66.7046     
1 1 1 21 3  8  o 13 228.595 2.63214 920.973     30.1514  931.464     30.1545  183.195    222.603     56.9857     222.603     
1 1 1 21 3  9  o 6  351.744 3.29793 2218.08     58.1301  2168.98     58.1321  245.336    67.8088     11.1254     247.809     
1 1 1 21 3  10 o 12 452.575 4.06248 3638.71     90.4118  3626.19     93.8278  369.65     110.621     89.521      110.621     
1 1 1 21 3  11 o 2  561.995 4.91327 5597.83     138.369  5609.87     138.385  417.319    114.554     22.6404     114.554     
1 1 1 21 3  12 o 6  254.427 2.77524 1145.28     34.7097  1149.66     36.0508  182.811    105.615     10.8962     105.615     
1 1 1 21 3  13 o 14 365.479 3.45216 2382.85     62.0328  2354.03     64.3867  298.616    281.072     77.1007     281.072     
1 1 1 21 3  14 o 13 300.414 3.14013 1613.71     49.0744  1586.41     45.4332  130.174    310.359     167.847     130.359     
1 1 1 21 3  15 o 1  219.002 2.93186 855.973     32.991   844.584     31.3529  100.723    351.941     104.085     171.941     
1 1 1 21 3  16 o 8  399.197 4.04836 2770.78     82.6721  2883.1      79.1745  312.385    77.6126     55.1367     77.6126     
1 1 1 21 3  17 o 6  370.633 4.06608 2473.5      79.2675  2400.27     71.6892  247.588    339.375     33.3977     159.375     
1 1 1 21 3  18 o 6  270.198 3.07933 1301.02     43.5559  1287.87     39.7691  248.867    76.6519     127.339     76.6519     
1 1 1 21 3  19 o 19 396.614 4.00021 2793.32     79.4889  2787.68     79.5271  300.143    232.354     35.5908     232.354     
1 1 1 21 3  20 o 1  110.344 2.58276 215.918     13.881   216.241     14.6342  49.3635    198.054     14.335      18.0542     
1 1 1 21 3  21 o 12 484.937 4.5682  4182.33     106.25   4165.24     115.568  328.992    353.615     35.7478     173.615     
1 1 1 21 3  22 o 14 255.779 2.90016 1148.84     36.3935  1171.2      37.952   162.133    192.94      32.0794     12.9404     
1 1 1 21 3  23 o 15 467.015 4.26562 3880.54     97.7809  3860.5      101.833  412.998    151.288     162.532     151.288     
1 1 1 21 3  24 o 3  345.564 3.43492 2127.41     55.7764  2108.66     62.9434  218.004    315.293     53.0851     135.293     
1 1 1 21 3  25 o 10 180.634 2.46484 562.945     21.7651  594.152     22.8639  138.624    324.252     39.239      324.252     
1 1 1 21 3  26 o 19 503.004 4.60065 4461.84     113.593  4522.18     118.33   399.974    272.667     84.1071     272.667     
1 1 1 21 3  27 o 10 273.392 3.05959 1312.72     38.2188  1338.39     45.3782  148.196    283.691     88.01       103.691     
1 1 1 21 3  28 o 8  301.587 3.1983  1636.71     47.3037  1589.91     49.3153  193.107    234.942     38.5359     54.9418     
1 1 1 21 3  29 o 16 140.682 2.52614 348.83      16.9958  353.225     18.5803  98.6777    41.1174     13.3511     41.1174     
1 1 1 21 3  30 o 16 232.274 2.97172 941.245     34.5917  972.576     34.5841  122.929    231.21      78.7519     51.2105     
1 1 1 21 3  31 o 3  19.3805 4.42817 11.6771     5.81579  -2.17829    5.80853  27.8864    233.039     60.3197     233.039     
1 1 1 21 3  32 o 2  377.848 3.89457 2521.52     73.7441  2546.81     73.7461  300.398    256.742     69.572      256.742     
1 1 1 21 3  33 o 3  268.533 3.43326 1262.58     47.3824  1296.54     44.9519  184.792    353.356     4.25388     173.355     
1 1 1 21 3  34 o 5  214.305 3.10687 800.764     30.6782  828.837     35.9308  190.566    139.788     91.521      139.788     
1 1 1 21 3  35 f 0  354.176 3.81284 2219.82     69.2488  2233.86     66.0526  246.257    168.951     0           0           
1 1 1 21 3  36 o 2  156.948 2.59478 429.243     19.526   444.52      21.2799  142.873    117.86      93.4482     117.86      
1 1 1 21 3  37 o 1  33.3466 4.15986 21.9547     6.41702  18.7565     6.92469  37.9507    335.466     98.0671     335.466     
1 1 1 21 3  38 o 1  169.958 2.72113 519.379     22.5809  505.374     23.7388  99.9628    325.377     28.5641     145.377     
1 1 1 21 3  39 o 15 49.8127 3.32144 42.403      8.14316  46.4974     8.23275  13.8132    295.495     69.6789     295.495     
1 1 1 21 3  40 o 14 160.255 2.55321 453.193     20.5396  457.788     20.4694  114.752    351.894     18.6594     351.894     
1 1 1 21 3  41 o 15 194.772 2.72603 677.99      27.2011  667.93      26.0099  114.617    189.897     34.4977     9.89678     
1 1 1 21 3  42 o 6  167.986 2.44569 483.623     20.1299  517.656     21.0512  67.4016    20.8305     91.8295     200.831     
1 1 1 21 3  43 o 6  357.935 3.73144 2247.3      66.882   2304.12     66.9775  206.326    152.286     80.7938     332.286     
1 1 1 21 3  44 o 1  412.009 4.08142 2969.04     80.3374  3065.94     88.1319  333.986    22.6285     101.355     22.6285     
1 1 1 21 3  45 o 17 177.752 2.63719 553.967     22.8916  567.335     24.0884  134.729    158.716     32.8885     158.716     
1 1 1 21 3  46 o 17 132.021 2.58307 302.978     16.585   316.145     17.5629  113.5      198.959     61.3614     198.959     
1 1 1 21 3  47 o 9  185.705 2.78761 613.512     25.8723  610.926     26.0126  145.41     14.9443     42.3433     14.9443     
1 1 1 21 3  48 o 1  101.828 2.79542 191.225     13.4412  177.673     14.9242  78.689     245.236     32.988      245.236     
1 1 1 21 3  49 o 19 63.3751 3.15398 77.5797     9.55585  66.1148     10.2275  28.7767    42.2038     10.9112     222.204     
1 1 1 21 3  50 o 2  35.7619 4.78594 20.375      7.83232  26.9928     8.70495  1.82963    39.5101     22.4829     39.5101     
1 1 1 21 3  51 o 7  79      2.96207 118.401     11.0691  104.321     12.1641  44.4409    119.712     6.87455     299.712     
1 1 1 21 3  52 o 8  126.349 2.68274 295.218     15.4046  272.897     18.2712  96.7283    97.1222     30.1406     97.1222     
1 1 1 21 3  53 o 8  75.4875 3.16548 105.353     11.1408  98.2768     12.5893  32.1204    97.8672     29.5186     277.867     
1 1 1 21 3  54 o 14 141.294 2.76176 367.894     17.0804  342.894     21.5582  90.7291    215.027     4.28871     35.027      
1 1 1 21 3  55 o 3  72.8533 3.02214 95.6651     10.2405  94.0533     11.6669  44.6157    54.9705     2.52026     54.9704     
1 1 1 21 3  56 o 14 43.3953 3.86944 30.2008     7.69977  38.4593     8.7561   4.73798    162.543     58.7648     162.543     
1 1 1 21 3  57 o 9  54.9313 3.35372 58.0095     8.53236  50.6684     9.59672  26.5255    228.767     4.7149      48.7667     
1 1 1 21 3  58 o 4  186.848 2.74542 604.773     24.4455  639.71      26.9626  141.154    358.286     36.8167     358.286     
1 1 1 21 3  59 o 19 77.5245 3.04296 105.011     10.6019  110.276     12.8839  66.0437    225.931     41.5025     225.931     
1 1 1 21 3  60 o 2  76.5951 3.0996  108.875     10.8677  101.563     12.675   48.0188    15.2784     1.09453     195.278     
1 1 1 21 3  61 o 19 167.197 2.60125 492.218     20.7149  505.221     22.8484  100.875    160.87      17.2662     340.87      
1 1 1 21 3  62 o 10 95.3134 3.29622 151.751     17.4529  175.209     13.25    64.3936    85.9123     6.57449     85.9123     
1 1 1 21 3  63 o 6  153.343 2.76667 459.939     20.4312  383.171     21.7804  97.7694    170.305     3.7244      350.305     
1 1 1 21 3  64 f 0  104.177 2.67151 203.058     14.0803  185.915     13.7596  61.0707    185.299     0           0           
1 1 1 21 3  65 o 12 84.2157 2.925   130.951     12.7344  124.119     11.8805  39.6329    68.5205     28.0509     248.521     
1 1 1 21 3  66 o 12 65.7459 3.12508 83.4966     10.5072  72.8196     9.95938  40.8748    61.6651     0.115898    61.6653     
1 1 1 21 3  67 o 8  59.4659 3.4178  68.9377     10.2042  59.675      9.96319  36.0528    99.1175     0.880595    279.117     
1 1 1 21 3  68 o 8  26.3464 5.05009 9.32617     8.05473  16.4332     6.18131  5.95222    143.852     13.9355     323.852     
1 1 1 21 3  69 o 1  40.6561 4.74792 29.3533     8.74125  33.05       9.93841  28.133     23.8156     16.1287     23.8156     
1 1 1 21 3  70 f 0  67.256  3.56984 70.6197     12.1032  95.3889     11.4234  44.9678    107.58      0           0           
1 1 1 21 3  71 o 1  41.0632 4.85245 39.0146     9.86829  25.8361     9.25705  18.9848    38.0721     10.847      218.072     
1 1 1 21 3  72 f 0  27.2421 6.15525 22.0547     11.0829  6.60223     8.80614  20.921     94.5711     0           0           
1 1 1 21 3  73 o 15 28.2684 5.73947 28.9885     10.6709  -1.43608    10.3427  7.73383    213.616     15.9675     33.616      
1 1 1 21 3  74 o 3  35.8677 6.17286 30.5186     12.2525  22.1632     9.77877  23.6863    348.22      10.8631     348.22      
1 1 1 21 3  75 o 3  64.7303 4.4568  80.6773     14.7489  78.0735     13.7941  31.4772    51.9087     16.1326     231.909     
1 1 1 21 3  76 o 6  23.9305 6.35659 9.75873     10.0958  9.85562     10.573   1.73346    264.969     21.35       84.9687     
1 1 1 21 3  77 o 14 27.084  6.27149 21.6398     10.4809  6.0616      10.6659  10.4831    1.48579     0.0902288   181.486     
1 1 1 21 3  78 o 10 50.1972 5.24786 54.5283     12.6446  44.7728     12.8174  32.4047    162.755     7.06626     162.754     
1 1 1 21 3  79 o 17 22.4378 6.39085 4.53399     10.2302  9.13397     11.8666  5.58654    323.062     2.1887      143.062     
1 1 1 21 3  80 o 13 46.7414 6.54698 42.1033     14.5914  48.8689     14.996   30.8871    100.819     8.51126     100.819     
1 1 1 21 3  81 o 11 77.9866 4.65768 122.934     17.0617  111.437     18.7859  52.7962    62.3451     12.4372     62.345      
1 1 1 21 3  82 o 13 19.4866 6.17566 -5.14853    11.007   2.90887     13.7844  3.25082    132.036     3.18265     312.036     
1 1 1 21 3  83 o 14 24.5569 7.12565 8.02784     12.3782  11.9111     15.6163  4.60541    43.4839     0.334169    43.484      
1 1 1 21 3  84 o 9  19.2236 6.27032 -17.7101    16.2718  2.18781     13.3654  0.140678   45.2579     0.472184    225.258     
1 1 1 21 3  85 o 17 24.2621 7.39763 2.89643     18.504   11.7004     15.0115  4.26802    13.3153     8.94584     193.315     
1 1 1 21 3  86 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 4  0  o 10 403.287 3.66086 2884.21     73.9601  2884.21     73.9601  476.632    180         363.029     180         
1 1 1 21 4  1  o 12 327.695 3.25947 1898.25     52.53    1909.36     54.5123  254.559    252.667     42.7615     252.667     
1 1 1 21 4  2  o 10 271.706 2.98261 1306.77     40.615   1310.62     40.6093  172.248    52.1785     39.9241     232.179     
1 1 1 21 4  3  o 7  246.823 2.80375 1087.32     34.68    1072.52     34.6797  155.505    146.744     35.5217     326.744     
1 1 1 21 4  4  o 6  181.629 2.43402 584.491     22.1561  584.921     22.1538  107.275    334.765     30.6517     154.765     
1 1 1 21 4  5  o 3  511.222 4.46676 4663.78     112.294  4608.43     116.511  448.771    164.367     159.178     164.367     
1 1 1 21 4  6  o 9  219.021 2.58553 858.487     29.4679  842.119     27.2665  164.346    217.027     28.573      217.027     
1 1 1 21 4  7  o 1  145.173 2.39178 381.562     16.9665  365.606     17.8011  52.8486    300.53      86.9101     120.53      
1 1 1 21 4  8  o 2  236.696 2.65574 996.524     30.905   989.656     32.0833  206.324    294.483     89.6992     294.483     
1 1 1 21 4  9  o 1  389.897 3.66373 2668.82     72.8812  2722.93     70.2362  324.583    231.841     90.8868     231.841     
1 1 1 21 4  10 o 14 289.275 2.985   1479.82     44.0564  1487.21     42.4707  229.072    112.98      50.4946     112.98      
1 1 1 21 4  11 o 4  353.884 3.82393 2201        66.159   2241.23     69.4584  242.482    228.1       21.5058     48.1001     
1 1 1 21 4  12 o 17 549.897 5.27328 5357.51     145.316  5378.4      145.322  362.395    248.365     70.9443     68.3653     
1 1 1 21 4  13 o 8  329.216 3.57654 1932.17     59.0075  1912.01     59.0056  278.515    195.884     91.0885     195.884     
1 1 1 21 4  14 o 7  572.52  5.65705 5821.11     162.3    5821.17     162.317  414.608    253.48      1.9372      253.48      
1 1 1 21 4  15 o 12 424.193 4.46501 3205.48     94.9391  3180.45     94.8948  238.138    57.333      133.969     237.333     
1 1 1 21 4  16 o 5  383.172 4.07227 2579.5      80.0178  2630.05     76.2897  331.688    155.009     118.27      155.009     
1 1 1 21 4  17 f 0  346.967 3.82257 2127.57     61.5353  2143.43     71.0878  244.764    124.124     0           0           
1 1 1 21 4  18 o 16 410.977 4.01761 2976.76     82.7473  3016.5      82.7416  292.458    39.0213     2.87946     219.021     
1 1 1 21 4  19 o 9  250.283 2.79417 1104.99     35.0209  1116.26     35.0716  203.831    98.1956     62.5948     98.1956     
1 1 1 21 4  20 o 18 278.585 3.01755 1383.24     42.123   1369.15     42.1326  112.512    24.1327     169.609     204.133     
1 1 1 21 4  21 o 5  278.964 3.0103  1384.08     42.0619  1375.84     42.1059  200.206    113.757     9.15244     113.757     
1 1 1 21 4  22 o 2  360.941 3.57547 2326.18     65.9574  2295.84     63.3798  279.369    41.8199     46.7663     41.82       
1 1 1 21 4  23 o 3  351.862 3.38632 2189.59     60.789   2202.39     58.6081  207.542    294.919     85.565      114.919     
1 1 1 21 4  24 o 1  78.7593 2.53667 104.954     9.73325  115.578     10.2389  8.80172    266.82      66.8778     86.8199     
1 1 1 21 4  25 o 16 54.9265 2.8527  58.4794     7.53181  49.2911     7.96915  4.78614    359.645     38.2841     359.645     
1 1 1 21 4  26 o 7  373.741 3.89513 2472.58     72.9563  2484.99     72.9528  227.724    28.6552     76.3288     208.655     
1 1 1 21 4  27 o 5  354.09  3.82568 2213.94     69.4765  2236.03     66.2398  252.208    194.569     2.06566     194.569     
1 1 1 21 4  28 o 2  587.81  5.54114 6141.25     163.225  6144.7      163.233  428.725    92.5807     18.8679     92.5807     
1 1 1 21 4  29 o 6  154.09  2.69287 425.586     20.2897  416.803     21.258   105.188    153.498     3.60461     153.498     
1 1 1 21 4  30 f 0  125.524 2.5896  288.253     15.8865  271.137     16.616   61.3157    79.757      0           0           
1 1 1 21 4  31 o 3  131.309 2.6803  289.376     17.5245  323.129     17.6813  79.8829    249         12.1576     69.0004     
1 1 1 21 4  32 o 16 69.7945 2.88026 84.0221     10.0735  89.409      9.97631  5.63639    309.364     66.3756     129.364     
1 1 1 21 4  33 o 4  195.52  2.65167 663.005     25.2827  693.066     26.6836  153.853    141.686     42.3636     141.686     
1 1 1 21 4  34 f 0  163.324 2.72148 467.093     20.4149  479.451     24.0118  104.961    357.296     0           0           
1 1 1 21 4  35 o 11 319.424 3.47488 1781.81     52.9764  1840.17     58.2226  222.083    70.2194     1.85104     250.219     
1 1 1 21 4  36 o 10 170.263 2.56792 509.307     20.9646  518.978     22.8337  73.8918    104.935     84.2714     284.935     
1 1 1 21 4  37 o 15 187.455 2.69009 611.818     23.533   634.837     26.9499  134.637    318.577     16.2055     318.577     
1 1 1 21 4  38 o 9  130.621 2.5238  288.438     16.0508  317.558     16.9622  87.0177    127.653     7.03087     127.653     
1 1 1 21 4  39 o 8  102.571 2.51085 188.64      12.3383  185.005     13.4017  25.1271    310.697     81.7071     130.697     
1 1 1 21 4  40 o 17 172.207 2.69422 520.919     22.226   531.231     24.2504  100.743    217.969     30.5232     37.9693     
1 1 1 21 4  41 o 1  195.618 2.72029 673.074     26.0852  684.695     27.2457  104.24     344.677     57.7726     164.677     
1 1 1 21 4  42 o 13 174.306 2.64313 534.867     23.0987  543.178     23.0767  87.9802    167.311     59.5806     347.311     
1 1 1 21 4  43 o 17 225.959 2.93125 891.501     31.6238  920.983     34.7324  136.086    349.971     36.2576     169.971     
1 1 1 21 4  44 o 10 227.468 2.87804 870.627     32.004   967.471     33.6082  157.035    160.925     4.38634     160.925     
1 1 1 21 4  45 o 15 139.266 2.4828  341.43      16.5202  347.107     18.0953  107.755    334.686     33.7582     334.686     
1 1 1 21 4  46 o 3  144.323 2.55995 368.769     17.6673  370.831     19.313   98.4588    338.66      5.18294     338.66      
1 1 1 21 4  47 o 18 34.4834 4.72826 25.1097     7.55308  18.8553     8.13503  7.63022    4.8799      38.1455     4.8799      
1 1 1 21 4  48 o 18 174.603 2.72744 543.897     22.5482  538.969     25.1014  124.081    101.665     14.0895     101.665     
1 1 1 21 4  49 o 6  228.841 3.13149 947.786     33.9014  914.402     37.7414  167.958    241.193     26.7117     241.193     
1 1 1 21 4  50 o 19 228.024 2.91492 893.973     31.0399  955.019     35.5469  179.045    33.1257     51.044      33.1257     
1 1 1 21 4  51 o 8  33.4506 4.89834 18.1111     7.20792  23.5707     8.70376  18.1701    313.155     69.5068     313.155     
1 1 1 21 4  52 o 12 69.4488 2.91632 81.7172     9.5884   90.5941     10.6267  39.4235    324.777     24.81       324.777     
1 1 1 21 4  53 o 8  160.526 2.60577 482.791     20.5903  434.241     21.2496  123.346    342.272     34.4534     342.272     
1 1 1 21 4  54 o 19 19.8502 5.216   3.80228     6.45532  7.1833      7.44281  10.4463    180.797     27.4829     180.797     
1 1 1 21 4  55 o 4  127.96  2.56924 292.572     15.4585  290.611     17.3938  92.3999    187.222     18.4664     187.222     
1 1 1 21 4  56 o 9  101.9   2.71324 182.984     13.2276  187.42      14.4202  59.3111    168.117     12.111      348.117     
1 1 1 21 4  57 o 19 77.1937 2.94631 103.816     10.7901  109.386     11.9161  7.99508    40.9692     83.2609     220.969     
1 1 1 21 4  58 o 14 45.5285 3.99974 40.7045     8.01109  34.9257     9.55916  16.9829    343.261     17.5548     163.261     
1 1 1 21 4  59 o 11 139.799 2.53225 352.036     16.9319  344.839     18.4789  92.8565    346.6       2.16881     346.6       
1 1 1 21 4  60 o 19 56.0631 3.48832 59.2817     8.81105  54.3536     10.4149  29.0667    185.747     11.3601     5.7466      
1 1 1 21 4  61 f 0  18.3027 4.97909 7.5192      7.00671  -0.445737   6.43667  4.91132    139.913     0           0           
1 1 1 21 4  62 o 8  36.7621 5.44776 17.985      11.1919  33.3821     8.15033  11.1377    149.339     19.8948     329.339     
1 1 1 21 4  63 o 19 53.3366 3.34485 47.5408     8.57076  55.7131     9.11575  37.2871    20.1417     11.1331     20.1417     
1 1 1 21 4  64 o 3  125.598 2.58867 287.686     16.5007  277.259     16.053   97.8089    341.826     33.8476     341.826     
1 1 1 21 4  65 o 7  101.023 2.67861 193.441     13.9746  172.969     13.1021  50.9117    266.905     27.9081     86.9048     
1 1 1 21 4  66 o 2  49.4541 3.63762 47.7773     9.31644  41.7261     8.45768  37.543     272.445     19.0657     272.445     
1 1 1 21 4  67 o 15 97.2625 2.69073 189.346     13.5091  151.517     12.63    61.2168    326.706     1.21142     146.706     
1 1 1 21 4  68 o 10 107.033 2.63536 207.422     15.1183  204.094     13.0456  77.0221    218.904     18.2207     218.904     
1 1 1 21 4  69 o 8  89.2709 2.75325 155.485     12.4958  132.055     12.0488  54.1603    158.98      4.41077     338.98      
1 1 1 21 4  70 o 2  53.4767 3.5079  52.23       10.0216  52.6029     8.47769  28.1253    198.555     9.54083     18.5546     
1 1 1 21 4  71 o 18 67.8581 3.8984  80.2344     14.0501  89.9109     11.9466  46.36      271.24      8.79425     271.24      
1 1 1 21 4  72 o 8  68.7247 3.89989 95.0082     14.6422  80.3501     12.011   45.7499    328.779     6.60125     328.779     
1 1 1 21 4  73 f 0  22.9113 5.9667  -3.31767    12.0215  14.2512     8.78239  6.31566    269.258     0           0           
1 1 1 21 4  74 o 5  32.9413 6.13211 22.3765     10.7114  22.0212     9.81622  14.8433    213.623     6.94701     33.623      
1 1 1 21 4  75 o 13 31.4782 6.71486 17.0267     13.0626  23.5258     10.4962  13.1453    121.318     7.38681     121.318     
1 1 1 21 4  76 o 19 65.3929 4.51139 93.2758     13.4997  70.2938     15.0428  37.4144    119.541     4.31846     299.541     
1 1 1 21 4  77 o 6  52.289  5.39123 46.684      12.9948  61.8738     14.369   34.5643    238.514     8.50047     238.514     
1 1 1 21 4  78 f 0  79.0565 4.20958 114.048     15.8478  122.064     17.264   37.8021    359.74      0           0           
1 1 1 21 4  79 o 15 26.5436 7.13903 18.215      11.9209  0.947115    17.1808  9.12732    188.17      8.63035     8.17008     
1 1 1 21 4  80 o 14 58.8492 5.26637 72.2988     15.3894  64.4904     14.9545  37.0978    341.159     4.55361     341.159     
1 1 1 21 4  81 o 19 43.7874 6.89252 47.5898     14.507   35.7028     15.0729  25.2643    305.208     0.824915    305.208     
1 1 1 21 4  82 o 17 22.0836 6.5288  9.66177     11.9636  0.873874    12.7342  5.42823    241.358     5.19083     61.3583     
1 1 1 21 4  83 o 13 23.7206 6.74867 -4.21356    12.0333  20.032      14.3817  4.8074     232.72      1.44898     52.7202     
1 1 1 21 4  84 o 8  24.2832 8.25824 3.96278     40.053   -3.21225    14.7643  3.12296    276.656     1.9785      96.6559     
1 1 1 21 4  85 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 5  0  o 7  364.76  3.65049 2359.85     66.6995  2359.85     66.6995  161.13     4.65744e-06 212.144     180         
1 1 1 21 5  1  o 10 186.761 2.47795 605.038     23.1857  631.611     23.1903  155.699    224.421     69.3736     224.421     
1 1 1 21 5  2  o 19 84.048  2.40222 127.855     9.87482  122.999     10.3037  26.4361    241.701     153.272     241.701     
1 1 1 21 5  3  o 19 395.952 3.84825 2802.97     74.805   2758.33     77.8564  283.54     25.4786     3.9732      205.479     
1 1 1 21 5  4  o 15 247.855 2.94947 1085.89     36.6359  1092.33     36.6349  144.173    220.895     62.1135     40.8946     
1 1 1 21 5  5  o 15 434.796 4.19351 3371.06     91.3634  3336.27     91.3828  342.015    325.172     56.3932     325.172     
1 1 1 21 5  6  o 16 339.365 3.47707 2038.69     59.1258  2045.91     59.1429  254.09     0.132518    22.5078     0.132517    
1 1 1 21 5  7  o 9  491.137 4.89883 4313.78     123.423  4248.71     117.696  411.023    73.9124     111.959     73.9124     
1 1 1 21 5  8  o 1  253.296 3.14976 1141.83     40.9103  1133.35     39.0385  222.095    16.0182     93.9146     16.0182     
1 1 1 21 5  9  o 2  480.02  4.91232 4126.13     118.175  4053.74     118.158  421.358    49.1014     150.342     49.1014     
1 1 1 21 5  10 o 13 376.882 4.14776 2523.87     78.3477  2516        78.3305  305.966    260.592     72.072      260.592     
1 1 1 21 5  11 o 5  128.915 2.6865  295.114     16.8864  294.643     17.7755  52.7126    178.409     58.6617     358.409     
1 1 1 21 5  12 o 17 392.421 4.19338 2778.23     82.4782  2686.69     82.4378  309.912    103.475     57.0497     103.475     
1 1 1 21 5  13 o 16 98.3651 2.64871 170.112     13.0457  173.455     13.0189  25.2914    326.036     1.32481     146.036     
1 1 1 21 5  14 o 17 149.916 2.49888 393.306     18.0033  403.558     19.5306  76.4371    324.59      44.1035     144.59      
1 1 1 21 5  15 o 7  307.161 3.16123 1671.04     47.6644  1675.12     49.6403  209.601    257.094     17.1724     77.0936     
1 1 1 21 5  16 o 10 417.257 4.23581 3119.81     92.5528  3059.47     84.4803  267.913    37.9028     63.8424     217.903     
1 1 1 21 5  17 o 1  417.424 4.07213 3093.18     85.1787  3090.38     85.1896  361.791    151.242     127.09      151.242     
1 1 1 21 5  18 o 3  219.499 2.88802 871.36      32.4433  837.406     31.0964  64.1663    186.967     181.035     6.96741     
1 1 1 21 5  19 o 10 224.997 2.70395 887.608     29.8791  907.56      31.0964  154.278    299.572     3.98064     119.572     
1 1 1 21 5  20 o 1  451.841 4.13374 3611.16     93.5864  3635.2      93.6184  339.472    244.534     30.8215     244.534     
1 1 1 21 5  21 o 11 366.383 3.65119 2356.03     68.3406  2407.08     65.6773  404.758    204.154     297.131     204.154     
1 1 1 21 5  22 o 19 189.214 2.81127 622.391     27.7782  647.406     25.4303  160.732    262.95      67.5427     262.95      
1 1 1 21 5  23 f 0  319.846 3.52525 1771.12     56.4888  1859.2      56.4976  214.438    82.6323     0           0           
1 1 1 21 5  24 o 2  468.629 4.5622  3947.69     107.145  3852        107.129  404.495    257.437     138.847     257.437     
1 1 1 21 5  25 o 13 254.405 3.27069 1132.78     39.5855  1163.51     43.7579  236.057    61.1305     117.146     61.1305     
1 1 1 21 5  26 o 5  157.237 2.61645 449.008     20.145   427.898     21.0484  118.59     180.239     25.9792     180.239     
1 1 1 21 5  27 o 3  302.051 3.22964 1657.61     48.8956  1579.82     48.8585  253.415    347.659     80.9368     347.659     
1 1 1 21 5  28 o 4  417.367 4.20881 3106.95     83.9064  3079.05     91.9342  275.447    248.661     43.2573     68.6607     
1 1 1 21 5  29 o 12 164.706 2.47232 467.306     19.0521  494.931     21.7373  155.827    0.505537    103.134     0.505537    
1 1 1 21 5  30 o 16 72.8396 2.65594 85.5107     9.07215  103.604     10.2629  21.4309    357.561     6.08956     177.561     
1 1 1 21 5  31 o 3  218.236 2.81193 835.11      29.9492  854.422     31.5516  147.879    0.872902    6.78475     180.873     
1 1 1 21 5  32 o 12 267.464 3.13082 1263.73     42.7858  1274.68     41.1192  186.119    168.568     1.51479     348.568     
1 1 1 21 5  33 o 3  101.957 2.5339  191.087     12.2441  178.177     13.5196  31.2248    190.992     68.519      10.9922     
1 1 1 21 5  34 o 16 97.7256 2.69506 170.307     12.2555  168.989     14.0235  13.1217    220.497     100.348     40.4972     
1 1 1 21 5  35 o 10 255.085 3.00595 1151.55     37.4715  1157.33     39.362   160.308    199.716     33.9556     19.7159     
1 1 1 21 5  36 o 4  37.4807 3.80791 21.9982     6.79608  29.1646     7.01132  35.3651    130.793     100.081     130.793     
1 1 1 21 5  37 o 9  249.263 2.8252  1085.96     35.1557  1118.66     35.4247  165.608    170.767     13.4216     350.767     
1 1 1 21 5  38 o 4  104.146 2.57325 181.243     13.1166  204.338     13.6947  66.4708    238.117     9.79616     238.117     
1 1 1 21 5  39 o 8  76.4724 2.54056 95.8643     9.3723   112.38      10.0411  23.0569    109.555     40.7579     289.555     
1 1 1 21 5  40 o 14 283.126 2.9524  1378.94     41.0021  1466.74     42.7849  194.693    56.6653     1.81194     236.665     
1 1 1 21 5  41 o 13 117.33  2.47326 245.706     13.7405  243.127     15.2629  73.6427    257.832     2.36117     77.8319     
1 1 1 21 5  42 o 10 126.19  2.47169 274.323     14.9504  291.228     16.2819  109.171    202.171     66.6002     202.171     
1 1 1 21 5  43 o 19 134.434 2.44607 311.544     15.7834  330.306     17.1488  79.08      159.948     20.2064     339.948     
1 1 1 21 5  44 o 18 166.117 2.50179 482.095     20.4343  497.323     21.2206  137.497    169.789     53.4253     169.789     
1 1 1 21 5  45 o 13 122.808 2.49478 266.119     15.0602  269.658     15.614   35.1038    107.026     94.694      287.026     
1 1 1 21 5  46 o 9  145.673 2.48021 376.369     17.7948  376.982     18.413   90.4822    256.45      14.1197     76.4502     
1 1 1 21 5  47 o 12 301.061 3.16355 1582.12     44.8125  1640.58     50.5648  196.502    351.61      19.0986     171.61      
1 1 1 21 5  48 o 4  198.036 2.81914 677.816     27.4451  716.155     28.5149  149.796    282.995     32.3659     282.995     
1 1 1 21 5  49 o 9  146.94  2.57332 389.829     18.884   377.577     18.9935  97.0276    117.829     1.74147     297.829     
1 1 1 21 5  50 o 17 294.351 3.23284 1545.93     46.5559  1538.36     48.788   236.123    253.985     72.9771     253.985     
1 1 1 21 5  51 o 15 18.8297 5.19437 4.93703     6.63502  2.56092     7.62569  7.04107    338.764     17.5842     338.764     
1 1 1 21 5  52 o 11 72.3393 3.05432 84.1379     10.2175  103.381     11.8466  27.8041    20.3866     35.2937     200.387     
1 1 1 21 5  53 o 3  57.3873 3.48798 54.6928     8.91082  63.8876     10.9637  31.6257    145.768     8.36761     145.768     
1 1 1 21 5  54 o 12 23.2777 5.59742 6.84232     6.76418  11.6085     8.88672  4.67518    290.677     15.1195     290.677     
1 1 1 21 5  55 o 14 70.995  3.07419 80.2068     9.72002  100.873     12.0854  36.7726    330.336     13.2625     150.336     
1 1 1 21 5  56 o 10 58.2677 3.25654 61.8946     8.80564  60.1469     9.99485  29.0473    266.221     10.4659     86.2206     
1 1 1 21 5  57 o 2  88.5062 2.90319 140.101     13.0948  140.048     12.5834  74.002     224.596     37.4101     224.596     
1 1 1 21 5  58 o 14 83.6225 2.97781 136.186     11.912   114.705     12.7962  62.3653    211.31      17.8039     211.31      
1 1 1 21 5  59 o 11 52.1723 3.45819 45.2501     8.77329  53.3752     9.06993  37.176     116.691     13.3941     116.691     
1 1 1 21 5  60 o 2  132.512 2.59934 295.833     16.8579  332.147     17.6239  118.479    34.2008     64.4977     34.2008     
1 1 1 21 5  61 o 18 68.6443 3.24754 78.6981     10.9881  91.42       11.1906  47.2654    241.191     8.25231     241.191     
1 1 1 21 5  62 o 16 107.303 2.88342 190.697     16.4422  223.089     14.1606  85.0546    311.652     31.7899     311.652     
1 1 1 21 5  63 o 19 89.6219 3.17874 145.158     15.6716  144.351     12.6197  60.9348    187.418     7.081       187.418     
1 1 1 21 5  64 o 1  101.993 2.69451 202.695     14.3665  171.227     13.1328  82.9851    212.977     35.6004     212.977     
1 1 1 21 5  65 o 17 92.3386 2.72945 163.611     13.3936  143.047     11.8253  60.6641    356.551     3.37109     356.551     
1 1 1 21 5  66 o 14 80.6505 2.97375 116.607     12.6109  117.941     11.2961  48.7178    122.329     4.8448      302.329     
1 1 1 21 5  67 o 4  81.0333 3.1139  115.02      13.7083  122.434     11.2613  50.5113    114.938     1.48613     294.938     
1 1 1 21 5  68 o 13 109.434 2.82393 222.357     16.8799  209.23      13.9765  80.0865    33.4159     20.8993     33.4158     
1 1 1 21 5  69 o 16 34.3487 5.22933 26.8602     9.66788  19.1949     7.85372  12.7529    278.612     14.7193     98.6119     
1 1 1 21 5  70 f 0  75.5669 3.14534 107.381     13.2488  100.433     10.3621  39.8788    60.0476     0           0           
1 1 1 21 5  71 o 9  61.7019 3.65654 77.4448     12.0982  63.4078     10.3301  45.9388    41.1803     16.2305     41.1803     
1 1 1 21 5  72 f 0  44.6165 5.25863 36.7176     11.7761  40.9013     10.814   20.9209    352.981     0           0           
1 1 1 21 5  73 o 5  22.5879 6.13882 11.66       10.2567  3.56499     9.69402  1.60614    60.001      20.3478     240.001     
1 1 1 21 5  74 o 3  30.967  6.71103 25.8885     12.5932  14.2787     10.5272  7.89766    291.962     19.1706     111.962     
1 1 1 21 5  75 o 12 18.9793 5.69311 -3.33837    9.87322  5.73725     9.50838  0.80401    243.361     13.1451     63.3607     
1 1 1 21 5  76 o 13 19.5069 5.765   4.83013     8.55935  0.930593    10.5145  1.74112    345.425     4.9094      165.425     
1 1 1 21 5  77 o 7  30.3801 6.6189  19.9915     9.79859  18.2752     12.6073  14.5287    56.2983     0.901596    236.298     
1 1 1 21 5  78 o 15 25.7672 6.64405 17.531      11.2749  5.62379     12.0683  6.06569    197.676     14.9438     17.6757     
1 1 1 21 5  79 o 15 21.2866 6.39669 2.54219     10.9407  4.84884     12.8328  1.99978    16.7088     17.1101     196.709     
1 1 1 21 5  80 o 7  20.0757 6.04847 -9.58746    10.7545  10.4619     12.0854  4.28874    113.332     3.05567     293.332     
1 1 1 21 5  81 o 5  64.6624 5.50182 78.8959     17.4354  90.5669     17.3995  40.4989    125.026     4.42695     125.026     
1 1 1 21 5  82 o 9  16.7481 5.54127 -15.7774    12.8686  -2.24686    11.0821  0.109618   241.78      2.709       61.7797     
1 1 1 21 5  83 o 3  33.8081 11.3305 150.519     70.4258  5.20984     13.3842  14.0126    201.093     2.34474     201.093     
1 1 1 21 5  84 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 6  0  o 14 267.828 3.38739 1272.74     45.4327  1272.74     45.4327  249.52     1.13428e-05 106.226     1.13428e-05 
1 1 1 21 6  1  o 4  254.173 3.15107 1140.66     40.1401  1150.44     40.134   176.38     176.901     6.18886     356.901     
1 1 1 21 6  2  o 15 452.099 4.62705 3617.14     102.305  3638.01     107.314  350.465    221.546     46.1163     221.546     
1 1 1 21 6  3  o 5  382.661 4.20828 2643.47     80.6827  2553.09     80.7005  285.229    242.779     18.7251     242.779     
1 1 1 21 6  4  o 8  303.376 3.46427 1637.28     55.2649  1627.28     49.9542  221.885    88.4995     10.8788     88.4995     
1 1 1 21 6  5  o 4  343.746 4.00166 2080.58     70.7199  2112.04     67.0706  212.282    167.952     70.4493     347.952     
1 1 1 21 6  6  o 8  200.676 3.12805 727.964     30.5157  700.34      32.3297  159.974    294.366     49.1101     294.366     
1 1 1 21 6  7  o 9  317.371 3.81154 1811.58     65.3444  1762.13     55.6338  303.469    209.521     159.477     209.521     
1 1 1 21 6  8  o 7  225.556 3.10229 910.823     35.0956  893.486     35.0362  133.002    48.9933     50.6173     228.993     
1 1 1 21 6  9  o 1  391.765 4.0639  2722.62     83.3478  2723.71     76.0562  336.936    208.907     111.492     208.907     
1 1 1 21 6  10 o 1  215.276 2.73162 822.955     29.4941  820.343     29.4454  182.641    33.1139     73.6055     33.1139     
1 1 1 21 6  11 o 4  201.865 2.68015 720.966     26.5537  723.938     27.6633  56.8244    29.0354     170.603     209.035     
1 1 1 21 6  12 o 18 241.368 2.81024 1024.65     33.9777  1041.29     34.0059  179.351    324.337     21.7225     324.337     
1 1 1 21 6  13 o 11 235.922 2.713   987.898     32.0562  985.755     32.0956  176.481    85.812      24.3028     85.812      
1 1 1 21 6  14 o 13 236.26  2.73897 981.479     32.4117  997.917     32.4457  107.842    140.465     118.874     320.465     
1 1 1 21 6  15 o 19 174.545 2.46096 548.008     21.0578  532.246     21.9686  109.663    295.833     17.4199     115.833     
1 1 1 21 6  16 o 5  726.355 6.30548 9397.13     234.084  9369.08     224.883  563.84     274.228     74.1015     274.228     
1 1 1 21 6  17 o 5  333.721 3.23742 2006.67     55.1347  1944.09     53.1547  333.427    342.605     195.751     342.605     
1 1 1 21 6  18 o 2  451.856 4.33717 3642.13     102.24   3606.46     94.0514  373.337    133.293     96.5907     133.293     
1 1 1 21 6  19 o 4  214.438 2.77253 806.778     29.1862  824.012     30.4011  175.402    99.2214     54.0882     99.2214     
1 1 1 21 6  20 o 4  366.552 3.76877 2372.57     67.7138  2395.64     70.7271  258.853    49.9591     7.89712     229.959     
1 1 1 21 6  21 o 9  140.142 2.52252 325.23      17.3243  372.232     18.0731  56.0959    153.782     79.5397     333.782     
1 1 1 21 6  22 o 19 358.181 3.89073 2237.17     71.4497  2316.97     68.1121  317.79     91.885      124.319     91.885      
1 1 1 21 6  23 o 5  160.882 2.50457 464.886     20.207   452.995     20.1767  125.266    81.8303     32.9054     81.8303     
1 1 1 21 6  24 f 0  145.996 2.47057 372.778     18.0855  383.115     18.0635  76.1861    260.541     0           0           
1 1 1 21 6  25 o 16 310.731 3.15237 1712.59     49.0645  1712.97     49.113   236.497    278.81      31.6185     278.81      
1 1 1 21 6  26 o 17 83.564  2.39499 130.798     9.94424  117.412     10.045   36.1744    336.462     20.1435     156.462     
1 1 1 21 6  27 o 19 234.285 2.64542 981.864     31.0155  964.968     31.1017  223.282    84.759      123.496     84.759      
1 1 1 21 6  28 o 16 163.262 2.35704 478.749     19.5686  466.513     19.0016  90.2693    129.329     43.5364     309.329     
1 1 1 21 6  29 o 5  108.773 2.30381 211.402     12.7194  208.544     12.3682  76.0002    78.6094     36.1736     78.6094     
1 1 1 21 6  30 o 1  81.1051 2.42425 112.184     9.90991  121.617     9.73183  3.84248    273.298     110.313     273.298     
1 1 1 21 6  31 o 4  95.2473 2.50121 158.346     12.2665  163.885     11.5432  32.4648    90.4441     54.8677     270.444     
1 1 1 21 6  32 o 12 136.264 2.35915 331.371     15.6771  327.35      16.5125  67.3211    312.674     47.9505     132.674     
1 1 1 21 6  33 o 14 311.963 3.26102 1742.11     47.7656  1712.15     53.9526  251.907    76.6267     66.8704     76.6267     
1 1 1 21 6  34 o 9  144.651 2.51877 381.42      18.1114  361.144     18.3719  104.096    320.194     18.2236     320.194     
1 1 1 21 6  35 o 18 256.391 2.78845 1157.23     35.048   1175.11     36.6021  202.328    18.867      49.3852     18.867      
1 1 1 21 6  36 o 4  187.909 2.49005 606.927     22.891   645.885     24.0106  117.171    338.867     22.806      158.867     
1 1 1 21 6  37 o 9  258.356 2.86999 1157.77     37.0526  1211.13     37.2549  177.807    342.998     2.74471     162.998     
1 1 1 21 6  38 o 13 271.385 2.9587  1244.01     39.245   1371.48     41.2339  195.458    343.665     14.6962     343.665     
1 1 1 21 6  39 o 17 135.534 2.39128 318.171     15.7687  333.774     16.7039  117.001    285.348     89.5328     285.348     
1 1 1 21 6  40 o 19 124.574 2.47331 255.805     15.138   295.962     15.6859  98.3815    274.343     39.9152     274.343     
1 1 1 21 6  41 o 4  288.321 3.08781 1436.88     43.5921  1515.6      45.6467  176.806    90.5064     46.0291     270.506     
1 1 1 21 6  42 o 5  121.8   2.47581 257.746     14.4877  269.224     15.7017  52.8863    264.162     56.9157     84.1624     
1 1 1 21 6  43 o 18 56.0004 3.22686 64.5127     8.50773  48.2482     9.16737  4.52652    195.299     55.9068     15.2994     
1 1 1 21 6  44 o 13 138.551 2.48535 334.054     16.6531  347.667     17.8431  41.314     351.544     105.477     171.544     
1 1 1 21 6  45 o 15 280.896 3.17036 1353.98     43.6447  1451.68     45.6192  207.032    281.827     28.0334     281.827     
1 1 1 21 6  46 f 0  301.18  3.29511 1577.74     48.6391  1649.05     50.8359  188.401    89.25       0           0           
1 1 1 21 6  47 o 8  58.4074 3.40978 67.4905     9.63505  55.0578     10.0135  13.1364    244.49      43.1475     64.4896     
1 1 1 21 6  48 o 15 173.078 2.68252 512.611     22.7679  552.433     23.7689  154.619    117.72      78.228      117.72      
1 1 1 21 6  49 o 4  54.3217 3.47923 55.1264     9.09013  50.9038     9.60266  21.1987    56.7979     16.608      236.798     
1 1 1 21 6  50 o 10 100.947 2.62185 179.979     12.6943  182.866     13.7733  68.5554    156.369     6.83211     156.369     
1 1 1 21 6  51 o 4  96.4768 2.70978 168.752     12.714   162.973     13.4113  68.8706    223.152     14.5891     223.152     
1 1 1 21 6  52 o 6  55.5379 3.41116 48.0834     9.02696  63.3474     9.71001  28.0606    240.528     3.08051     60.5282     
1 1 1 21 6  53 o 9  143.082 2.54898 359.303     17.7768  369.655     18.7599  104.495    320.555     19.9252     320.555     
1 1 1 21 6  54 o 8  64.3756 3.19915 69.2299     9.80409  79.6277     10.7118  38.5482    80.0209     2.77634     80.0209     
1 1 1 21 6  55 o 2  97.2495 2.8229  170.755     12.7818  167.068     14.5905  45.2242    195.844     36.4899     15.844      
1 1 1 21 6  56 o 3  134.761 2.76942 314.63      17.2932  333.863     20.0394  98.9148    120.614     20.0286     120.614     
1 1 1 21 6  57 o 11 140.695 2.86081 373.153     19.0445  334.793     21.0464  101.73     144.042     17.1523     144.042     
1 1 1 21 6  58 o 2  19.6419 5.13737 8.89505     6.74709  0.158033    7.54222  9.7981     243.547     37.3838     243.547     
1 1 1 21 6  59 o 12 155.915 2.61904 410.698     19.3232  458.186     21.6196  117.966    330.506     30.237      330.506     
1 1 1 21 6  60 o 4  34.0302 4.60889 25.8718     7.49916  17.8478     7.59175  10.8608    52.2795     16.3806     232.28      
1 1 1 21 6  61 o 13 177.244 2.56785 555.007     22.2873  568.38      23.3281  137.474    116.043     42.0646     116.043     
1 1 1 21 6  62 o 9  61.5366 3.39169 66.4812     10.9855  70.7928     9.66264  27.5011    12.9166     23.0659     192.917     
1 1 1 21 6  63 o 10 36.1819 4.98072 23.9909     9.22676  25.6527     8.15248  14.7976    90.5568     8.49154     90.5568     
1 1 1 21 6  64 o 4  15.5118 4.6501  -11.5568    7.33846  4.98416     6.94743  2.31586    297.09      9.92474     297.09      
1 1 1 21 6  65 o 14 29.612  5.13161 22.1856     7.61916  11.5687     7.88392  10.502     344.944     9.7606      164.944     
1 1 1 21 6  66 o 18 87.6074 3.02297 138.059     14.2742  139.048     12.0806  66.6087    257.274     22.059      257.274     
1 1 1 21 6  67 o 3  20.9943 5.55392 7.15326     8.25047  6.14644     7.49051  3.26364    95.2842     3.9456      275.284     
1 1 1 21 6  68 o 17 45.4084 4.19855 35.7747     9.54726  41.266      8.98994  33.871     175.388     14.4902     175.388     
1 1 1 21 6  69 o 8  41.8435 4.47396 30.2631     9.21083  36.0517     8.86685  19.0704    253.204     12.5833     73.2037     
1 1 1 21 6  70 o 11 33.7892 5.3534  27.5916     8.47254  17.5091     9.35659  15.7522    222.207     7.49619     42.2066     
1 1 1 21 6  71 o 1  57.0548 3.91396 70.2531     11.8837  51.7922     10.209   31.9032    182.64      6.71009     2.64027     
1 1 1 21 6  72 o 9  38.7773 5.68966 36.0169     10.9468  24.6333     10.4815  20.4008    228.453     4.47075     48.4534     
1 1 1 21 6  73 o 14 78.1967 3.61713 112.181     14.3811  114.47      13.7968  54.73      279.018     12.6182     279.018     
1 1 1 21 6  74 f 0  26.5894 6.58059 12.3386     10.1922  15.3158     11.4425  17.002     166.441     0           0           
1 1 1 21 6  75 o 19 22.5054 6.36661 6.631       10.4227  7.67373     11.3268  4.19605    204.386     2.36072     24.386      
1 1 1 21 6  76 o 7  18.8096 5.94884 -6.93521    12.1352  1.46299     11.2537  1.65068    59.5306     7.82559     239.531     
1 1 1 21 6  77 o 2  27.359  6.68867 19.6518     10.9863  8.72891     12.3717  0.894519   131.7       28.919      311.7       
1 1 1 21 6  78 o 1  28.5656 6.67916 11.0015     10.7275  22.6394     12.0354  2.81109    60.5294     26.6778     240.529     
1 1 1 21 6  79 o 19 30.511  7.10055 14.6081     13.0281  25.1757     12.7589  11.6738    187.203     9.8253      7.20268     
1 1 1 21 6  80 o 18 27.3289 6.93219 7.58404     12.7404  22.0178     12.6019  12.5106    232.042     1.18941     232.042     
1 1 1 21 6  81 o 10 20.744  6.44153 -2.688      14.3324  5.32992     11.9809  3.40844    304.106     4.58765     124.106     
1 1 1 21 6  82 o 1  29.2064 7.47688 12.4276     16.9754  24.7332     13.1036  10.7983    92.4267     2.06693     92.4267     
1 1 1 21 6  83 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 6  84 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 7  0  o 17 117.46  2.63287 245.264     15.4628  245.264     15.4628  50.6433    180         23.5255     180         
1 1 1 21 7  1  o 9  246.786 3.19806 1059.28     39.5767  1101.06     39.5146  172.222    29.138      3.96877     209.138     
1 1 1 21 7  2  o 11 164.073 2.70061 451.977     21.7318  503.277     22.6717  45.1695    171.403     136.931     351.403     
1 1 1 21 7  3  o 2  234.334 2.94587 984.974     34.6113  962.489     34.5751  207.347    325.409     92.3282     325.409     
1 1 1 21 7  4  o 18 268.847 3.13738 1288.73     42.2838  1274.83     42.2555  194.703    227.704     7.82112     227.704     
1 1 1 21 7  5  o 3  436.783 4.22787 3303.74     92.5296  3468.68     92.5163  332.932    2.7625      32.8647     2.7625      
1 1 1 21 7  6  o 3  310.361 3.23395 1724.1      49.289   1692.56     51.2681  235.363    67.7627     26.742      67.7627     
1 1 1 21 7  7  o 5  178.883 2.51524 570.799     22.5503  563.799     22.5453  88.0508    140.773     71.4566     320.773     
1 1 1 21 7  8  o 3  153.242 2.44384 419.803     19.1457  412.818     18.3874  38.3587    322.271     134.551     142.271     
1 1 1 21 7  9  o 10 256.414 3.06721 1173.45     38.5144  1158.48     40.2803  194.543    349.897     26.6549     349.897     
1 1 1 21 7  10 f 0  237.631 2.9243  1004.24     36.247   998.405     33.3499  149.844    205.163     0           0           
1 1 1 21 7  11 o 9  177.914 2.60307 559.943     23.2003  562.457     23.2177  93.2913    195.101     59.9954     15.1006     
1 1 1 21 7  12 o 13 174.412 2.51031 550.435     21.9115  528.288     21.9633  98.6446    251.258     43.4059     71.2576     
1 1 1 21 7  13 o 5  296.455 3.06157 1575.14     46.3188  1542.14     44.6485  162.788    336.466     100.405     156.466     
1 1 1 21 7  14 o 1  230.572 3.07001 967.243     37.3015  918.747     33.6273  235.49     315.953     159.106     315.953     
1 1 1 21 7  15 o 9  293.209 3.47729 1585.67     53.7089  1465.75     48.4937  221.621    137.645     24.242      137.646     
1 1 1 21 7  16 o 19 518.068 5.29043 4779.91     137.36   4758.62     137.345  426.667    123.95      103.064     123.95      
1 1 1 21 7  17 o 7  222.879 3.03856 898.509     35.6435  863.689     32.205   192.945    238.195     74.4657     238.195     
1 1 1 21 7  18 o 1  31.4554 4.61779 20.4264     7.62682  16.1439     6.476    40.5753    27.7304     100.967     27.7304     
1 1 1 21 7  19 o 19 302.151 3.49415 1604.08     54.1475  1635.56     51.6104  204.598    61.1416     24.2243     241.142     
1 1 1 21 7  20 o 14 137.603 2.50685 331.132     16.993   340.797     17.5527  37.1412    299.325     116.702     119.325     
1 1 1 21 7  21 o 15 140.987 2.4299  361.436     17.4943  343.546     16.8444  53.1977    14.4351     88.4863     194.435     
1 1 1 21 7  22 o 13 170.312 2.5872  524.744     22.0356  504.062     22.1198  139.644    9.20778     47.4808     9.20779     
1 1 1 21 7  23 o 1  298.487 2.99246 1594.5      45.5673  1566.22     43.9551  137.161    223.564     152.988     43.5645     
1 1 1 21 7  24 o 18 307.35  3.09353 1663.55     48.4881  1688        46.7787  189.649    61.4098     59.4849     241.41      
1 1 1 21 7  25 o 4  92.1308 2.35105 149.962     10.9995  151.433     10.6704  42.7795    277.657     25.4865     97.6575     
1 1 1 21 7  26 o 11 290.551 3.05168 1512.78     43.5603  1482.56     45.2717  248.356    274.558     86.334      274.558     
1 1 1 21 7  27 o 17 206.166 2.48217 773.142     25.5909  734.575     25.6848  118.908    345.153     50.9003     165.153     
1 1 1 21 7  28 o 6  135.756 2.2343  323.785     15.1502  329.768     15.2509  113.834    323.623     58.8724     323.623     
1 1 1 21 7  29 o 6  401.327 3.71339 2846.75     76.0196  2872.14     73.3109  275.379    236.137     20.5481     56.1369     
1 1 1 21 7  30 o 18 368.965 3.61503 2393.69     68.0953  2439.88     65.5374  255.839    190.382     11.909      10.3819     
1 1 1 21 7  31 o 2  231.231 2.77122 961.839     32.7007  935.161     31.5257  180.304    254.228     39.2429     254.228     
1 1 1 21 7  32 o 2  153.743 2.42155 425.51      18.9289  412.904     18.3869  89.5851    116.291     29.2563     296.291     
1 1 1 21 7  33 o 17 242.303 2.89259 1071.75     35.0739  1011.94     35.1503  106.86     211.836     126.133     31.8363     
1 1 1 21 7  34 o 19 342.586 3.32479 2064.34     58.0608  2102.26     56.0627  335.323    185.076     191.914     185.076     
1 1 1 21 7  35 o 17 214.24  2.75641 809.747     29.492   818.845     29.6962  192.463    232.13      92.7573     232.13      
1 1 1 21 7  36 o 8  115.444 2.4753  232.754     13.8324  240.498     14.7727  51.3215    233.71      49.2782     53.7101     
1 1 1 21 7  37 o 18 45.8722 3.54734 34.8063     7.709    40.9495     8.33136  3.10752    178.744     31.502      178.744     
1 1 1 21 7  38 o 9  174.286 2.73313 533.56      23.6032  544.476     24.1407  103.63     139.447     31.0287     319.447     
1 1 1 21 7  39 o 8  78.3552 2.76407 105.741     10.4503  112.777     11.1913  34.5947    250         23.4657     69.9997     
1 1 1 21 7  40 o 2  364.511 3.6066  2312.91     65.7658  2410.4      65.982   279.985    162.225     51.5292     162.225     
1 1 1 21 7  41 o 1  116.156 2.75176 242.912     14.9746  236.673     16.9275  60.5613    232.401     33.6452     52.4008     
1 1 1 21 7  42 o 7  112.28  2.56225 210.305     13.914   238.128     14.885   77.5886    89.0197     8.07619     89.0197     
1 1 1 21 7  43 o 19 135.903 2.52235 320.03      16.5731  336.27      17.756   90.0466    171.749     2.4714      351.749     
1 1 1 21 7  44 o 8  159.339 2.50731 438.102     19.0496  463.647     20.9886  132.362    174.683     50.5764     174.683     
1 1 1 21 7  45 o 13 82.2324 2.77984 118.414     10.9774  122.441     11.8627  40.4751    69.2467     23.6168     249.247     
1 1 1 21 7  46 o 10 60.8714 3.25701 71.0125     8.97198  61.7473     10.5246  31.0628    191.818     9.74326     191.818     
1 1 1 21 7  47 o 3  138.771 2.70759 331.331     19.4354  353.947     18.1033  117.235    183.722     50.8616     183.722     
1 1 1 21 7  48 f 0  109.42  2.68607 204.095     13.7821  222.344     15.6318  39.389     324.891     0           0           
1 1 1 21 7  49 o 4  123.515 2.59451 266.638     15.7499  276.424     16.3351  74.1734    165.871     16.2171     345.871     
1 1 1 21 7  50 o 17 90.5289 2.73486 143.732     11.2225  148.503     13.4644  56.0692    33.5659     4.3237      213.566     
1 1 1 21 7  51 o 5  48.5186 3.72678 41.5491     8.20759  43.5941     9.59304  19.1364    165.958     1.28677     165.958     
1 1 1 21 7  52 o 7  92.7382 2.68224 147.391     11.8256  159.551     13.0567  73.8043    359.916     31.8454     359.916     
1 1 1 21 7  53 o 6  22.9628 5.35566 9.41041     6.75854  8.84552     7.56776  12.1311    231.17      38.3198     231.17      
1 1 1 21 7  54 o 19 42.8726 3.96846 34.2715     7.892    32.784      8.6992   18.0263    64.5779     0.211209    244.578     
1 1 1 21 7  55 o 12 109.687 2.65664 220.659     14.0824  208.934     15.0297  71.8791    59.0754     0.890384    239.075     
1 1 1 21 7  56 o 13 162.648 2.54345 481.126     19.5379  462.292     21.8092  127.318    357.067     37.758      357.067     
1 1 1 21 7  57 o 11 121.098 2.57458 273.484     14.8737  250.585     16.2254  71.0735    356.264     18.357      176.264     
1 1 1 21 7  58 o 18 38.5212 4.25122 24.0932     7.81029  31.0105     7.99455  12.4682    165.618     20.8509     345.618     
1 1 1 21 7  59 o 7  95.1957 2.59187 167.153     12.3283  157.299     12.3458  65.9005    153.619     7.72583     153.619     
1 1 1 21 7  60 o 17 107.576 2.68048 201.19      13.8947  213.637     14.9638  69.9661    247.428     0.817953    67.4278     
1 1 1 21 7  61 o 17 90.3281 2.9057  140.525     13.0796  152.975     13.1419  68.1311    272.196     19.7483     272.196     
1 1 1 21 7  62 o 10 22.3563 5.72741 8.79889     7.81951  7.05145     8.77596  1.97099    168.635     13.5972     348.635     
1 1 1 21 7  63 o 8  48.764  4.18923 44.9844     10.3878  42.89       9.66659  25.9109    309.718     8.035       129.718     
1 1 1 21 7  64 o 9  36.5928 5.09445 25.3093     9.08917  25.7879     8.92905  15.9425    145.01      10.4754     325.01      
1 1 1 21 7  65 o 19 26.3286 4.76069 23.8476     7.23159  -1.39625    8.62113  5.45271    148.397     17.1216     328.397     
1 1 1 21 7  66 o 2  74.4998 3.28285 94.5131     12.1562  107.265     12.197   49.1372    15.9971     3.70639     15.9971     
1 1 1 21 7  67 o 6  19.7147 5.36237 0.675689    7.51732  8.82688     7.95342  2.07755    14.2606     24.3922     14.2606     
1 1 1 21 7  68 o 1  20.5651 5.37503 8.92264     7.49922  4.06702     7.38966  0.0227985  349.505     21.321      349.504     
1 1 1 21 7  69 o 6  29.233  5.58021 21.3984     8.30431  12.2772     8.90019  13.702     227.46      4.41186     47.4598     
1 1 1 21 7  70 o 12 17.7519 5.15892 2.12481     7.43048  3.35263     7.32215  4.67832    9.16144     27.5205     9.16145     
1 1 1 21 7  71 o 8  36.1607 5.85219 27.8166     10.966   25.1301     9.78911  18.2285    16.487      5.45487     196.487     
1 1 1 21 7  72 o 18 23.334  6.25895 6.35525     10.1292  11.4469     10.2072  0.949776   85.8959     23.226      265.896     
1 1 1 21 7  73 o 9  48.8503 5.17614 52.9752     11.9579  40.922      12.3453  26.5969    96.9249     5.49243     276.925     
1 1 1 21 7  74 o 17 25.8128 6.36314 5.69506     10.9226  18.5544     10.4814  8.37934    251.668     7.31421     71.6683     
1 1 1 21 7  75 o 2  52.0449 5.43478 45.2915     13.611   62.7429     13.5109  29.9616    334.309     2.22997     154.309     
1 1 1 21 7  76 o 5  28.7258 6.92301 5.7176      14.6979  24.0042     11.7946  9.60747    114.706     4.92327     114.706     
1 1 1 21 7  77 o 3  19.0655 6.15894 -7.9992     15.6145  -1.71865    10.8057  0.965404   342.805     15.8548     162.805     
1 1 1 21 7  78 f 0  63.2314 6.32798 81.8758     22.1431  83.3802     15.7492  29.5811    287.56      0           0           
1 1 1 21 7  79 o 9  50.0012 6.72104 70.5323     18.1491  39.401      14.429   31.791     68.4301     5.25657     68.4301     
1 1 1 21 7  80 o 2  18.427  5.64413 7.35411     9.65621  -12.9572    11.834   0.835044   0.0947849   11.9413     180.095     
1 1 1 21 7  81 o 15 14.9457 5.03305 -9.30322    8.93614  -8.46504    11.5068  2.25321    320.129     11.1591     320.129     
1 1 1 21 7  82 o 10 20.0331 6.5022  -0.0905563  16.7638  -3.23414    12.6484  1.04181    3.2545      5.36222     183.255     
1 1 1 21 7  83 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 8  0  o 5  702.688 6.51535 8771.39     229.347  8771.39     229.347  621.06     2.11134e-06 209         2.11134e-06 
1 1 1 21 8  1  o 5  104.985 2.58128 188.023     13.292   203.431     13.8283  54.0947    258.953     9.82319     78.9533     
1 1 1 21 8  2  o 11 366.937 3.84662 2385.69     70.7483  2392.47     70.7204  253.79     317.081     24.7194     137.081     
1 1 1 21 8  3  o 16 139.256 2.47386 350.166     16.5836  337.727     17.8759  57.9045    58.8479     73.3741     238.848     
1 1 1 21 8  4  o 13 46.6974 3.12446 39.3629     7.0848   38.6774     7.3587   6.21745    329.797     21.9142     329.797     
1 1 1 21 8  5  o 12 411.36  3.95565 3005.61     83.1714  3000.15     79.8895  329.159    186.139     61.0904     186.139     
1 1 1 21 8  6  f 0  298.607 3.17029 1581.34     48.3978  1581.56     46.4656  186.462    347.783     0           0           
1 1 1 21 8  7  o 19 230.683 2.78716 948.176     31.5853  939.041     32.8376  110.24     147.027     109.811     327.027     
1 1 1 21 8  8  o 11 219.32  2.73094 850.862     29.4324  854.96      30.5908  153.7      48.607      2.8976      228.607     
1 1 1 21 8  9  o 5  231.09  2.80904 950.678     33.8797  943.253     31.1351  119.318    237.364     92.084      57.364      
1 1 1 21 8  10 o 3  304.017 3.85441 1614.98     58.7226  1665.51     58.715   268.108    9.06513     100.578     9.06513     
1 1 1 21 8  11 o 3  151.78  2.77375 405.547     21.1207  412.022     21.0383  94.6829    142.092     18.311      322.092     
1 1 1 21 8  12 o 10 98.4094 2.64755 180.48      13.1097  163.659     12.9404  27.4585    205.938     72.7863     25.9377     
1 1 1 21 8  13 f 0  438.945 4.54883 3467.04     100.063  3376.31     100.048  304.711    132.71      0           0           
1 1 1 21 8  14 o 11 223.104 3.18388 888.646     36.5437  877.209     34.6377  185.126    192.438     54.7605     192.438     
1 1 1 21 8  15 o 14 148.771 2.76972 406.224     21.221   379.528     20.0478  111.25     304.785     20.3313     304.785     
1 1 1 21 8  16 o 1  140.82  2.7402  331.196     19.7346  373.285     18.7821  126.852    342.618     78.346      342.618     
1 1 1 21 8  17 o 17 183.147 2.71063 601.556     25.9395  588.146     23.7935  133.667    157.905     11.34       157.905     
1 1 1 21 8  18 o 4  365.962 3.76372 2381.13     70.5217  2372.92     67.5026  285.556    261.087     43.4085     261.087     
1 1 1 21 8  19 o 10 106.811 2.56231 204.641     13.9548  200.44      13.4357  41.2364    262.752     58.9726     82.7521     
1 1 1 21 8  20 o 9  135.505 2.57311 331.111     16.9792  320.605     17.9048  84.785     245.433     13.2789     65.4329     
1 1 1 21 8  21 o 15 212.751 2.80011 816.613     29.8125  789.064     29.888   128.422    21.8409     44.3083     201.841     
1 1 1 21 8  22 o 18 181.398 2.62246 594.408     23.7932  572.791     23.8786  111.403    24.2041     30.7389     204.204     
1 1 1 21 8  23 o 4  387.488 3.80355 2693.22     73.8305  2638        73.8825  314.855    69.7992     73.8911     69.7992     
1 1 1 21 8  24 o 3  157.917 2.56951 455.373     20.263   429.32      20.3893  140.433    171.338     73.4407     171.338     
1 1 1 21 8  25 o 18 191.188 2.57995 672.776     24.6357  624.198     24.7712  85.6389    231.073     97.6524     51.0726     
1 1 1 21 8  26 o 1  147.349 2.57009 387.602     18.8772  382.527     19.077   83.1603    77.8432     34.8053     257.843     
1 1 1 21 8  27 o 6  133.725 2.43318 322.782     16.5361  311.918     16.0498  26.5139    273.913     131.175     93.9126     
1 1 1 21 8  28 f 0  163.619 2.48505 486.591     20.7495  463.11      20.0058  54.1095    218.422     0           0           
1 1 1 21 8  29 o 18 452.772 4.27471 3661.42     100.93   3623.82     92.9315  311.336    63.8927     23.8559     243.893     
1 1 1 21 8  30 o 16 344.714 3.59221 2110.28     63.3369  2109.16     60.7478  253.436    88.4949     17.9585     88.4949     
1 1 1 21 8  31 o 8  202.865 2.63956 741.065     27.3092  719.019     26.3619  108.055    102.403     67.1831     282.403     
1 1 1 21 8  32 o 8  231.347 2.95951 992.283     32.7043  908.006     35.6719  195.601    351.479     70.2861     351.479     
1 1 1 21 8  33 o 8  290.07  3.221   1499.7      46.7368  1487.28     46.9064  237.081    19.1944     67.2412     19.1944     
1 1 1 21 8  34 o 4  53.5486 3.20905 54.5635     8.69396  48.0677     8.35789  0.337835   108.769     46.2423     288.769     
1 1 1 21 8  35 o 4  252.967 2.81058 1124.44     35.5375  1146.67     35.7223  207.978    137.125     64.0204     137.125     
1 1 1 21 8  36 o 3  297.569 3.17943 1560.85     46.456   1583.4      48.3627  205.173    60.412      6.94898     240.412     
1 1 1 21 8  37 o 11 77.5266 2.64049 106.94      10.1306  106.86      10.3256  42.554     342.673     4.30737     342.673     
1 1 1 21 8  38 o 15 156.34  2.60445 428.358     19.6296  439.194     21.1689  104.535    320.654     3.87531     140.654     
1 1 1 21 8  39 o 1  144.594 2.64924 366.366     19.4896  376.357     18.8554  88.1374    46.0914     20.4811     226.091     
1 1 1 21 8  40 o 8  196.562 2.68356 681.894     24.5701  689.92      28.194   142.297    345.075     13.3722     345.075     
1 1 1 21 8  41 o 2  69.2382 2.89843 80.9661     9.4305   90.0475     10.6003  19.4425    233.041     48.0644     53.0405     
1 1 1 21 8  42 f 0  158.839 2.47487 430.048     18.7026  466.156     20.7034  107.107    319.014     0           0           
1 1 1 21 8  43 o 3  133.9   2.51703 310.799     15.7784  326.524     17.9473  87.6453    320.408     5.23463     140.408     
1 1 1 21 8  44 o 17 87.5492 2.68672 125.867     11.0869  147.437     12.4458  47.2844    228.904     18.3986     48.9042     
1 1 1 21 8  45 o 14 102.777 2.48607 179.192     12.3476  196.741     13.2292  40.8438    348.19      55.4864     168.19      
1 1 1 21 8  46 o 1  50.7269 3.55162 41.0087     8.3816   51.9131     9.43531  8.75083    68.0871     41.5501     248.087     
1 1 1 21 8  47 o 9  118.663 2.47365 231.713     14.4708  269.976     14.8805  79.8152    6.74927     1.70364     6.74928     
1 1 1 21 8  48 o 16 162.299 2.55667 454.732     19.1749  482.332     22.3711  108.598    214.285     2.63518     34.2848     
1 1 1 21 8  49 o 14 100.818 2.69175 174.925     13.6612  187.5       13.4694  64.5026    333.988     3.0319      153.989     
1 1 1 21 8  50 o 10 71.9253 2.92451 92.1047     10.3341  92.8833     10.6583  52.2937    235.892     21.3355     235.892     
1 1 1 21 8  51 o 7  77.8295 2.84378 103.81      10.8719  112.781     11.2339  33.8171    38.1487     32.2698     218.149     
1 1 1 21 8  52 o 16 136.145 2.50085 333.132     16.3378  327.181     17.7272  96.6477    188.825     11.9237     188.825     
1 1 1 21 8  53 o 19 25.4565 4.83939 20.0648     6.89885  1.69568     7.82676  4.62779    64.0286     28.6649     64.0286     
1 1 1 21 8  54 o 11 113.055 2.51777 222.585     13.6191  233.521     14.871   82.9431    286.825     15.9752     286.825     
1 1 1 21 8  55 o 10 49.3152 3.86839 43.2114     8.66827  45.304      10.098   19.9586    271.738     22.0359     91.738      
1 1 1 21 8  56 o 10 101.842 2.6463  186.894     13.4979  184.012     13.4678  74.2193    130.654     14.1676     130.654     
1 1 1 21 8  57 o 10 19.1233 5.08361 -0.744699   7.10907  8.77794     7.01676  1.38595    340.281     11.3504     340.281     
1 1 1 21 8  58 o 3  43.0324 4.13303 34.6456     8.85188  33.6021     8.51402  22.8446    145.645     5.61604     325.645     
1 1 1 21 8  59 o 8  23.6049 5.39947 7.88875     7.43649  12.0692     7.30489  3.23016    270.567     11.3639     90.5666     
1 1 1 21 8  60 o 6  40.4296 4.48304 34.757      8.75696  26.4954     8.69797  10.8579    187.699     27.935      7.69919     
1 1 1 21 8  61 o 3  48.401  4.0419  52.9445     9.48295  34.3143     9.34053  18.1401    137.773     24.3963     317.773     
1 1 1 21 8  62 o 7  29.4852 5.44917 17.6055     8.08763  15.9048     8.20742  11.7428    76.6545     5.42763     256.655     
1 1 1 21 8  63 o 17 111.98  2.88305 220.133     16.8818  231.375     15.3337  76.1425    41.1192     6.62977     41.1191     
1 1 1 21 8  64 o 1  96.9616 3.1445  165.033     15.5674  175.032     14.8687  62.9158    357.897     0.462974    357.897     
1 1 1 21 8  65 o 3  76.6304 3.56795 97.9905     14.0279  116.643     13.0136  45.6555    351.335     6.85845     171.335     
1 1 1 21 8  66 o 10 56.893  3.77666 52.9579     10.4763  66.685      10.7056  35.502     197.329     0.430954    17.3295     
1 1 1 21 8  67 o 5  35.9652 5.04608 30.3753     8.973    20.1471     8.57177  17.394     263.081     7.90511     83.0806     
1 1 1 21 8  68 o 8  27.5754 5.65682 11.6802     8.37953  18.2758     8.42494  14.2147    31.6299     3.46188     31.6299     
1 1 1 21 8  69 o 4  29.0567 5.72882 17.3528     8.40013  16.4641     8.92612  12.5826    82.675      7.02978     262.675     
1 1 1 21 8  70 o 15 21.8519 5.536   -7.21659    10.2602  15.3939     8.59208  2.96227    174.277     30.1844     174.277     
1 1 1 21 8  71 o 17 41.0632 5.94506 33.8621     11.829   34.5713     11.8147  26.9099    135.998     6.35794     135.998     
1 1 1 21 8  72 o 9  35.955  6.12718 35.9383     11.5886  18.1993     10.7841  23.204     15.6165     13.2435     15.6165     
1 1 1 21 8  73 o 4  31.413  6.9972  35.1129     15.5499  8.36588     10.484   11.3552    19.8097     11.6587     199.81      
1 1 1 21 8  74 o 10 57.1291 5.23547 70.6511     16.7201  58.1188     12.5006  39.8461    119.895     11.1458     119.895     
1 1 1 21 8  75 o 7  29.5224 7.25835 16.1582     14.3896  19.5681     12.192   12.6202    248.279     5.9311      68.2791     
1 1 1 21 8  76 o 15 30.6145 7.66048 19.4348     16.4531  20.1296     13.1394  15.4252    319.14      1.3201      139.14      
1 1 1 21 8  77 o 11 37.901  7.02045 43.1417     14.5664  20.7441     13.4459  22.1181    133.977     1.54435     133.977     
1 1 1 21 8  78 o 3  33.1457 7.3654  25.8433     13.5148  23.9722     13.7805  16.4972    165.261     3.13138     345.261     
1 1 1 21 8  79 o 17 27.4301 7.10491 11.7889     12.9622  20.1201     12.965   11.3428    239.6       2.54983     59.6        
1 1 1 21 8  80 o 14 19.1042 6.08408 -4.12461    12.2761  2.02955     12.3846  1.34475    138.611     4.93665     318.611     
1 1 1 21 8  81 o 8  21.965  6.64601 7.70002     13.2282  4.27891     12.8307  1.25974    269.806     1.40088     89.8058     
1 1 1 21 8  82 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 9  0  o 4  105.093 2.61786 196.488     13.7485  196.488     13.7485  73.5066    180         40.8174     180         
1 1 1 21 9  1  o 18 262.673 3.32704 1224.49     43.7271  1223.47     43.8648  183.774    305.774     11.3496     125.774     
1 1 1 21 9  2  o 16 395.442 4.19618 2794.12     85.1006  2757.96     81.1891  267.217    166.244     42.8025     346.244     
1 1 1 21 9  3  o 13 272.67  3.36906 1329.19     45.9825  1308.78     46.0883  229.685    267.325     67.2765     267.325     
1 1 1 21 9  4  o 14 366.318 4.02005 2404.01     73.7784  2359.74     73.8145  308.085    159.881     83.6803     159.881     
1 1 1 21 9  5  o 7  267.712 3.53665 1274.75     50.0144  1268.48     44.7477  124.303    4.98682     139.776     184.987     
1 1 1 21 9  6  o 5  121.299 2.82772 263.031     17.5978  259.394     16.7276  92.019     357.446     30.4658     357.446     
1 1 1 21 9  7  o 10 198.122 3.03446 714.712     29.2924  677.93      30.885   147.899    13.1819     14.9275     13.1819     
1 1 1 21 9  8  o 13 62.1298 3.28574 72.0933     10.0825  65.7017     10.2053  17.8239    196.098     110.79      196.098     
1 1 1 21 9  9  o 18 45.697  3.7325  36.9268     8.60826  38.1798     8.15382  13.8915    136.421     62.8767     136.421     
1 1 1 21 9  10 o 6  122.005 2.89944 250.617     17.8047  278.34      17.5484  45.4435    293.973     76.9722     113.973     
1 1 1 21 9  11 o 2  89.8486 2.72915 151.405     11.7359  135.661     12.683   51.4685    70.5755     6.44264     70.5755     
1 1 1 21 9  12 o 1  226.631 2.7953  914.011     31.1087  907.766     32.3689  219.052    190.044     119.472     190.044     
1 1 1 21 9  13 o 18 30.0304 4.28789 17.8778     6.11498  15.3284     6.33897  37.8771    73.6557     94.2011     73.6557     
1 1 1 21 9  14 o 5  156.044 2.46404 440.435     18.8749  423.162     19.6343  81.1786    140.096     56.1851     320.096     
1 1 1 21 9  15 o 2  74.5561 2.50565 105.888     9.28011  91.9346     9.34864  18.436     335.277     49.5001     155.277     
1 1 1 21 9  16 o 14 127.727 2.43481 291.136     15.2708  287.841     15.8615  88.2138    257.407     7.11638     257.407     
1 1 1 21 9  17 o 15 430.911 4.01666 3319.57     86.7187  3274.3      86.7555  333.347    333.25      41.9977     333.25      
1 1 1 21 9  18 o 2  127.423 2.49044 295.582     15.1522  280.795     16.5485  70.7803    225.502     30.5827     45.5019     
1 1 1 21 9  19 o 14 83.3987 2.5603  124.197     10.9142  122.959     10.4328  8.33578    193.312     126.16      193.312     
1 1 1 21 9  20 o 8  75.1484 2.57359 103.843     9.19214  96.9859     10.0737  10.1217    61.5982     70.4518     241.598     
1 1 1 21 9  21 o 4  242.161 2.77194 1039.88     32.3469  1040.42     34.8845  201.704    153.778     60.843      153.778     
1 1 1 21 9  22 o 3  149.377 2.40252 410.163     17.5989  381.457     18.3199  83.9366    41.158      37.93       221.158     
1 1 1 21 9  23 o 11 212.149 2.63757 812.324     27.4677  784.32      28.579   107.68     142.618     85.532      322.618     
1 1 1 21 9  24 o 8  159.362 2.3449  462.99      17.86    437.873     19.5013  107.918    73.0951     2.94518     253.095     
1 1 1 21 9  25 o 16 137.058 2.42853 340.499     16.2267  326.074     17.0829  98.5532    271.996     15.0593     271.996     
1 1 1 21 9  26 o 16 147.189 2.47068 385.513     17.7709  382.936     18.6638  100.515    255.747     1.85368     255.747     
1 1 1 21 9  27 o 14 172.019 2.54214 526.465     21.4224  523.19      22.393   93.2468    0.930751    52.7923     180.931     
1 1 1 21 9  28 o 15 304.646 3.29708 1658.06     50.2703  1636.61     50.4007  226.942    359.729     21.1402     359.729     
1 1 1 21 9  29 o 15 36.843  4.35452 27.6007     7.78032  22.0922     7.68537  21.4983    158.958     65.9434     158.958     
1 1 1 21 9  30 o 4  329.205 3.53849 1952.42     54.2985  1896.45     62.072   281.069    170.332     95.8426     170.332     
1 1 1 21 9  31 o 13 226.904 2.88599 919.442     31.9911  907.735     33.6112  122.883    176.969     73.6258     356.969     
1 1 1 21 9  32 o 18 287.69  3.11057 1496.97     43.8576  1441.45     45.7659  190.598    210.988     25.3327     30.9881     
1 1 1 21 9  33 o 11 225.372 2.74091 902.157     30.791   900.383     31.1214  133.132    336.194     49.7629     156.194     
1 1 1 21 9  34 o 3  94.327  2.55346 149.672     11.9232  166.742     12.158   48.4491    287.549     22.5751     107.549     
1 1 1 21 9  35 o 16 183.322 2.51369 609.166     22.9927  583.542     23.1814  154.424    348.275     57.6147     348.275     
1 1 1 21 9  36 o 1  50.6565 3.4739  50.8092     8.68908  41.4769     8.65092  8.71085    16.0153     13.7739     196.015     
1 1 1 21 9  37 o 6  124.648 2.40067 273.148     14.849   278.658     15.1155  93.8021    20.0361     21.7146     20.0361     
1 1 1 21 9  38 o 3  206.337 2.71468 740.71      28.4039  771.171     27.7109  170.696    267.337     55.4188     267.337     
1 1 1 21 9  39 o 10 326.392 3.25906 1879.44     52.1056  1907.61     54.4992  252.921    293.78      48.3142     293.78      
1 1 1 21 9  40 o 18 83.2853 2.68887 122.609     11.0307  124.286     11.3549  38.0025    213.582     31.9492     33.5817     
1 1 1 21 9  41 o 8  52.8367 3.56938 47.4987     8.74974  52.84       9.92875  19.8256    0.123057    10.0569     180.123     
1 1 1 21 9  42 o 1  61.6444 3.27456 56.1745     9.47648  80.9225     10.5057  13.9841    80.9109     48.5643     260.911     
1 1 1 21 9  43 o 19 125.43  2.58257 279.879     15.5538  279.645     16.8517  99.907     123.852     32.7009     123.852     
1 1 1 21 9  44 o 4  80.8591 2.99977 113.859     11.62    119.444     12.6043  45.3754    131.776     12.7549     311.776     
1 1 1 21 9  45 o 19 167.334 2.48068 485.262     20.5276  510.193     21.0779  133.368    190.688     39.0053     190.688     
1 1 1 21 9  46 o 11 117.442 2.67459 246.019     15.3749  245.159     16.0577  80.856     4.82318     4.73485     4.82318     
1 1 1 21 9  47 o 19 131.108 2.50321 281.858     16.1183  330.997     16.7074  95.8625    170.57      15.7569     170.57      
1 1 1 21 9  48 o 19 134.075 2.54941 311.88      16.8438  328.443     17.3856  87.5018    4.44454     5.47487     184.445     
1 1 1 21 9  49 o 6  117.923 2.58282 246.647     15.3055  248.963     15.1835  78.8183    210.631     0.714169    210.631     
1 1 1 21 9  50 f 0  96.3218 2.60022 160.32      12.2835  170.721     12.7747  61.8133    154.129     0           0           
1 1 1 21 9  51 f 0  42.4304 4.24494 28.9394     8.70189  37.2896     8.72167  38.4431    197.083     0           0           
1 1 1 21 9  52 o 12 78.586  2.84151 106.467     10.9487  114.598     11.3582  50.1636    64.9407     1.76498     244.941     
1 1 1 21 9  53 o 9  19.9844 5.22406 9.09251     6.92902  0.366226    7.80319  1.14672    286.766     9.48703     286.766     
1 1 1 21 9  54 o 14 68.8623 2.99715 76.2728     10.3508  94.4808     10.1098  37.832     17.8914     14.2269     197.891     
1 1 1 21 9  55 o 11 18.2768 5.09487 5.19563     7.04421  1.81583     6.80024  3.8563     358.371     18.6095     358.371     
1 1 1 21 9  56 o 2  46.2169 4.13469 43.5998     9.41281  35.1031     9.22647  28.7501    4.20716     2.1048      4.20715     
1 1 1 21 9  57 o 13 43.4627 4.31233 33.6448     9.06645  36.2613     9.19598  27.5974    33.357      4.65604     33.357      
1 1 1 21 9  58 o 7  37.4518 4.60555 25.107      8.11692  27.5303     8.54582  12.62      20.3187     19.7082     200.319     
1 1 1 21 9  59 o 17 38.7188 4.59694 21.2703     8.16259  35.8234     8.86527  20.7386    39.3443     3.40215     219.344     
1 1 1 21 9  60 o 10 14.948  4.5904  -6.47042    6.59036  2.59282     6.79265  0.276204   98.5081     1.13398     98.5081     
1 1 1 21 9  61 o 4  37.6905 4.73741 23.8659     8.73809  29.9279     8.42582  24.1349    233.018     9.00258     233.018     
1 1 1 21 9  62 o 10 77.1876 2.94311 107.292     11.3722  107.741     11.3123  64.7125    312.364     31.1512     312.364     
1 1 1 21 9  63 f 0  41.5229 4.37341 31.1328     8.85449  33.4339     8.77858  33.8794    182.222     0           0           
1 1 1 21 9  64 o 17 24.578  5.88744 5.71026     10.018   14.488      8.19847  3.87345    21.1206     18.8429     201.121     
1 1 1 21 9  65 o 6  24.3618 5.8498  8.34248     8.94034  12.9799     8.35327  3.9564     209.582     18.9572     29.5824     
1 1 1 21 9  66 o 14 119.501 2.7408  245.296     16.3325  271.109     16.424   100.178    6.23831     46.0277     6.2383      
1 1 1 21 9  67 o 11 16.7769 5.05599 -3.57936    7.62007  3.87156     7.75247  1.95172    43.0606     19.3188     43.0606     
1 1 1 21 9  68 o 5  14.2903 4.51605 2.40349     6.75919  -16.9427    8.43654  1.41137    23.6284     11.1546     23.6284     
1 1 1 21 9  69 o 19 25.7707 6.422   23.8778     13.0871  -0.194763   9.53063  10.557     304.224     4.21848     124.224     
1 1 1 21 9  70 o 9  44.5068 6.20172 47.0153     15.145   34.5614     11.5992  22.9929    248.989     7.88744     68.9889     
1 1 1 21 9  71 o 14 20.6976 6.15617 9.81465     12.3387  -3.84516    9.87575  4.01639    286.157     5.72685     106.157     
1 1 1 21 9  72 o 7  29.2815 6.89533 14.1145     13.3952  20.6619     10.962   12.3061    235.948     5.07166     55.9482     
1 1 1 21 9  73 o 8  48.3654 5.85232 50.561      15.1051  44.3453     12.2171  27.3859    239.924     3.15622     59.9239     
1 1 1 21 9  74 o 17 42.8661 5.98421 43.4227     12.9282  32.1597     11.8884  32.7648    69.4452     18.1696     69.4452     
1 1 1 21 9  75 o 6  67.8979 4.69081 76.9501     15.8177  101.63      15.2652  45.1285    138.994     6.77298     138.994     
1 1 1 21 9  76 o 15 26.151  6.90745 11.3946     12.1302  14.9836     12.2744  3.40529    258.109     22.2897     78.1091     
1 1 1 21 9  77 o 11 33.6779 6.92783 16.2143     12.8802  34.2404     13.1193  19.9628    46.3925     4.0575      46.3925     
1 1 1 21 9  78 o 2  17.3934 5.69376 -1.65667    11.9348  -10.0773    11.7499  0.980507   89.3205     7.05124     269.32      
1 1 1 21 9  79 o 9  16.4645 5.46046 -3.65163    11.4887  -11.3762    11.4207  0.201085   8.37074     5.42257     8.37076     
1 1 1 21 9  80 o 18 30.5246 6.78307 3.19562     14.3639  36.1671     13.4404  7.56182    270.584     3.24443     270.584     
1 1 1 21 9  81 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 10 0  o 16 242.71  3.27574 1045.56     39.8107  1045.56     39.8107  238.613    5.93368e-06 119.426     5.93368e-06 
1 1 1 21 10 1  o 19 41.5722 3.78993 31.133      7.86257  31.2291     7.55746  14.2657    180.925     53.7648     180.925     
1 1 1 21 10 2  o 3  154.564 2.77755 414.021     20.4047  433.76      22.5904  135.898    337.717     63.2263     337.717     
1 1 1 21 10 3  o 17 469.204 4.86437 3815.59     114.326  4009.85     114.381  416.464    111.492     146.394     111.492     
1 1 1 21 10 4  o 19 315.973 3.49096 1767.19     55.2883  1776.09     55.2683  236.077    283.904     12.5758     283.904     
1 1 1 21 10 5  o 12 161.204 2.57026 456.985     20.3066  464.656     21.218   59.9377    178.483     109.596     358.483     
1 1 1 21 10 6  o 16 233.17  2.93901 962.813     35.0178  965.884     33.6517  150.173    274.998     35.7881     94.9976     
1 1 1 21 10 7  o 4  243.589 3.12191 1090.44     36.1576  1015.43     39.8077  142.018    303.146     68.1557     123.146     
1 1 1 21 10 8  f 0  254.084 2.98767 1158.45     37.9737  1131.94     38.1061  196.004    100.539     0           0           
1 1 1 21 10 9  f 0  236.411 2.89376 1001.03     34.1765  981.678     34.3864  238.492    103.124     0           0           
1 1 1 21 10 10 o 1  176.043 2.87321 564.153     26.4994  535.418     24.1917  78.8925    3.2548      93.1163     183.255     
1 1 1 21 10 11 o 6  164.757 2.62678 472.169     21.131   490.7       22.2468  78.2672    200.6       76.7387     20.5999     
1 1 1 21 10 12 o 6  141.08  2.4874  354.878     17.5096  351.238     17.6472  95.1577    338.899     2.61587     158.899     
1 1 1 21 10 13 o 7  98.7811 2.62543 177.694     12.3777  168.948     13.5088  54.6697    43.0871     14.1328     223.087     
1 1 1 21 10 14 o 9  108.258 2.51093 202.145     13.3589  214.05      13.8504  17.5442    5.30479     112.982     185.305     
1 1 1 21 10 15 o 17 85.9799 2.47754 128.939     10.6739  133.704     10.6283  8.86337    93.0807     94.3354     273.081     
1 1 1 21 10 16 o 12 133.981 2.48756 306.888     16.7694  330.43      16.5814  53.9173    53.6256     77.8207     233.626     
1 1 1 21 10 17 o 4  130.502 2.51524 311.128     15.7221  293.503     17.0684  84.9333    218.525     5.57281     38.5254     
1 1 1 21 10 18 o 4  60.0408 2.92262 66.2765     8.11259  62.2627     9.27964  10.6673    352.374     89.3801     352.374     
1 1 1 21 10 19 o 16 97.1478 2.48016 163.644     11.7725  171.579     12.3387  12.5581    8.06098     104.917     188.061     
1 1 1 21 10 20 f 0  279.419 3.02991 1404.81     41.5524  1365.85     43.255   161.07     234.336     0           0           
1 1 1 21 10 21 o 13 73.137  2.75682 95.0015     9.16624  95.3054     10.8944  14.7009    311.951     122.934     311.951     
1 1 1 21 10 22 o 8  211.725 2.67141 805.019     27.1428  785.327     29.4666  163.688    169.543     29.1744     169.543     
1 1 1 21 10 23 o 9  183.289 2.49705 588.663     22.4387  603.037     23.4327  153.435    47.0592     53.8209     47.0592     
1 1 1 21 10 24 o 2  182.664 2.50183 599.749     22.388   583.867     23.3881  72.2258    118.174     113.628     298.174     
1 1 1 21 10 25 o 8  333.602 3.23132 1975.35     52.9623  1975.15     55.0606  291.713    339.141     106.875     339.141     
1 1 1 21 10 26 o 11 103.396 2.48513 189.974     12.7613  189.693     12.9543  73.6041    244.624     30.7278     244.624     
1 1 1 21 10 27 o 6  95.7208 2.44234 168.265     11.3734  157.267     11.9806  48.5475    154.12      23.242      334.12      
1 1 1 21 10 28 f 0  46.7016 3.56432 45.9212     7.66462  32.9906     8.38458  19.2873    181.832     0           0           
1 1 1 21 10 29 o 19 65.9007 2.9257  78.2595     8.99666  76.4896     10.1764  18.4291    114.171     4.60325     294.171     
1 1 1 21 10 30 o 17 204.898 2.67825 752.86      26.8264  736.974     28.1436  170.821    294.846     56.707      294.846     
1 1 1 21 10 31 o 5  281.007 2.90294 1399.5      40.0165  1403.52     41.7287  228.75     194.989     60.3033     194.989     
1 1 1 21 10 32 o 5  231.517 2.78057 961.778     30.9108  940.83      33.5259  190.076    163.731     55.6228     163.731     
1 1 1 21 10 33 o 12 68.851  2.83603 83.4118     9.41464  85.4578     10.0672  25.118     328.072     29.8755     148.072     
1 1 1 21 10 34 o 1  150.997 2.35875 404.532     17.7579  404.528     17.9394  74.6928    354.043     60.1072     174.043     
1 1 1 21 10 35 o 18 218.185 2.51971 859.586     27.4643  830.285     27.6282  153.566    109.841     1.03965     109.841     
1 1 1 21 10 36 o 1  216.905 2.53698 838.009     27.4475  832.207     27.7049  128.26     199.337     48.1734     19.3368     
1 1 1 21 10 37 o 3  363.418 3.38127 2327.58     62.6272  2368.95     60.4936  241.277    133.583     30.9118     313.583     
1 1 1 21 10 38 o 9  228.923 2.86234 921.123     32.6004  941.058     33.0752  181.124    109.395     42.5091     109.395     
1 1 1 21 10 39 o 4  188.125 2.4982  623.064     23.4085  633.895     23.6965  137.611    116.602     14.2119     116.601     
1 1 1 21 10 40 o 6  33.0211 4.7678  18.8449     7.59116  21.5612     7.65509  4.55047    223.598     30.3794     223.598     
1 1 1 21 10 41 o 4  37.0209 4.43985 19.4572     7.91249  31.4757     7.70272  25.6208    62.2824     94.218      62.2824     
1 1 1 21 10 42 o 2  116.581 2.50693 247.257     14.7491  236.244     14.5083  87.7626    321.442     19.6715     321.442     
1 1 1 21 10 43 o 18 122.276 2.40939 266.093     14.874   265.674     14.6247  81.569     53.586      2.17884     233.586     
1 1 1 21 10 44 f 0  146.317 2.59389 380.752     18.6599  380.926     19.3572  112.324    159.942     0           0           
1 1 1 21 10 45 o 12 99.5577 2.88792 164.654     13.306   189.352     15.4669  66.1707    137.585     0.538253    137.586     
1 1 1 21 10 46 o 2  79.7098 2.91009 107.527     10.9924  119.629     12.1863  57.6339    222.831     15.4087     222.831     
1 1 1 21 10 47 o 12 123.508 2.59263 272.011     15.3243  271.604     16.7028  88.9953    352.146     12.3754     352.146     
1 1 1 21 10 48 o 5  35.2043 4.90118 19.9498     7.83091  26.4711     8.86952  10.3836    180.722     59.4218     180.722     
1 1 1 21 10 49 o 14 65.5408 3.24404 74.7941     9.72065  79.4953     11.4273  33.1888    134.793     16.4071     314.793     
1 1 1 21 10 50 o 10 61.0144 3.57855 63.5494     9.95838  70.8352     11.7268  36.3197    8.38727     3.42085     188.387     
1 1 1 21 10 51 o 10 152.412 2.75229 394.388     20.7823  435.491     21.2228  127.608    9.58137     49.0388     9.58137     
1 1 1 21 10 52 o 10 105.379 2.84771 189.101     14.3075  208.5       15.7234  72.1334    295.055     2.85313     295.055     
1 1 1 21 10 53 o 18 18.6522 5.32604 4.80052     7.41202  0.632526    8.18059  6.20451    232.325     26.6895     232.325     
1 1 1 21 10 54 o 11 58.6909 3.69771 62.4174     11.1055  62.6306     10.4033  19.2927    298.634     38.0955     118.634     
1 1 1 21 10 55 o 19 34.583  5.34548 26.9573     8.65196  18.7196     9.41456  6.19852    218.72      29.1589     38.7203     
1 1 1 21 10 56 o 10 66.1503 3.59654 80.5944     10.619   78.256      12.8766  54.6791    325.056     25.7076     325.056     
1 1 1 21 10 57 o 3  39.2736 4.61786 28.7887     8.56339  29.0141     8.97257  24.4811    232.001     13.5121     232.001     
1 1 1 21 10 58 o 6  34.2808 5.02594 21.0735     8.17291  23.7581     8.53319  17.4233    120.938     2.51499     300.938     
1 1 1 21 10 59 o 14 83.8509 2.87456 130.267     11.9426  123.006     12.1294  63.223     316.38      17.2251     316.38      
1 1 1 21 10 60 o 15 17.9439 5.15044 4.94552     7.06707  -0.207735   7.71267  0.0274348  320.765     1.54738     140.765     
1 1 1 21 10 61 o 7  67.7106 3.4087  81.6897     11.0367  85.0943     11.9411  46.402     139.059     5.92328     139.059     
1 1 1 21 10 62 o 8  53.3321 3.87579 52.6381     9.49777  52.1271     10.8563  28.9328    237.183     9.77387     57.1828     
1 1 1 21 10 63 o 13 17.8692 5.2465  -0.941983   7.45158  4.68086     8.19692  1.3705     176.304     5.50779     356.304     
1 1 1 21 10 64 o 14 70.0896 3.4354  85.7322     12.0355  94.0803     11.9199  45.8271    202.32      1.52105     202.32      
1 1 1 21 10 65 o 11 55.9245 4.19803 68.5984     12.1947  49.1957     10.8893  30.4404    283.573     10.1739     103.573     
1 1 1 21 10 66 o 19 74.1724 3.76922 93.3992     15.2165  110.536     11.9709  49.5921    131.204     4.16849     131.204     
1 1 1 21 10 67 o 10 25.7209 5.95034 16.9635     9.50575  8.75333     8.48983  10.2413    194.141     3.42313     194.141     
1 1 1 21 10 68 o 3  43.6105 5.70447 36.9122     13.8382  39.1549     9.80554  31.9692    219.581     12.6127     219.581     
1 1 1 21 10 69 o 1  55.8019 4.94866 58.2812     15.3687  62.3846     10.8458  35.4073    139.727     1.57702     139.727     
1 1 1 21 10 70 o 12 17.9821 5.77119 -0.681479   12.0909  -6.73585    10.4427  1.33569    2.10073     5.76741     182.101     
1 1 1 21 10 71 o 18 39.4634 5.9517  35.2433     11.6531  28.8757     11.1897  23.7425    19.6805     2.4923      19.6805     
1 1 1 21 10 72 o 9  59.3148 4.62637 56.3888     13.2481  80.1118     13.383   38.6072    124.089     4.36042     124.089     
1 1 1 21 10 73 o 5  34.8296 6.29702 9.66366     11.6199  42.1629     12.9845  22.7789    93.3263     8.60494     93.3263     
1 1 1 21 10 74 o 3  19.665  6.02401 6.53857     11.7562  -5.38775    10.6538  4.29155    111.899     2.38767     291.899     
1 1 1 21 10 75 o 7  24.9065 6.80057 7.04152     12.1031  14.7648     12.305   10.4246    347.289     2.12251     167.289     
1 1 1 21 10 76 o 7  31.4946 7.33978 26.8546     13.2502  17.4781     14.2585  16.2706    58.5701     1.16131     238.57      
1 1 1 21 10 77 o 17 26.719  7.04913 20.6553     13.0699  8.43131     13.1075  9.8584     320.084     6.42952     140.084     
1 1 1 21 10 78 o 19 18.97   6.07617 -1.15747    12.1236  -1.52922    12.75    1.45239    53.5409     6.96667     233.541     
1 1 1 21 10 79 o 8  21.5232 6.76636 -7.60932    12.2695  13.7133     17.0386  2.15507    174.743     3.30679     354.743     
1 1 1 21 10 80 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 11 0  o 10 47.2467 3.36847 40.773      7.77505  40.773      7.77505  22.2558    360         96.7154     360         
1 1 1 21 11 1  o 16 210.649 2.84803 785.649     30.6878  788.512     29.4268  159.145    217.332     16.8908     217.332     
1 1 1 21 11 2  o 7  163.585 2.80024 499.295     22.2502  450.929     23.5126  115.378    231.49      1.35787     231.49      
1 1 1 21 11 3  o 13 160.5   2.62132 469.02      20.489   444.853     21.6228  116.595    252.948     9.14578     252.948     
1 1 1 21 11 4  o 13 311.868 3.29082 1762.68     50.3404  1689.47     52.4402  280.036    104.336     107.721     104.336     
1 1 1 21 11 5  o 12 266.369 2.93225 1277.8      39.109   1239.65     39.1678  138.126    40.4677     111.305     220.468     
1 1 1 21 11 6  o 12 92.984  2.52421 162.673     11.3994  144.696     12.0063  52.9608    228.364     4.52168     48.364      
1 1 1 21 11 7  o 18 128.255 2.41552 294.135     15.0696  289.665     15.9341  73.2856    318.177     28.8423     138.177     
1 1 1 21 11 8  o 3  96.7719 2.41826 172.287     11.613   160.361     11.7869  60.5775    275.056     7.9823      275.056     
1 1 1 21 11 9  o 19 342.882 3.42815 2085.81     56.5614  2087.33     61.1632  290.083    202.489     81.5814     202.489     
1 1 1 21 11 10 o 19 286.735 3.32548 1474.36     45.44    1443.81     49.9713  208.76     148.191     1.90026     148.191     
1 1 1 21 11 11 o 14 146.613 2.55638 390.797     18.6172  371.998     18.9147  96.1858    183.837     10.4421     3.83651     
1 1 1 21 11 12 o 5  308.747 3.47973 1683.3      51.1961  1700.7      56.3848  198.761    206.3       51.1202     26.2999     
1 1 1 21 11 13 o 9  244.787 2.96567 1050.75     35.4304  1075.48     37.3247  189.21     1.78533     26.9764     1.78532     
1 1 1 21 11 14 o 12 158.399 2.69148 461.654     21.131   428.988     21.542   85.9479    179.1       50.8393     359.1       
1 1 1 21 11 15 o 10 188.023 2.75396 615.529     25.7487  638.794     26.1497  159.862    55.1081     56.9309     55.1081     
1 1 1 21 11 16 o 4  131.884 2.55278 311.627     16.3187  305.824     17.3659  73.9351    85.1939     32.7871     265.194     
1 1 1 21 11 17 o 18 111.715 2.74557 223.427     15.2079  219.89      15.4833  53.5478    138.81      42.2749     318.81      
1 1 1 21 11 18 o 14 79.9898 2.76805 117.476     10.6161  110.135     11.455   13.7968    5.75284     133.171     5.75284     
1 1 1 21 11 19 o 16 211.431 2.84017 793.352     29.3027  792.823     30.8636  191.944    69.9795     87.3944     69.9796     
1 1 1 21 11 20 o 4  158.007 2.7724  427.765     22.3529  458.623     21.4723  147.502    149.274     86.3805     149.274     
1 1 1 21 11 21 o 16 137.74  2.64769 338.104     16.8944  335.482     19.5179  96.0824    255.829     5.78378     255.829     
1 1 1 21 11 22 o 15 442.252 4.36564 3437.52     90.2888  3515.93     102.938  372.459    333.135     105.341     333.135     
1 1 1 21 11 23 f 0  210.932 2.84323 797.386     27.9051  781.476     32.0189  183.44     184.958     0           0           
1 1 1 21 11 24 o 12 254.148 2.96129 1120.52     36.0251  1172.17     39.3935  166.981    28.0377     29.258      208.038     
1 1 1 21 11 25 o 11 261.502 2.96428 1210.78     37.9841  1216.34     39.6942  220.644    120.988     69.5294     120.988     
1 1 1 21 11 26 o 6  91.6782 2.59191 152.59      11.525   146.132     12.2136  39.9401    285.536     37.4021     105.536     
1 1 1 21 11 27 o 14 335.935 3.60059 1990.25     61.8     2018.99     59.3887  266.937    296.257     52.9488     296.257     
1 1 1 21 11 28 o 18 91.9598 2.76643 152.832     12.2134  147.868     13.1879  41.3454    256.246     35.6667     76.2461     
1 1 1 21 11 29 o 11 301.461 3.27404 1633.68     48.3317  1594.28     50.5357  246.098    269.179     62.749      269.179     
1 1 1 21 11 30 o 2  48.8    3.47867 39.0969     8.19347  46.5432     8.56393  6.37336    107.336     64.124      107.336     
1 1 1 21 11 31 o 3  48.0449 3.77947 46.3172     8.1606   37.0401     9.40316  0.456558   13.4279     48.8883     13.4279     
1 1 1 21 11 32 o 18 106.375 2.55188 197.403     13.6075  204.752     13.5563  82.1029    160.895     26.0414     160.895     
1 1 1 21 11 33 o 2  96.7457 2.60084 170.538     12.3055  162.279     12.8425  53.5856    120.986     21.8375     300.986     
1 1 1 21 11 34 o 14 75.7127 2.72805 103.937     9.91591  100.183     10.6853  20.8613    124.514     57.7429     304.514     
1 1 1 21 11 35 o 2  342.347 3.3788  2086.99     57.8675  2081.3      58.0684  275.819    310.412     66.1129     310.412     
1 1 1 21 11 36 f 0  121.64  2.47144 260.817     14.5361  265.054     15.5539  97.3974    34.1897     0           0           
1 1 1 21 11 37 o 11 354.202 3.50756 2217.27     59.7041  2248.85     64.7478  278.247    222.181     55.6833     222.181     
1 1 1 21 11 38 o 9  154.391 2.61843 420.313     19.52    426.67      20.9819  96.3894    14.4382     21.318      194.438     
1 1 1 21 11 39 o 4  227.425 2.62451 918.574     29.1593  919.673     30.6472  180.805    293.151     43.6825     293.151     
1 1 1 21 11 40 o 15 163.96  2.52144 473.583     19.6986  481.879     21.7046  147.126    28.3682     69.4317     28.3682     
1 1 1 21 11 41 f 0  198.058 2.51121 713.413     24.2353  681.254     25.5563  132.296    280.58      0           0           
1 1 1 21 11 42 o 17 166.526 2.4762  500.607     20.043   485.452     21.2463  117.166    253.166     4.31094     253.166     
1 1 1 21 11 43 o 14 165.119 2.47913 482.782     19.8964  486.931     21.1186  111.019    217.484     5.7409      37.4837     
1 1 1 21 11 44 o 18 146.625 2.42188 390.952     17.3242  373.924     18.2292  104.385    348.708     8.17376     348.708     
1 1 1 21 11 45 o 9  51.7641 3.4266  56.5256     8.81928  40.6893     8.58273  25.2629    207.051     5.07472     27.0506     
1 1 1 21 11 46 o 3  88.4568 2.69619 135.383     11.3403  144.009     12.5063  54.6238    126.111     6.86976     306.111     
1 1 1 21 11 47 o 19 65.6819 3.12518 71.4247     10.0212  83.5786     10.4098  49.3539    61.6048     25.6518     61.6048     
1 1 1 21 11 48 o 5  23.7627 5.53404 5.16485     7.43518  14.1513     8.35777  5.73483    15.8248     27.3025     15.8248     
1 1 1 21 11 49 o 16 106.216 2.88935 199.353     13.8178  204.162     16.7695  51.5039    304.841     41.0249     124.841     
1 1 1 21 11 50 o 8  209.984 2.83349 758.536     30.336   817.188     29.2137  146.054    179.994     4.14716     179.994     
1 1 1 21 11 51 o 11 69.9096 3.08938 76.0683     10.6376  100.451     10.7478  60.0321    160.329     30.5071     160.329     
1 1 1 21 11 52 o 18 110.863 2.64324 211.016     14.649   228.849     14.6613  78.2761    138.264     7.17062     138.264     
1 1 1 21 11 53 o 18 37.472  4.70286 20.5087     8.31209  32.6947     8.55554  17.1677    105.31      9.64929     285.31      
1 1 1 21 11 54 o 19 55.9272 3.4222  52.2355     9.63942  61.4188     9.25916  31.0403    109.228     9.96888     289.229     
1 1 1 21 11 55 o 2  26.9413 5.48398 12.7967     8.06485  14.7222     7.58742  2.21016    220.406     35.5209     220.406     
1 1 1 21 11 56 o 14 116.081 2.73336 234.638     15.6288  249.199     16.1289  76.8364    185.777     1.5779      5.77712     
1 1 1 21 11 57 f 0  36.0728 5.14829 18.5803     8.96835  31.709      9.00063  37.5277    61.1748     0           0           
1 1 1 21 11 58 o 15 22.9286 5.60658 8.06933     7.65315  10.1668     8.04674  0.934025   170.877     21.0768     350.877     
1 1 1 21 11 59 o 11 20.5011 5.47892 8.86357     7.887    2.39574     7.91811  1.82602    356.552     23.3284     356.552     
1 1 1 21 11 60 o 10 21.6366 5.73991 7.9756      8.65852  6.10586     8.19691  3.74271    46.3178     9.27839     226.318     
1 1 1 21 11 61 o 4  19.9713 5.56086 -1.15385    9.13283  8.42013     8.11473  2.98141    268.708     7.65679     88.7082     
1 1 1 21 11 62 o 3  12.0443 4.06687 -4.12563    7.16217  -16.5995    6.89296  4.56243    282.694     15.58       282.694     
1 1 1 21 11 63 o 7  34.9861 5.67103 18.9938     9.96182  29.6426     9.67873  20.3457    32.8248     0.364728    212.825     
1 1 1 21 11 64 o 14 100.85  3.04059 181.994     16.7508  188.058     13.6808  73.7012    51.5463     15.9707     51.5463     
1 1 1 21 11 65 o 2  21.814  5.90706 12.0636     9.08206  -1.31439    10.5288  3.82743    201.844     15.3054     21.8444     
1 1 1 21 11 66 o 2  29.1505 6.31511 12.7542     11.8048  20.7589     9.24984  11.1164    232.701     11.1273     52.7008     
1 1 1 21 11 67 o 11 22.8041 6.1062  8.99918     10.2851  8.33667     8.87723  4.19669    2.52031     15.6644     182.52      
1 1 1 21 11 68 o 18 47.0345 5.14507 53.9784     12.0641  34.0152     11.1217  39.7216    45.0525     26.1474     45.0525     
1 1 1 21 11 69 o 4  64.5603 3.94849 92.7493     13.1537  65.317      11.9969  43.8151    327.341     6.78774     327.341     
1 1 1 21 11 70 o 16 17.8778 5.64609 -0.105582   10.159   -3.70947    10.5662  0.823351   182.863     5.10608     2.8627      
1 1 1 21 11 71 o 8  22.1566 6.30883 10.0645     10.9054  2.6808      10.9705  3.81187    323.245     0.537814    143.245     
1 1 1 21 11 72 f 0  51.5388 5.37273 54.3291     13.1659  51.2699     13.7131  36.4218    326.032     0           0           
1 1 1 21 11 73 o 15 22.4342 6.62871 8.66422     11.4155  0.808051    14.1386  6.71025    263.689     0.385722    263.689     
1 1 1 21 11 74 o 15 17.2052 5.71363 -6.8525     10.806   -10.1684    14.1534  0.713221   305.687     12.981      125.687     
1 1 1 21 11 75 o 12 24.7881 7.17478 13.7715     13.0139  3.85775     16.4182  8.63962    108.001     7.14948     288.001     
1 1 1 21 11 76 o 1  21.7681 6.76723 2.17714     12.0694  5.27838     16.2778  5.1745     193.674     5.86191     13.6736     
1 1 1 21 11 77 o 18 22.4545 6.90349 1.46848     12.5099  10.4888     16.2798  4.37879    186.434     3.23497     6.43351     
1 1 1 21 11 78 o 17 20.6487 6.58371 -1.36021    12.7238  3.93792     15.8859  1.96471    262.748     5.90355     82.7482     
1 1 1 21 11 79 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 12 0  o 1  115.681 2.39659 237.815     13.8666  237.815     13.8666  64.2652    1.26105e-05 42.1664     180         
1 1 1 21 12 1  o 7  374.225 3.63899 2467.33     68.2423  2505.33     68.2458  322.873    25.5028     98.3785     25.5028     
1 1 1 21 12 2  f 0  106.59  2.40406 200.287     12.7744  203.086     12.8763  94.9951    138.127     0           0           
1 1 1 21 12 3  o 7  319.243 3.4006  1817.36     52.0523  1800.52     56.6377  232.941    208.653     0.319169    28.6505     
1 1 1 21 12 4  o 1  274.269 3.14509 1347.94     43.238   1321.77     43.2161  220.246    291.581     42.6478     291.581     
1 1 1 21 12 5  f 0  70.8986 2.72756 89.4427     9.30367  89.4097     9.9925   44.1623    231.398     0           0           
1 1 1 21 12 6  f 0  139.562 2.50347 360.376     16.8088  331.061     18.089   177.396    338.217     0           0           
1 1 1 21 12 7  o 3  230.817 2.9543  971.891     33.4254  918.944     34.8456  140.466    73.0721     53.034      253.072     
1 1 1 21 12 8  o 15 67.4632 2.7942  76.6064     9.0032   85.5443     9.81346  19.6376    239.646     22.7036     59.6465     
1 1 1 21 12 9  o 10 102.397 2.65395 192.84      13.3367  179.736     13.8201  58.347     117.056     15.1287     297.056     
1 1 1 21 12 10 o 16 224.96  2.87359 905.338     31.0739  890.354     33.6436  185.679    33.412      49.3482     33.412      
1 1 1 21 12 11 o 13 235.217 2.82425 997.521     32.6531  965.675     33.8913  146.318    313.758     47.217      133.758     
1 1 1 21 12 12 o 4  280.149 3.18315 1419.16     44.6591  1366.79     44.7074  161.044    8.83756     85.1986     188.838     
1 1 1 21 12 13 o 19 241.898 2.87094 1065.95     34.749   1010.74     34.8362  165.492    42.9728     17.9202     222.973     
1 1 1 21 12 14 o 2  177.879 2.57992 579.673     23.2929  543.083     22.7005  77.3919    25.0175     99.4504     205.018     
1 1 1 21 12 15 o 7  231.501 2.81003 972.118     33.1276  929.74      32.0763  170.42     263.421     8.65637     263.421     
1 1 1 21 12 16 o 14 54.2761 3.17468 55.9873     8.03827  49.3986     8.95734  3.89549    289.593     27.3327     109.593     
1 1 1 21 12 17 o 12 211.412 2.83763 793.803     29.2494  792.186     30.8552  112.051    284.639     79.432      104.639     
1 1 1 21 12 18 o 1  43.2173 3.97683 39.0152     7.69602  28.8566     8.71945  12.0963    279.486     54.5478     279.486     
1 1 1 21 12 19 o 1  224.082 2.88115 909.021     32.9001  873.087     31.8115  219.74     276.25      124.294     276.25      
1 1 1 21 12 20 o 1  323.593 3.64503 1855.08     57.5713  1864.35     60.6164  261.086    94.9152     54.7369     94.9152     
1 1 1 21 12 21 o 17 68.384  3.04563 84.7818     10.0523  81.8811     10.6916  24.4468    130.974     17.6224     310.974     
1 1 1 21 12 22 o 18 240.75  3.02312 1047.56     33.8264  1010.04     38.8461  131.055    217.365     83.8278     37.365      
1 1 1 21 12 23 o 14 269.15  3.12219 1265.39     39.3911  1306.7      44.7415  232.958    280.707     81.0715     280.707     
1 1 1 21 12 24 o 11 27.4771 5.26919 13.1383     7.22163  14.6657     7.65804  17.7143    70.0617     45.2524     70.0617     
1 1 1 21 12 25 f 0  172.025 2.58558 518.856     21.723   531.308     22.8537  116.66     15.0588     0           0           
1 1 1 21 12 26 o 9  291.609 3.11906 1502.6      44.4858  1517.26     46.6603  227.297    58.4272     36.5033     58.4272     
1 1 1 21 12 27 o 18 285.655 3.16017 1456.64     43.1479  1441.7      47.216   244.016    69.6417     79.6369     69.6417     
1 1 1 21 12 28 o 4  101.891 2.79626 198.82      12.7638  170.866     15.3536  78.0642    88.754      26.0971     88.754      
1 1 1 21 12 29 o 10 166.448 2.61854 500.069     20.7851  483.509     22.813   133.338    20.3643     34.1797     20.3643     
1 1 1 21 12 30 o 1  77.6738 2.93186 116.561     10.4586  98.7167     12.0286  15.7635    88.6271     72.0736     268.627     
1 1 1 21 12 31 o 12 42.9626 4.16927 34.0807     7.91355  32.8704     9.44672  0.854407   211.646     45.4113     211.646     
1 1 1 21 12 32 o 12 29.759  5.20679 22.4108     7.64669  10.2484     8.37802  6.1471     50.5762     24.6141     50.5762     
1 1 1 21 12 33 f 0  216.845 2.86684 838.807     29.623   832.119     32.6008  139.78     78.1479     0           0           
1 1 1 21 12 34 o 10 196.119 2.85944 688.875     25.9146  678.165     30.1003  125.555    184.462     25.7085     4.46159     
1 1 1 21 12 35 o 14 111.122 2.64208 219.547     13.8005  219.693     15.5322  77.0659    110.534     3.46591     110.534     
1 1 1 21 12 36 o 1  190.216 2.79624 619.05      25.6904  667.725     27.6295  162.188    332.892     58.5072     332.892     
1 1 1 21 12 37 o 18 86.2094 2.73325 127.019     11.5116  137.859     12.0463  51.9957    115.645     9.66673     295.645     
1 1 1 21 12 38 o 8  193.85  2.66476 657.801     25.0759  678.447     26.6932  154.834    210.08      38.6961     210.08      
1 1 1 21 12 39 o 17 55.3798 3.36411 53.4549     8.95226  56.6822     9.54178  10.856     68.3464     47.9359     248.346     
1 1 1 21 12 40 o 12 156.081 2.51405 430.452     19.3709  435.916     19.9569  106.406    157.094     3.792       337.094     
1 1 1 21 12 41 o 1  73.1044 2.94457 91.2997     10.1984  99.7929     11.2924  41.5624    75.7727     11.183      255.773     
1 1 1 21 12 42 o 3  183.688 2.57234 598.366     23.3793  602.605     23.9774  163.711    300.56      73.6485     300.56      
1 1 1 21 12 43 o 3  96.875  2.70946 167.993     13.0104  166.849     13.2435  67.0963    22.8968     5.22508     22.8968     
1 1 1 21 12 44 o 9  118.622 2.7789  263.501     16.0006  238.942     16.9041  103.694    133.865     49.0384     133.865     
1 1 1 21 12 45 o 7  45.4029 4.12934 34.4237     8.83287  40.947      9.5141   2.42498    93.9651     50.8736     273.965     
1 1 1 21 12 46 o 6  42.6618 4.43911 27.4577     8.86563  40.0549     9.37243  19.2624    304.901     2.50716     304.901     
1 1 1 21 12 47 f 0  58.2939 3.49437 61.615      9.55333  61.0264     10.6312  39.6259    131.034     0           0           
1 1 1 21 12 48 o 7  150.062 2.49647 382.773     18.7596  420.67      18.7566  103.767    329.059     1.25577     329.059     
1 1 1 21 12 49 o 2  107.481 2.88844 189.2       15.0128  225.3       16.0292  86.2862    81.621      27.026      81.621      
1 1 1 21 12 50 o 13 18.5068 5.22642 2.51845     7.23306  4.18198     7.42419  6.68387    206.528     28.4615     206.528     
1 1 1 21 12 51 o 8  99.456  2.67178 169.684     13.1819  184.73      13.3924  99.0563    37.701      66.6644     37.701      
1 1 1 21 12 52 o 15 76.579  2.89105 98.8457     10.8694  112.183     11.2255  49.1141    345.804     3.66884     165.804     
1 1 1 21 12 53 o 11 16.4737 4.87524 3.75669     6.98327  -2.56997    6.87408  10.1835    59.6652     34.6968     59.6653     
1 1 1 21 12 54 o 13 43.4615 4.23439 31.536      8.57046  38.6606     9.37506  27.3158    341.699     1.87685     341.699     
1 1 1 21 12 55 o 19 64.317  3.50692 71.1539     11.2224  79.3826     11.178   28.7749    275.769     27.2741     95.7688     
1 1 1 21 12 56 o 13 63.8797 3.45796 72.8611     10.4984  75.5803     11.465   55.0876    344.376     29.1691     344.376     
1 1 1 21 12 57 o 19 27.3767 5.77917 20.0857     8.64828  7.17578     9.64693  6.56155    318.159     16.8605     138.159     
1 1 1 21 12 58 o 16 107.29  2.9395  196.227     17.0156  219.262     14.1921  76.9828    358.437     11.3507     358.437     
1 1 1 21 12 59 o 3  30.1069 5.78388 12.9224     10.252   21.8108     8.29657  15.6581    13.5147     1.26689     13.5147     
1 1 1 21 12 60 f 0  59.8572 3.83917 62.3301     12.1583  69.7277     10.3793  41.8993    289.715     0           0           
1 1 1 21 12 61 o 17 26.1217 5.45553 1.15143     9.40667  21.862      8.55194  10.1733    105.2       8.18972     285.2       
1 1 1 21 12 62 o 5  27.4881 5.78537 23.5371     9.97331  5.79042     8.54663  9.30433    25.1114     13.056      205.111     
1 1 1 21 12 63 o 9  47.6508 4.49924 38.4084     10.6533  48.0933     10.0566  30.0479    264.737     26.4063     264.737     
1 1 1 21 12 64 o 18 31.0494 5.83986 21.8564     9.14012  17.1568     9.45907  19.6774    315.163     9.09263     315.163     
1 1 1 21 12 65 o 5  33.3111 5.73161 28.3042     10.088   17.1752     9.0871   11.7027    22.1616     16.8979     202.162     
1 1 1 21 12 66 f 0  26.2039 5.88313 9.20818     9.04535  17.7782     8.86645  15.9309    267.665     0           0           
1 1 1 21 12 67 o 13 50.8981 5.2504  48.0141     14.0261  54.1207     11.5302  19.8186    174.615     24.5376     354.615     
1 1 1 21 12 68 o 6  24.529  6.26507 18.2864     11.1567  2.97076     9.7521   6.15434    158.951     0.765647    158.951     
1 1 1 21 12 69 o 14 70.9389 4.15298 104.185     15.3468  87.1107     13.9203  62.4277    80.4158     37.0389     80.4158     
1 1 1 21 12 70 o 18 31.5882 6.9018  13.305      11.9798  29.4211     13.0251  17.1044    254.222     0.391556    254.222     
1 1 1 21 12 71 o 16 36.2639 6.97824 30.2295     12.1315  26.7272     14.0898  14.5254    316.763     14.2489     136.763     
1 1 1 21 12 72 o 5  19.7111 6.18659 -0.887472   11.1613  0.379241    13.1632  4.48557    188.746     7.71181     8.74644     
1 1 1 21 12 73 o 1  21.4011 6.30661 -1.84339    11.663   10.2758     11.5973  5.34059    138.622     9.9097      318.622     
1 1 1 21 12 74 f 0  18.3233 5.88491 -6.21313    11.9071  0.16184     11.7842  11.6791    108.585     0           0           
1 1 1 21 12 75 o 14 31.0197 7.08297 10.786      13.2979  33.0913     13.8357  15.2246    131.105     7.24809     131.105     
1 1 1 21 12 76 o 7  27.2333 7.30376 16.1364     13.4496  17.4523     13.9844  10.1415    42.0187     0.0163427   222.02      
1 1 1 21 12 77 o 3  22.5485 6.71894 -1.27877    12.7104  14.9591     14.0383  3.82232    358.942     5.28274     178.942     
1 1 1 21 12 78 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 13 0  o 8  420.069 4.06312 3132.54     85.4982  3132.54     85.4982  337.41     180         52.7394     180         
1 1 1 21 13 1  f 0  184.896 2.6319  608.817     24.3902  604.022     24.3834  135.722    118.597     0           0           
1 1 1 21 13 2  o 11 344.744 3.54452 2125.22     61.2368  2095.17     61.2348  269.682    345.998     34.3812     345.998     
1 1 1 21 13 3  o 11 303.12  3.29407 1644.29     50.0399  1617.59     50.0355  226.467    346.778     10.1259     346.778     
1 1 1 21 13 4  o 19 219.78  2.88372 871.894     31.0241  842.29      32.4509  176.382    121.454     36.7433     121.454     
1 1 1 21 13 5  o 11 63.0178 2.86378 71.3172     8.7387   70.1836     9.24137  13.0318    354.06      9.98099     174.06      
1 1 1 21 13 6  o 19 89.2618 2.57118 153.044     11.1703  130.53      11.6812  30.934     238.145     53.9633     58.1454     
1 1 1 21 13 7  f 0  241.941 2.92775 1043.36     35.4852  1033.93     35.5101  157.363    112.766     0           0           
1 1 1 21 13 8  o 2  104.306 2.69441 207.949     13.2798  179.113     14.6436  28.3463    13.9213     85.9464     193.921     
1 1 1 21 13 9  o 5  201.527 2.81411 734.646     27.9031  706.606     28.9017  77.724     249.543     136.397     69.5428     
1 1 1 21 13 10 o 16 192.339 2.82187 656.979     24.7344  655.755     29.4543  148.05     138.566     22.1248     138.566     
1 1 1 21 13 11 o 9  187.306 2.73514 627.024     24.6645  617.839     26.63    115.204    211.44      37.873      31.4401     
1 1 1 21 13 12 o 13 392.892 4.02097 2748.72     77.4648  2736.87     80.833   322.079    269.123     69.4966     269.123     
1 1 1 21 13 13 o 1  221.725 2.84269 890.409     28.8491  854.37      33.9963  187.947    230.729     58.5173     230.729     
1 1 1 21 13 14 o 4  201.055 2.64417 718.37      25.0239  715.867     28.1614  179.34     208.645     74.0609     208.645     
1 1 1 21 13 15 o 9  131.006 2.55465 311.802     16.7335  297.642     16.7706  98.0565    140.524     18.7528     140.524     
1 1 1 21 13 16 o 17 36.857  4.21418 21.4718     7.37538  28.2736     7.59424  13.3703    48.436      46.1047     48.436      
1 1 1 21 13 17 o 17 156.521 2.63184 429.159     20.3374  440.163     20.9511  128.005    102.753     39.2319     102.753     
1 1 1 21 13 18 o 2  67.25   2.92491 80.2695     9.72447  80.864      9.89488  21.0777    2.87841     0.767188    182.878     
1 1 1 21 13 19 o 8  157.09  2.56806 447.187     20.1123  428.533     20.3099  121.412    359.557     24.0084     359.557     
1 1 1 21 13 20 o 7  168.777 2.72152 520.222     22.9234  490.963     23.0947  117.064    277.287     4.07312     97.287      
1 1 1 21 13 21 o 3  332.638 3.67677 2003.03     62.7148  1929.63     59.8721  285.655    106.578     89.934      106.578     
1 1 1 21 13 22 o 10 222.265 2.89733 856.94      30.7005  897.175     33.827   125.476    4.8877      68.7854     184.888     
1 1 1 21 13 23 o 5  101.151 2.66255 182.703     12.9193  180.97      13.9994  48.8843    303.11      38.9466     123.11      
1 1 1 21 13 24 o 13 248.519 2.96471 1109.23     35.3796  1084.17     38.3684  192.539    134.732     28.1679     134.732     
1 1 1 21 13 25 o 17 114.959 2.70653 249.987     14.6689  220.191     16.2781  93.7471    349.419     34.5256     349.419     
1 1 1 21 13 26 o 9  91.2398 2.8128  149.601     12.8397  146.589     12.8201  67.5137    227.333     19.328      227.333     
1 1 1 21 13 27 o 7  133.505 2.70631 330.824     16.9782  302.91      19.0206  59.6473    150.37      69.0118     330.37      
1 1 1 21 13 28 o 7  118.818 2.5824  258.451     15.2673  243.404     15.4337  92.9044    277.518     23.4648     277.518     
1 1 1 21 13 29 o 3  37.5749 4.63131 29.5687     8.29832  22.4541     8.42252  1.07349    307.787     16.8727     127.787     
1 1 1 21 13 30 o 14 200.446 2.5617  715.693     25.1127  711.289     26.3344  165.79     349.205     47.3744     349.205     
1 1 1 21 13 31 o 12 159.278 2.661   447.679     20.1796  453.655     22.2625  112.354    309.332     0.523645    309.33      
1 1 1 21 13 32 o 9  21.9339 5.49327 8.71229     7.17751  5.97475     8.06231  22.0796    137.429     57.435      137.429     
1 1 1 21 13 33 o 19 110.945 2.53016 206.19      13.3249  231.965     14.7847  81.5969    296.368     12.2089     296.368     
1 1 1 21 13 34 f 0  158.749 2.61023 459.225     20.1355  436.62      21.338   120.518    36.5453     0           0           
1 1 1 21 13 35 o 19 167.15  2.63104 504.569     21.3334  488.781     22.6974  154.66     137.83      76.8366     137.83      
1 1 1 21 13 36 o 5  274.768 3.09382 1354.97     39.7897  1333.42     45.192   248.559    63.754      108.098     63.754      
1 1 1 21 13 37 o 7  40.2608 4.48697 33.2094     7.94442  26.391      9.2747   0.458561   199.211     46.1883     199.211     
1 1 1 21 13 38 o 1  144.164 2.69149 377.358     17.7276  362.648     20.9319  85.3884    106.555     30.4422     286.555     
1 1 1 21 13 39 o 8  174.645 2.80849 544.542     22.4987  541.76      26.4865  136.705    259.895     29.5934     259.895     
1 1 1 21 13 40 o 2  47.3253 4.24206 43.6056     8.92759  38.0713     10.4841  19.3169    2.63334     11.4088     182.633     
1 1 1 21 13 41 o 11 144.339 2.94732 381.425     18.9805  362.329     23.2653  118.608    109.345     38.5912     109.345     
1 1 1 21 13 42 o 10 88.8075 3.01447 140.997     12.3653  141.121     14.3136  48.8023    104.621     21.5134     284.621     
1 1 1 21 13 43 o 14 56.9626 3.93999 63.2491     10.2316  54.4444     11.7224  20.4814    195.03      31.5558     15.0295     
1 1 1 21 13 44 o 6  78.8188 2.87496 111.201     10.7598  111.14      11.847   57.5448    66.3424     11.5324     66.3424     
1 1 1 21 13 45 o 3  59.2647 3.43548 69.764      9.50694  57.2185     10.4957  7.25328    331.154     64.8147     151.154     
1 1 1 21 13 46 o 10 80.0582 2.76794 113.287     10.9741  116.157     11.1691  43.1104    240.878     22.561      60.878      
1 1 1 21 13 47 o 11 37.8609 4.48763 26.4493     7.89077  26.789      8.5283   22.0818    238.917     3.54443     238.917     
1 1 1 21 13 48 o 1  89.046  2.68498 142.799     11.6789  141.127     12.2192  65.7749    87.2412     11.1404     87.2412     
1 1 1 21 13 49 o 4  36.4178 4.70793 34.4581     7.85479  16.4944     8.32537  19.6998    346.339     1.27393     166.339     
1 1 1 21 13 50 o 11 106.083 2.75319 200.579     13.7397  202.97      15.4414  69.0609    94.9756     6.26905     274.976     
1 1 1 21 13 51 o 4  53.4921 3.8462  51.8178     9.35092  52.8296     10.9231  22.5696    126.169     25.0826     306.169     
1 1 1 21 13 52 o 13 65.7324 3.47081 77.5974     11.022   79.2777     11.6754  49.6998    241.812     13.4369     241.812     
1 1 1 21 13 53 o 17 45.0906 4.54419 28.0329     9.40738  49.2423     10.0712  29.6031    340.168     3.60553     340.168     
1 1 1 21 13 54 o 8  43.5304 4.64095 26.6354     9.43761  45.5837     9.70643  29.1988    43.1161     5.55018     43.1161     
1 1 1 21 13 55 o 3  59.9045 3.5577  67.0584     10.8455  63.8827     10.3197  22.755     63.0124     33.6236     243.012     
1 1 1 21 13 56 o 7  41.2986 4.64624 36.5308     9.76479  28.0005     8.80751  30.3038    212.575     13.4669     212.575     
1 1 1 21 13 57 o 18 58.4224 3.8034  58.1106     11.0265  67.4456     10.9288  27.2462    175.153     22.0842     355.153     
1 1 1 21 13 58 o 7  112.575 2.85269 222.693     16.5437  234.788     15.5375  87.5547    187.334     24.9239     187.334     
1 1 1 21 13 59 o 18 27.3072 5.67949 9.64705     8.79039  18.9428     8.39579  12.2717    213.548     5.22183     33.5484     
1 1 1 21 13 60 o 19 16.9282 5.09108 3.54315     7.83771  -2.62682    7.54736  1.59761    219.313     19.0446     219.313     
1 1 1 21 13 61 o 10 61.1766 3.69896 65.4028     11.8342  73.1867     10.4453  38.7862    253.652     1.93748     73.6517     
1 1 1 21 13 62 o 1  58.6975 3.82297 61.0817     10.8032  67.3412     11.4372  38.713     209.439     1.62847     209.439     
1 1 1 21 13 63 o 12 30.4825 5.87493 16.3108     8.73899  21.632      9.75422  18.8193    133.298     8.93817     133.298     
1 1 1 21 13 64 o 14 22.5366 5.99312 12.6764     9.10323  2.01648     10.389   6.34667    209.211     10.0524     29.2107     
1 1 1 21 13 65 o 16 91.007  3.59277 158.836     17.8852  148.932     14.665   68.4147    205.219     18.7515     205.219     
1 1 1 21 13 66 o 15 24.9108 6.53625 13.5718     11.3243  9.26186     10.4552  9.64013    114.37      1.46742     294.37      
1 1 1 21 13 67 o 3  36.3809 6.30821 25.1412     12.2669  30.4929     10.702   18.7077    255.567     5.10296     75.5667     
1 1 1 21 13 68 o 8  20.6469 5.93798 -4.16486    11.426   9.99059     9.4645   2.78298    196.431     13.4423     16.4311     
1 1 1 21 13 69 o 18 20.1542 6.06674 -7.29791    11.4251  8.73372     11.3286  4.67051    17.3986     4.26384     197.399     
1 1 1 21 13 70 o 14 32.6151 7.08875 23.0413     12.7452  23.3768     12.6692  14.8736    38.3584     8.26408     218.358     
1 1 1 21 13 71 o 1  22.5777 6.50735 12.1333     12.136   0.528886    11.7596  5.13556    117.697     13.4485     297.697     
1 1 1 21 13 72 o 3  18.5417 6.07651 -10.4022    11.2515  0.00215485  15.0951  3.24615    24.4754     8.16349     204.475     
1 1 1 21 13 73 o 17 20.1127 6.23455 4.91276     12.2283  -1.6877     12.0026  4.44788    286.011     5.86173     106.011     
1 1 1 21 13 74 o 3  21.7447 6.58468 0.6992      12.3671  9.75206     13.4467  4.85678    16.0194     3.43746     196.019     
1 1 1 21 13 75 o 17 23.1426 6.80588 13.3718     12.8044  2.61666     14.0908  5.0743     257.937     2.93103     77.937      
1 1 1 21 13 76 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 13 77 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 14 0  o 15 25.9489 6.28121 15.5168     7.33587  15.5168     7.33587  23.6383    360         57.5151     360         
1 1 1 21 14 1  o 6  44.6215 3.67296 38.3224     8.04686  33.4423     8.03749  31.7395    311.915     111.896     311.915     
1 1 1 21 14 2  o 7  235.234 2.9203  991.542     35.1692  972.411     33.6789  183.952    189.202     26.6427     189.201     
1 1 1 21 14 3  o 11 225.089 2.82646 901.097     31.874   896.907     31.8918  103.217    192.798     122.07      12.7981     
1 1 1 21 14 4  o 8  50.6423 3.52356 44.3793     8.56991  47.612      9.086    8.3713     32.9655     67.5708     32.9655     
1 1 1 21 14 5  f 0  100.604 2.65452 184.955     13.6257  174.734     13.0955  111.819    20.2107     0           0           
1 1 1 21 14 6  o 10 148.2   2.50631 389.492     18.5772  389.705     18.651   104.849    246.753     1.73561     246.753     
1 1 1 21 14 7  o 18 40.6031 4.06521 35.2911     7.91281  24.922      7.94938  10.8708    92.881      47.2682     92.881      
1 1 1 21 14 8  o 17 153.831 2.53386 422.31      19.1209  417.283     19.933   120.614    161.87      25.977      161.87      
1 1 1 21 14 9  f 0  190.851 2.66247 644         25.4322  648.487     25.4973  156.636    63.2455     0           0           
1 1 1 21 14 10 o 15 42.1997 3.90518 32.2458     7.5898   32.1149     8.49701  9.34075    147.939     47.7902     147.939     
1 1 1 21 14 11 o 1  294.592 3.2396  1535.98     47.7968  1545.67     47.857   230.699    12.9519     31.5356     12.9519     
1 1 1 21 14 12 o 16 169.623 2.6135  517.656     22.1755  503.348     22.2523  62.1753    172.29      120.122     352.29      
1 1 1 21 14 13 o 3  200.871 2.90635 712.547     28.468   719.741     30.0317  140.241    336.567     8.66781     156.567     
1 1 1 21 14 14 o 15 181.935 2.86152 587.572     24.0719  587.374     27.9613  158.727    144.837     60.1998     144.837     
1 1 1 21 14 15 o 5  174.519 2.63442 540.901     22.1515  539.973     23.8945  136.717    72.1411     25.7874     72.1411     
1 1 1 21 14 16 o 2  141.278 2.55428 353.879     17.3899  354.672     18.7376  99.239     68.871      0.952477    68.871      
1 1 1 21 14 17 o 16 148.446 2.72879 382.531     19.4968  400.288     21.0663  110.587    186.535     12.9401     186.535     
1 1 1 21 14 18 o 8  251.323 2.93156 1134.9      35.406   1107.96     38.3409  186.135    143.009     8.0685      143.009     
1 1 1 21 14 19 o 15 177.364 2.63355 559.322     22.0335  557.318     24.7015  166.353    202.488     83.1539     202.488     
1 1 1 21 14 20 o 17 105.276 2.54396 196.13      12.9351  197.718     13.856   69.4164    272.581     3.5082      92.5805     
1 1 1 21 14 21 o 3  106.586 2.63441 207.588     13.1704  196.294     14.8241  90.7073    213.323     43.302      213.323     
1 1 1 21 14 22 o 14 134.393 2.66841 331.944     18.4894  310.024     17.4233  103.068    230.619     18.5191     230.619     
1 1 1 21 14 23 o 13 156.65  2.65986 433.216     20.3215  438.123     21.4312  152.845    170.909     87.7027     170.909     
1 1 1 21 14 24 o 13 157.913 2.56384 441.005     20.1746  444.39      20.4042  119.36     300.549     14.6401     300.549     
1 1 1 21 14 25 o 9  16.5996 4.97386 0.558503    7.02167  -0.124089   7.31475  8.58948    25.6383     19.6055     25.6383     
1 1 1 21 14 26 o 13 159.069 2.68514 455.165     21.2567  443.674     21.5458  99.6298    233.587     27.2559     53.5871     
1 1 1 21 14 27 o 2  133.881 2.7691  317.999     18.9032  319.436     18.2061  87.5131    343.587     13.3503     163.587     
1 1 1 21 14 28 o 14 112.187 2.72313 225.367     15.0552  222.405     15.5122  57.9795    231.81      40.6435     51.8105     
1 1 1 21 14 29 o 5  95.6185 2.81129 169.301     13.1207  156.385     13.7154  68.5454    226.482     8.73044     226.482     
1 1 1 21 14 30 o 1  114.416 2.76279 230.513     15.1299  235.416     16.4898  78.9876    141.736     0.229569    321.737     
1 1 1 21 14 31 o 16 59.6782 3.44023 58.6608     10.431   69.2594     9.84386  28.0403    67.9132     16.3558     247.913     
1 1 1 21 14 32 o 15 231.381 2.78287 955.695     32.1505  948.445     32.385   177.17     237.371     24.1472     237.371     
1 1 1 21 14 33 o 9  76.6466 2.95989 99.2983     10.9088  110.571     11.7482  38.4426    184.057     25.1921     4.05689     
1 1 1 21 14 34 o 18 153.411 2.57794 427.546     19.5996  409.563     20.0207  122.715    237.64      30.2699     237.64      
1 1 1 21 14 35 o 14 202.488 2.79216 733.407     26.417   726.163     30.1083  177.183    259.159     68.2222     259.159     
1 1 1 21 14 36 o 1  57.2173 3.60409 58.9548     10.0053  58.9071     10.4417  25.6194    158.03      19.9589     338.03      
1 1 1 21 14 37 o 9  54.105  3.7325  45.8389     9.63891  60.3407     10.2619  29.4045    209.793     2.45442     29.7932     
1 1 1 21 14 38 o 16 59.0612 3.68135 61.5971     10.2667  64.182      11.2942  25.1877    286.254     24.4329     106.254     
1 1 1 21 14 39 o 8  23.7271 5.35225 16.0012     7.76039  1.1088      8.3755   5.54461    282.789     20.4685     282.789     
1 1 1 21 14 40 o 17 244.307 2.79919 1070.02     34.0459  1058.58     34.4917  201.782    287.118     59.7353     287.118     
1 1 1 21 14 41 o 16 103.744 2.66549 195.006     13.2242  189.242     14.3991  80.8972    296.127     20.9331     296.127     
1 1 1 21 14 42 o 1  169.987 2.82749 527.042     23.0033  504.855     25.0503  127.547    352.511     17.6893     352.511     
1 1 1 21 14 43 o 19 21.9226 5.0003  -3.57142    6.85867  16.669      8.14909  0.0704341  36.0064     1.29243     36.0064     
1 1 1 21 14 44 o 6  55.8327 3.4673  56.7527     9.19791  55.9303     9.98214  29.1781    191.897     15.701      11.8967     
1 1 1 21 14 45 o 12 96.0268 2.78524 172.933     12.4293  157.425     14.1538  86.631     56.5032     42.8792     56.5032     
1 1 1 21 14 46 o 19 73.5967 3.15007 97.7407     10.5855  97.2212     12.4531  48.7931    307.721     1.75345     127.72      
1 1 1 21 14 47 o 17 21.8234 5.47253 11.0942     7.75977  3.50938     7.77499  1.21105    336.988     12.9999     156.988     
1 1 1 21 14 48 o 3  33.8758 5.1992  22.6386     8.4473   21.0857     8.6991   14.232     344.199     10.8568     164.199     
1 1 1 21 14 49 o 1  33.6793 5.27817 25.5747     8.5318   17.9558     8.88363  4.23327    211.728     33.5158     31.7275     
1 1 1 21 14 50 o 5  67.1759 3.54844 81.6811     11.3764  82.3258     12.3241  57.3853    264.083     27.0659     264.083     
1 1 1 21 14 51 o 8  25.6048 5.74819 14.1795     8.65858  10.2297     7.97932  7.2266     152.748     2.99769     332.748     
1 1 1 21 14 52 f 0  97.1148 2.82553 170.539     14.004   168.933     13.4362  67.3731    121.439     0           0           
1 1 1 21 14 53 o 5  49.8984 4.32427 50.6875     10.4349  41.9456     10.6178  26.0734    249.007     12.5904     69.0067     
1 1 1 21 14 54 o 6  36.4623 5.46505 23.9231     9.51269  27.5469     9.84652  7.96373    146.97      30.1141     326.97      
1 1 1 21 14 55 o 4  26.2712 5.83621 5.71984     8.67934  19.6483     9.51995  1.0142     257.665     28.9276     77.6651     
1 1 1 21 14 56 o 1  27.5048 5.98994 10.8244     8.0522   18.6613     10.22    4.50522    256.445     23.6347     76.4446     
1 1 1 21 14 57 o 19 21.4978 5.87394 4.1557      7.90131  9.06421     10.0829  3.94021    4.21301     0.93126     184.213     
1 1 1 21 14 58 o 18 50.5398 4.54333 38.1917     9.62426  59.4381     12.9449  28.2416    312.197     9.15843     132.197     
1 1 1 21 14 59 o 10 41.0492 4.99604 31.8366     9.10954  33.3339     10.6719  29.7323    181.986     9.05892     181.986     
1 1 1 21 14 60 o 4  55.4884 4.32586 55.9686     10.2045  60.2986     13.2959  48.1776    115.214     26.0206     115.214     
1 1 1 21 14 61 o 18 45.072  4.78273 42.3234     10.4304  36.2326     10.449   25.4399    49.7185     6.52975     229.719     
1 1 1 21 14 62 o 15 34.3212 5.7176  22.3814     9.65748  25.5215     9.70275  24.5131    147.452     13.7344     147.452     
1 1 1 21 14 63 o 6  18.6395 5.48756 4.78455     8.37035  0.677805    8.7668   2.52493    217.514     2.40888     37.5144     
1 1 1 21 14 64 f 0  44.5286 4.90747 44.7953     10.279   33.2304     10.643   34.8137    34.1733     0           0           
1 1 1 21 14 65 o 10 79.2014 3.94049 134.922     17.1138  102.477     14.0183  54.6164    28.8953     6.81247     28.8954     
1 1 1 21 14 66 o 7  16.8202 5.30987 3.9029      10.0491  -10.7786    8.8993   0.273665   300.106     7.69446     120.106     
1 1 1 21 14 67 o 5  34.9599 6.14398 32.8141     11.6224  19.1121     10.1105  13.6593    61.4774     14.6929     241.477     
1 1 1 21 14 68 o 18 43.5606 5.66487 35.8784     12.765   41.1867     10.8742  33.967     121.694     16.4393     121.694     
1 1 1 21 14 69 o 6  29.8636 6.83021 25.3069     12.3282  12.6209     11.7107  18.1238    25.5492     7.74121     25.5492     
1 1 1 21 14 70 o 9  32.2482 6.85171 30.531      12.8557  15.5026     11.8318  21.1107    234.302     9.11892     234.302     
1 1 1 21 14 71 o 15 22.5131 6.47598 12.4732     12.0769  1.74313     11.3944  8.01362    295.329     4.477       115.329     
1 1 1 21 14 72 o 3  17.2835 5.6271  -13.4114    12.2818  0.820783    11.0647  0.863372   200.682     10.7129     20.6816     
1 1 1 21 14 73 o 12 37.8061 7.32197 28.345      16.2787  40.2708     13.353   20.1694    169.707     2.76261     349.707     
1 1 1 21 14 74 o 15 21.3964 6.54475 5.4922      12.7045  4.98568     13.0677  3.32091    80.6884     4.7581      260.688     
1 1 1 21 14 75 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 15 0  o 6  75.6935 2.83571 102.454     10.6874  102.454     10.6874  2.29222    0.00077058  1.11935     0.00077058  
1 1 1 21 15 1  o 10 111.529 2.67414 224.607     14.6098  217.376     15.2198  81.7071    234.21      14.6879     234.21      
1 1 1 21 15 2  o 5  426.252 4.24343 3210.33     92.5949  3252.87     88.6215  302.316    67.6586     25.3807     247.659     
1 1 1 21 15 3  o 10 286.167 3.25858 1466.64     47.7482  1441.93     45.7069  184.071    315.631     52.4421     135.631     
1 1 1 21 15 4  o 5  99.5849 2.59403 183.484     12.9274  169.073     12.9043  48.8892    103.486     37.2609     283.486     
1 1 1 21 15 5  o 12 157.3   2.76595 440.047     22.2182  438.492     21.364   139.853    169.791     59.5573     169.791     
1 1 1 21 15 6  o 11 54.0545 3.39829 54.2931     9.14103  50.3596     9.07007  9.68975    232.953     83.531      232.953     
1 1 1 21 15 7  o 10 69.3425 3.00321 88.3797     10.1595  83.0297     10.586   28.2767    352.344     23.3412     172.344     
1 1 1 21 15 8  o 3  195.485 2.72937 678.129     26.724   678.312     26.753   132.373    17.3906     18.5108     197.391     
1 1 1 21 15 9  o 13 173.52  2.69486 535.697     23.9506  533.032     22.9083  127.695    203.02      6.33861     203.02      
1 1 1 21 15 10 o 17 131.327 2.60747 308.01      16.8295  304.602     17.4482  106.202    76.6761     31.0216     76.6761     
1 1 1 21 15 11 o 8  200.659 2.77976 707.075     28.5082  722.388     27.3713  160.38     101.324     30.8957     101.324     
1 1 1 21 15 12 o 2  52.04   3.42497 44.2093     8.51151  53.0613     9.13505  9.83543    317.602     28.4426     137.602     
1 1 1 21 15 13 o 19 137.144 2.56501 338.909     17.5361  329.185     17.6854  36.7743    175.663     123.738     355.663     
1 1 1 21 15 14 o 4  85.4852 2.79112 128.933     11.9582  131.098     11.8904  44.1692    18.5851     24.9593     198.585     
1 1 1 21 15 15 o 15 231.546 2.91811 952.882     33.0577  951.271     34.6442  145.595    207.662     46.4631     27.662      
1 1 1 21 15 16 o 7  90.8367 2.68294 143.416     12.1136  150.097     12.2572  66.3513    331.041     15.0793     331.041     
1 1 1 21 15 17 o 14 166.793 2.80141 480.664     22.8457  507.521     23.9907  89.3492    318.082     62.2224     138.082     
1 1 1 21 15 18 o 3  160.36  2.74503 472.126     21.9879  441.644     22.0912  119.011    312.28      8.30305     312.28      
1 1 1 21 15 19 o 4  205.998 2.82308 758.733     28.4378  748.604     29.8229  144.056    35.6958     10.5667     215.696     
1 1 1 21 15 20 o 8  264.857 3.07732 1258.98     39.1889  1234.22     42.403   223.832    50.4905     62.5547     50.4905     
1 1 1 21 15 21 o 5  85.5517 2.83312 130.404     11.6647  130.202     12.5437  70.1802    43.0212     44.7913     43.0212     
1 1 1 21 15 22 o 3  166.058 2.75041 497.773     21.6479  481.995     24.0237  102.846    25.2241     33.0684     205.224     
1 1 1 21 15 23 o 11 101.901 2.81876 185.281     13.5013  184.303     15.1771  73.8876    233.096     8.36766     233.096     
1 1 1 21 15 24 o 1  136.484 2.54018 339.909     16.8568  322.182     17.8239  80.1452    143.119     33.9336     323.119     
1 1 1 21 15 25 o 7  88.0367 2.90146 152.237     12.1219  124.607     13.1774  42.8598    10.8974     35.0071     190.897     
1 1 1 21 15 26 o 5  168.323 2.73278 511.589     22.6381  495.59      23.4415  120.066    65.1809     0.532419    245.182     
1 1 1 21 15 27 o 1  120.352 2.55184 262.458     14.8373  252.786     15.8683  87.7709    143.306     7.35171     143.306     
1 1 1 21 15 28 o 16 107.969 2.57599 203.737     13.5347  211.125     14.3013  79.733     76.0982     10.4498     76.0982     
1 1 1 21 15 29 o 17 71.6017 3.15835 103.685     10.6985  80.3224     11.57    34.7384    104.829     25.3806     284.829     
1 1 1 21 15 30 o 11 169.624 2.79261 525.241     22.553   498.665     24.7994  121.709    340.425     1.75502     340.426     
1 1 1 21 15 31 o 4  38.14   5.15198 26.6475     8.87335  27.3356     10.0906  5.36847    281.023     54.4652     281.023     
1 1 1 21 15 32 o 1  170.578 2.85883 532.497     23.6139  504.109     25.1593  107.937    355.922     27.1157     175.922     
1 1 1 21 15 33 o 13 87.6694 3.31059 134.058     14.8716  141.005     14.0723  56.6629    233.757     5.65989     53.757      
1 1 1 21 15 34 o 16 87.6076 3.28313 129.463     13.8986  145.495     14.8292  65.2484    187.836     13.2371     187.836     
1 1 1 21 15 35 o 15 118.103 2.98385 263.084     16.55    235.388     18.5029  104.717    127.073     47.5678     127.073     
1 1 1 21 15 36 o 15 14.4445 4.64954 -5.16466    7.41697  -3.84677    7.38152  7.72088    340.361     17.9513     340.361     
1 1 1 21 15 37 o 18 19.1996 5.40865 4.60014     7.83081  2.44616     7.84939  11.1531    198.941     30.3346     198.941     
1 1 1 21 15 38 o 10 60.1489 3.4106  66.1096     9.44696  64.1777     10.8602  24.8043    151.645     28.822      331.645     
1 1 1 21 15 39 o 5  56.3801 3.47376 60.2175     9.26862  54.5535     10.0784  26.0572    35.0722     20.796      215.072     
1 1 1 21 15 40 o 11 31.3426 5.25627 17.1735     7.69851  19.9943     8.57189  0.447949   9.06062     36.263      9.06061     
1 1 1 21 15 41 o 19 102.04  2.74566 195.477     13.5786  177.088     14.3717  79.1591    215.554     17.2158     215.554     
1 1 1 21 15 42 o 16 41.3293 4.43852 25.6988     8.9263   37.9936     8.53004  20.9913    142.631     9.65272     322.631     
1 1 1 21 15 43 o 9  104.975 2.70566 217.083     14.3937  178.242     13.9596  87.1429    272.736     29.2778     272.736     
1 1 1 21 15 44 o 8  119.361 2.68426 251.587     16.5734  258.415     15.4606  87.9228    186.012     10.0176     186.012     
1 1 1 21 15 45 o 12 92.5298 2.79845 154.773     13.205   152.397     12.6862  51.285     67.8772     25.1738     247.877     
1 1 1 21 15 46 o 13 18.1601 5.28075 5.12404     8.37309  -0.973585   7.28776  9.78839    45.6249     37.3401     45.6249     
1 1 1 21 15 47 o 12 65.1275 3.3558  70.1573     11.2386  83.8356     10.33    50.086     226.382     13.6655     226.382     
1 1 1 21 15 48 o 15 69.3721 3.14203 79.2969     11.0571  95.0175     10.5429  59.2204    344.677     26.5575     344.677     
1 1 1 21 15 49 o 15 58.8515 3.53471 67.7671     10.2253  58.5918     10.366   31.0114    76.4647     16.624      256.465     
1 1 1 21 15 50 o 6  33.3211 5.55151 15.3549     8.97765  28.1241     9.55771  19.1368    146.331     5.27259     146.331     
1 1 1 21 15 51 o 13 52.6919 4.17518 48.3541     10.4855  54.4209     11.1862  24.3742    80.8605     20.9401     260.861     
1 1 1 21 15 52 o 19 74.1435 3.46106 110.502     11.2585  90.0274     13.7729  42.5796    14.5592     14.7328     194.559     
1 1 1 21 15 53 o 10 29.9295 5.83326 16.0157     8.17983  19.0866     9.88923  7.06076    243.998     3.55642     243.998     
1 1 1 21 15 54 o 14 63.0979 3.78833 74.4522     10.9588  71.8645     12.6572  44.9558    339.841     6.4768      339.841     
1 1 1 21 15 55 o 7  56.1239 4.33294 50.0774     9.99254  68.2554     14.0447  33.9975    22.8474     5.98536     202.847     
1 1 1 21 15 56 o 5  56.9344 4.0338  51.3807     10.0056  69.9039     12.7585  45.6484    209.293     17.2053     209.293     
1 1 1 21 15 57 o 3  67.8082 3.88925 89.1527     11.0092  81.3634     14.6456  52.4425    316.35      15.3168     316.35      
1 1 1 21 15 58 o 18 74.0677 3.74344 102.081     11.5562  101.121     15.6458  63.2583    90.3884     28.8461     90.3884     
1 1 1 21 15 59 o 18 24.0348 5.84325 3.03701     8.37871  17.5727     9.79551  8.77411    147.755     2.67139     147.755     
1 1 1 21 15 60 o 4  51.5645 4.34007 42.8072     10.0995  59.1145     11.8797  38.0846    308.82      10.1059     308.82      
1 1 1 21 15 61 f 0  38.3388 5.75089 27.0555     10.264   32.8653     11.1688  30.3415    295.723     0           0           
1 1 1 21 15 62 o 12 34.1477 5.60474 27.1498     9.27051  20.4777     9.62871  19.9432    314.496     0.503249    134.497     
1 1 1 21 15 63 o 5  29.542  5.97434 19.7711     9.49051  16.4811     9.12547  7.28493    221.996     20.7058     41.996      
1 1 1 21 15 64 o 2  23.8885 6.01082 18.4001     10.5431  1.71918     8.96988  8.18159    235.309     4.91091     55.3085     
1 1 1 21 15 65 o 1  42.4066 5.76602 41.1746     12.2974  32.669      11.3311  17.1002    197.086     18.8263     17.0863     
1 1 1 21 15 66 o 3  23.6157 6.3606  11.0809     11.0877  8.54708     9.76855  6.3746     150.331     12.367      330.331     
1 1 1 21 15 67 o 1  44.866  5.4652  57.4149     12.49    26.3795     10.827   19.4104    236.769     17.7944     56.7689     
1 1 1 21 15 68 o 17 22.2702 6.41863 10.8754     11.7019  2.03989     11.2825  7.76901    219.797     0.368026    219.797     
1 1 1 21 15 69 o 19 21.2829 6.48546 -3.78479    15.0817  7.43539     11.1951  3.42453    147.513     15.5666     327.513     
1 1 1 21 15 70 o 16 21.3155 6.37484 10.9523     12.2139  -3.71349    12.3093  6.4485     310.036     3.9963      130.036     
1 1 1 21 15 71 o 4  22.9732 6.5314  -0.678619   12.7802  15.4989     11.865   6.7028     59.7179     1.1832      239.718     
1 1 1 21 15 72 o 17 20.8517 6.3744  8.23131     12.6566  0.24523     11.9715  2.78952    312.101     2.52971     132.101     
1 1 1 21 15 73 f 0  42.0498 7.19382 50.9702     14.9051  34.667      15.5632  14.0016    318.414     0           0           
1 1 1 21 15 74 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 16 0  o 16 70.4924 3.00493 89.1044     10.5262  89.1044     10.5262  37.3186    180         26.6924     8.60081e-06 
1 1 1 21 16 1  o 2  161.769 2.64806 475.794     21.9226  453.402     21.0155  133.224    110.874     34.1902     110.874     
1 1 1 21 16 2  o 13 101.281 2.77495 187.532     14.5816  177.324     13.5356  43.5931    256.84      54.8974     76.8399     
1 1 1 21 16 3  o 17 187.524 2.77401 634.426     26.6166  614.341     25.5226  76.0166    146.849     122.878     326.849     
1 1 1 21 16 4  o 1  241.248 2.97479 1052.08     35.1538  1015.41     36.7226  189.648    295.232     25.3293     295.232     
1 1 1 21 16 5  o 14 158.434 2.66669 453.797     20.6667  437.485     21.6445  136.1      249.58      45.5735     249.58      
1 1 1 21 16 6  o 18 137.307 2.67773 329.221     18.3808  340.736     18.4319  112.505    262.171     30.7431     262.171     
1 1 1 21 16 7  o 6  139.496 2.58111 343.689     18.0292  347.611     18.0269  59.3225    282.014     83.2074     102.014     
1 1 1 21 16 8  o 9  39.4855 4.59867 30.0838     8.64545  26.9696     8.89068  7.5277     249.21      53.381      249.21      
1 1 1 21 16 9  o 11 101.268 2.71939 181.536     14.1157  183.154     13.4233  44.4761    7.28894     53.711      187.289     
1 1 1 21 16 10 o 18 114.96  2.6622  241.137     14.9595  228.719     15.6393  82.2985    184.871     3.30722     184.871     
1 1 1 21 16 11 f 0  61.5065 3.28637 68.4941     10.0051  66.7558     10.1015  84.8808    77.9023     0           0           
1 1 1 21 16 12 o 12 314.601 3.39504 1760.46     53.5129  1758.98     53.5389  264.276    284.574     65.5216     284.574     
1 1 1 21 16 13 o 16 87.3415 2.78067 135.833     12.1111  135.684     12.1686  1.24098    325.934     121.368     145.934     
1 1 1 21 16 14 o 19 279.141 3.24162 1379.1      46.293   1391.33     44.3706  191.996    258.652     26.2521     78.6518     
1 1 1 21 16 15 o 13 191.335 2.76629 631.012     25.9245  669.83      27.1297  124.807    267.307     29.191      87.3065     
1 1 1 21 16 16 o 18 32.8988 4.98272 18.8808     7.64197  21.2929     8.29931  3.79667    335.244     26.8866     335.244     
1 1 1 21 16 17 o 6  98.3427 2.76653 174.146     13.3891  170.053     13.8153  62.6011    154.04      11.2149     334.04      
1 1 1 21 16 18 o 2  20.7753 5.044   -4.17882    7.25245  13.4809     7.68896  12.2338    108.504     31.4705     108.504     
1 1 1 21 16 19 o 2  246.211 2.90179 1089.41     35.026   1065.74     36.546   187.949    206.553     16.5969     206.553     
1 1 1 21 16 20 o 6  155.544 2.71429 434.625     21.5272  425.257     20.788   139.345    338.701     57.0504     338.701     
1 1 1 21 16 21 o 12 142.12  2.62644 366.394     18.6203  351.945     18.7512  85.3852    188.35      33.2529     8.34976     
1 1 1 21 16 22 o 18 129.452 2.72368 310.628     17.0864  285.876     18.1301  116.059    119.109     50.9537     119.109     
1 1 1 21 16 23 o 7  190.536 2.95238 644.037     28.8449  647.488     27.5175  112.72     14.3515     50.6533     194.352     
1 1 1 21 16 24 o 8  117.21  2.82285 247.224     14.989   242.006     17.9536  79.4895    231.989     6.35075     51.989      
1 1 1 21 16 25 o 10 66.516  3.32862 77.4899     11.141   80.9485     10.8952  45.9322    72.2606     11.8803     72.2606     
1 1 1 21 16 26 o 9  80.9284 3.15111 121.032     12.2033  113.021     13.1897  54.4001    17.2348     0.340212    17.2346     
1 1 1 21 16 27 o 5  99.3934 2.95488 183.473     14.021   169.054     15.2516  54.1889    309.614     30.7896     129.614     
1 1 1 21 16 28 o 14 78.2093 3.14907 109.133     11.7231  109.571     12.835   59.0839    98.0512     15.6637     98.0512     
1 1 1 21 16 29 o 19 62.993  3.56712 66.5642     10.4965  76.2088     11.8494  26.6294    49.6839     29.911      229.684     
1 1 1 21 16 30 o 17 84.7747 3.10762 135.586     12.7732  121.571     13.4613  42.6031    182.066     31.733      2.0661      
1 1 1 21 16 31 o 5  63.9052 3.27054 74.2074     9.92684  72.3468     10.8429  45.7567    298.426     14.9718     298.426     
1 1 1 21 16 32 o 13 181.546 2.76998 579.216     25.0424  595.467     25.36    158.035    102.542     57.716      102.542     
1 1 1 21 16 33 o 7  101.507 2.8159  196.896     13.1887  171.485     15.1417  66.3833    72.882      7.9962      252.882     
1 1 1 21 16 34 o 12 175.167 2.73417 552.078     23.4343  541.967     24.5436  149.669    66.4013     51.0864     66.4013     
1 1 1 21 16 35 o 19 19.7427 5.46519 1.50181     7.39672  6.96661     8.49003  19.3447    26.9033     53.4866     26.9033     
1 1 1 21 16 36 o 12 87.0645 3.11711 148.163     12.416   124.016     14.3548  54.6207    32.5699     10.4897     212.57      
1 1 1 21 16 37 o 16 59.866  3.68881 57.9588     11.0008  72.0117     10.7672  31.8548    266.021     15.6919     86.0213     
1 1 1 21 16 38 o 14 66.8214 4.19932 81.3735     11.8118  80.8783     15.6789  48.4102    347.682     7.44394     347.682     
1 1 1 21 16 39 o 6  154.93  2.91933 435.987     22.9379  423.057     22.3551  128.739    99.2573     38.4876     99.2573     
1 1 1 21 16 40 o 4  40.8718 4.72245 30.6614     9.67835  31.5033     8.97583  23.6866    353.609     2.87236     173.609     
1 1 1 21 16 41 o 19 44.4322 4.78999 38.5537     11.1508  34.9276     9.49998  32.403     331.928     11.9362     331.928     
1 1 1 21 16 42 o 5  52.8026 4.08127 45.3553     10.5033  57.0709     10.6238  29.9388    335.204     10.3787     155.204     
1 1 1 21 16 43 o 6  61.2641 3.42018 62.9903     10.4781  73.197      10.2844  49.8139    326.127     18.6762     326.127     
1 1 1 21 16 44 f 0  30.9761 5.50403 8.49365     8.87611  28.5761     9.45334  18.3491    46.3289     0           0           
1 1 1 21 16 45 o 1  27.906  5.88133 16.5339     8.76409  13.0419     9.01201  8.18449    143.958     0.486928    143.958     
1 1 1 21 16 46 o 2  121.859 2.86509 271.802     17.5671  262.295     17.3763  87.0825    64.8885     4.92912     64.8885     
1 1 1 21 16 47 o 1  60.5378 3.60194 60.6148     10.1228  73.385      11.5446  36.3917    57.784      8.64156     237.784     
1 1 1 21 16 48 o 1  28.2161 5.69204 23.0703     9.00634  6.24528     9.48812  8.64197    175.814     2.2466      175.814     
1 1 1 21 16 49 o 7  61.51   3.48998 65.8592     10.3636  72.1727     10.9741  46.7554    283.79      11.876      283.79      
1 1 1 21 16 50 o 15 24.1236 5.71563 10.6449     8.09922  10.4704     8.17512  4.53568    232.843     0.590275    52.8426     
1 1 1 21 16 51 o 12 45.4365 4.2107  42.1526     9.37965  34.9473     9.26473  20.4008    271.52      18.783      91.5201     
1 1 1 21 16 52 o 6  51.3472 3.8604  50.8238     9.5947   46.608      9.92755  34.0136    177.971     0.681045    177.971     
1 1 1 21 16 53 o 9  78.7457 3.06765 118.763     12.0896  106.529     12.0041  68.0685    143.815     30.4564     143.815     
1 1 1 21 16 54 o 16 30.8781 5.41608 10.9723     8.63422  26.8991     8.83479  10.5487    227.948     17.4087     47.9484     
1 1 1 21 16 55 o 1  33.0131 5.40921 21.4096     8.64904  21.699      8.89855  18.723     123.557     2.78881     303.557     
1 1 1 21 16 56 o 16 21.6386 5.69348 5.04236     8.56444  9.80797     8.18681  7.5423     109.03      4.80892     289.03      
1 1 1 21 16 57 o 11 50.9442 4.35104 45.7231     10.3027  52.987      11.4749  29.6142    122.609     7.67304     302.609     
1 1 1 21 16 58 o 14 78.5772 3.42661 103.635     11.9897  125.049     14.8876  51.6658    257.669     1.61324     77.6685     
1 1 1 21 16 59 o 15 31.0443 6.00993 25.5363     9.19058  13.6049     11.0398  14.3645    356.456     8.64151     176.456     
1 1 1 21 16 60 o 5  75.2531 3.65698 97.4997     13.377   114.181     14.0125  57.3862    134.504     15.5468     134.504     
1 1 1 21 16 61 o 9  20.3698 5.90938 9.13335     9.73871  -2.57727    10.5784  4.72257    49.091      7.18096     229.091     
1 1 1 21 16 62 o 14 19.5825 5.84634 3.0724      8.77331  3.23762     10.8922  3.35459    110.831     7.13052     290.831     
1 1 1 21 16 63 o 14 36.724  6.61727 35.2414     12.3953  23.0252     12.3966  12.058     101.453     21.2823     281.453     
1 1 1 21 16 64 o 8  39.9734 6.54855 32.8528     12.8401  35.3723     12.8886  26.3133    149.745     4.53023     149.745     
1 1 1 21 16 65 o 12 62.8778 4.4659  81.4128     14.1986  71.0684     13.5482  38.2397    44.248      4.85193     224.248     
1 1 1 21 16 66 o 14 42.9245 6.50608 51.895      16.2634  28.5689     11.1237  28.7691    340.267     4.71084     340.267     
1 1 1 21 16 67 o 15 19.8286 5.96698 5.12846     11.143   1.51085     9.61086  3.83048    36.0224     12.0129     216.022     
1 1 1 21 16 68 o 4  43.2469 6.33293 43.2809     13.3801  37.5823     13.1723  32.9235    335.005     14.1029     335.005     
1 1 1 21 16 69 o 11 18.9411 5.99209 2.96783     11.8315  -4.18177    11.7271  3.34442    87.4621     6.54017     267.462     
1 1 1 21 16 70 o 15 17.6646 5.75084 -3.6041     12.0552  -3.48612    11.4308  1.22288    62.7635     6.90341     242.764     
1 1 1 21 16 71 o 12 34.7879 7.26288 25.8424     13.7817  33.7953     13.57    17.9656    27.0583     10.4282     27.0583     
1 1 1 21 16 72 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 17 0  o 3  83.3067 2.82334 123.97      11.7251  123.97      11.7251  47.0845    360         29.9132     180         
1 1 1 21 17 1  o 7  53.115  3.655   60.4297     9.47151  41.7949     9.45083  19.8067    157.633     20.431      337.633     
1 1 1 21 17 2  o 19 36.4411 4.96764 21.5501     9.02172  27.5807     8.40298  0.347372   219.34      26.1579     219.34      
1 1 1 21 17 3  o 17 30.5244 5.31761 14.5137     7.99683  20.2019     8.25245  9.51495    133.859     40.3581     133.859     
1 1 1 21 17 4  o 10 99.7065 2.67831 182.998     13.3488  170.753     13.3553  83.9982    79.9548     32.5862     79.9548     
1 1 1 21 17 5  o 12 34.5288 5.09865 16.004      8.65796  28.6791     8.47453  22.3241    205.227     83.4812     205.227     
1 1 1 21 17 6  o 15 104.665 2.756   193.248     14.1187  196.513     14.74    57.1718    54.5674     34.4359     234.567     
1 1 1 21 17 7  o 7  283.903 3.3229  1438.73     47.268   1428.59     47.2852  220.129    94.2638     20.6429     94.2638     
1 1 1 21 17 8  o 15 212.056 2.79558 823.246     29.71    775.08      29.6877  179.115    174.068     47.3707     174.068     
1 1 1 21 17 9  o 10 106.022 2.85418 195.887     15.1928  204.245     15.0736  63.0187    223.407     24.3783     43.407      
1 1 1 21 17 10 o 17 45.0601 4.13392 31.652      9.06398  42.3418     8.9634   9.76495    210.058     4.77595     30.058      
1 1 1 21 17 11 o 10 48.84   4.12909 39.0721     10.2311  47.3986     9.36188  15.8722    220.007     20.259      40.0071     
1 1 1 21 17 12 o 6  194.058 2.74608 676.812     26.6994  661.643     26.7094  156.758    34.6372     30.0904     34.6372     
1 1 1 21 17 13 o 14 37.9703 4.76837 22.8639     8.7165   30.4279     8.6889   0.406922   320.356     36.9126     320.356     
1 1 1 21 17 14 o 9  182.519 2.69865 590.568     24.6563  593.449     24.7117  136.903    119.683     7.69084     119.682     
1 1 1 21 17 15 o 17 129.379 2.68416 294.544     17.7034  300.942     17.0508  116.604    89.8484     50.4803     89.8484     
1 1 1 21 17 16 o 13 193.027 2.78194 650.375     26.338   674.486     27.4854  201.92     133.846     125.614     133.846     
1 1 1 21 17 17 o 1  109.645 2.71874 215.355     14.6175  212.592     15.2036  86.8521    43.3265     20.1533     43.3265     
1 1 1 21 17 18 o 6  162.313 2.71936 483.438     22.5064  453.585     21.7341  134.338    58.596      34.3296     58.596      
1 1 1 21 17 19 o 10 76.2589 2.9842  107.34      11.2124  100.304     11.4858  42.157     30.7325     19.097      210.733     
1 1 1 21 17 20 o 2  157.206 2.55645 439.833     19.6659  438.793     20.6025  126.901    194.693     27.2374     194.693     
1 1 1 21 17 21 o 9  94.5925 2.86019 158.072     13.1328  160.938     13.9162  80.3351    240.653     32.4303     240.653     
1 1 1 21 17 22 o 4  159.678 2.84308 453.366     22.0717  454.451     23.391   160.045    275.727     92.5692     275.727     
1 1 1 21 17 23 o 14 94.8961 3.23075 170.976     15.3297  151.082     15.2663  84.9079    142.008     42.1284     142.008     
1 1 1 21 17 24 o 4  129.088 3.21393 308.046     20.0055  287.027     21.4159  113.472    247.345     44.3094     247.345     
1 1 1 21 17 25 o 3  115.326 2.84782 245.759     15.8305  228.679     16.9584  79.3686    278.645     4.87547     98.6454     
1 1 1 21 17 26 o 6  39.9026 5.24639 37.6324     10.0896  22.3683     9.96599  11.4684    113.586     9.74274     293.586     
1 1 1 21 17 27 o 9  126.114 2.81687 292.19      17.9189  275.245     17.6376  80.1261    112.263     19.608      292.263     
1 1 1 21 17 28 f 0  186.664 2.87085 646.574     25.812   596.201     27.7498  104.987    274.023     0           0           
1 1 1 21 17 29 o 15 115.197 2.80036 248.947     15.5802  225.028     16.6027  99.0882    195.42      37.45       195.42      
1 1 1 21 17 30 o 7  116.711 2.91112 258.976     16.7174  228.135     17.195   119.557    223.835     80.6429     223.835     
1 1 1 21 17 31 o 1  70.0975 3.47849 87.0813     11.483   89.6801     12.7808  40.7182    344.075     12.0968     164.075     
1 1 1 21 17 32 o 18 140.057 2.82213 356.23      17.9463  344.397     21.4075  112.433    293.954     26.1931     293.954     
1 1 1 21 17 33 o 16 28.5813 5.57815 10.0767     7.81407  20.844      9.09835  0.952505   273.168     20.5264     93.1675     
1 1 1 21 17 34 o 15 68.4634 3.41793 90.4499     11.0348  78.5575     12.1085  39.5637    248.764     14.2532     68.7638     
1 1 1 21 17 35 o 13 126.337 2.8445  297.725     17.149   273.416     18.6954  102.114    290.142     25.251      290.142     
1 1 1 21 17 36 o 7  117.828 2.90464 245.731     16.5906  251.374     17.6532  92.5779    200.997     18.2614     200.997     
1 1 1 21 17 37 o 11 20.5721 5.70486 5.33473     8.2823   4.39328     8.88239  0.364499   352.565     7.67888     172.565     
1 1 1 21 17 38 o 16 51.8578 4.06876 54.7556     10.374   43.9032     10.3029  23.0868    213.417     24.0621     33.417      
1 1 1 21 17 39 o 15 90.1064 3.12384 140.268     13.1954  151.951     14.9285  79.1093    250.924     33.3162     250.924     
1 1 1 21 17 40 f 0  27.8622 5.91526 19.6321     8.9997   8.7586      9.67755  34.1345    34.1902     0           0           
1 1 1 21 17 41 o 18 28.9629 6.11411 19.6595     9.76676  12.1014     9.64107  1.36366    3.92243     32.6797     183.922     
1 1 1 21 17 42 o 1  45.5157 4.52894 41.5128     9.50104  35.6985     10.4194  26.7085    278.521     5.8639      98.5214     
1 1 1 21 17 43 o 11 61.1072 3.69291 74.3324     10.7879  62.1735     11.4514  40.4796    302.616     1.81654     122.616     
1 1 1 21 17 44 o 1  46.6056 4.11745 37.5621     9.66631  42.8565     9.03687  23.6994    171.045     14.3006     351.045     
1 1 1 21 17 45 o 4  55.4452 3.61626 56.5522     10.2294  55.834      9.63347  44.7519    223.076     16.7439     223.076     
1 1 1 21 17 46 o 11 33.8399 5.08053 15.2508     8.38478  29.3792     8.45507  17.895     32.5917     4.49224     212.592     
1 1 1 21 17 47 o 5  53.1876 3.66307 52.649      9.53678  51.0819     9.73634  32.9831    114.201     4.94506     294.201     
1 1 1 21 17 48 o 5  31.2227 5.34026 14.1966     8.35185  23.8527     8.42353  17.7006    290.733     4.89204     290.733     
1 1 1 21 17 49 o 15 17.898  5.15715 6.29635     7.59426  -2.86323    7.70231  0.480435   354.206     15.3742     354.206     
1 1 1 21 17 50 o 12 56.3678 3.79145 63.5441     11.0727  53.7556     10.0924  35.4096    205.96      4.71712     25.9596     
1 1 1 21 17 51 o 9  27.4759 5.74687 13.3503     8.6722   16.0819     8.33153  12.9167    168.001     5.12715     348.001     
1 1 1 21 17 52 o 12 69.6118 3.34797 93.4593     11.7494  84.0395     11.458   43.0501    14.6693     8.37954     194.669     
1 1 1 21 17 53 o 1  23.1852 5.82929 7.55261     9.04957  11.152      8.17516  7.50687    349.531     10.3782     169.531     
1 1 1 21 17 54 o 11 77.9588 3.20413 105.943     12.6205  116.789     12.2598  57.2294    91.9465     9.03681     91.9465     
1 1 1 21 17 55 o 18 22.5692 5.81364 9.62192     8.70656  8.21745     8.35365  5.48584    270.427     14.6412     90.4274     
1 1 1 21 17 56 o 2  24.8119 5.86603 8.28285     8.91263  15.1748     8.65096  11.3955    210.966     3.27397     210.966     
1 1 1 21 17 57 o 12 14.5466 4.73871 -6.97336    8.16997  -2.99144    7.91087  0.0899804  298.454     5.3538      118.454     
1 1 1 21 17 58 o 16 33.8907 5.68072 19.3922     9.62953  27.8492     9.52072  14.3449    30.8224     13.6824     210.822     
1 1 1 21 17 59 o 10 27.4867 6.52638 11.7516     9.22281  19.7355     12.0572  10.4741    246.739     10.6148     66.7395     
1 1 1 21 17 60 o 13 41.7501 5.65861 45.7715     10.2693  26.0938     12.116   16.1883    317.082     20.9979     137.082     
1 1 1 21 17 61 o 10 24.8572 6.29862 12.7321     9.30599  11.1401     10.719   9.48009    28.9184     4.4165      208.918     
1 1 1 21 17 62 o 8  32.1628 6.56074 33.5241     11.978   9.33291     13.0517  15.7436    249.655     6.44556     69.655      
1 1 1 21 17 63 o 3  39.1556 6.25119 26.1251     12.1343  38.8902     11.9905  21.756     272.251     5.15025     92.2508     
1 1 1 21 17 64 o 6  15.9958 5.27653 -11.3429    10.6168  -3.72002    10.3761  1.76169    109.217     5.07667     289.217     
1 1 1 21 17 65 o 8  32.4222 6.74518 15.498      12.4029  30.5328     12.0532  6.51714    232.488     27.2148     52.4882     
1 1 1 21 17 66 f 0  29.613  7.24356 14.1633     14.7437  23.9597     12.4854  13.7528    62.9619     0           0           
1 1 1 21 17 67 o 7  27.7463 6.70197 26.9906     12.2534  2.78079     13.442   14.7599    203.812     5.1771      203.812     
1 1 1 21 17 68 o 2  24.7872 6.8052  18.4473     12.6873  5.36739     12.4149  9.71186    272.033     2.77832     92.0332     
1 1 1 21 17 69 o 9  19.1356 6.23201 -2.8105     13.9948  -2.48071    13.6281  1.14358    155.884     1.96945     335.884     
1 1 1 21 17 70 o 2  31.0456 7.9295  32.7814     16.8865  18.2029     15.269   15.0706    143.836     2.40568     143.836     
1 1 1 21 17 71 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 18 0  o 2  59.9173 3.52608 65.0848     10.413   65.0848     10.413   33.861     180         18.7494     2.25776e-05 
1 1 1 21 18 1  o 1  97.223  2.74285 173.29      13.32    163.345     13.3443  51.9647    201.327     34.435      21.3269     
1 1 1 21 18 2  o 16 18.6935 5.37382 2.6244      7.83172  2.39171     7.94402  12.0428    346.485     29.8076     346.485     
1 1 1 21 18 3  o 11 89.7478 2.90804 138.497     13.4323  148.654     12.5996  70.9211    331.582     19.6793     331.582     
1 1 1 21 18 4  f 0  143.354 2.61378 361.02      18.7726  369.872     18.7488  132.947    89.1211     0           0           
1 1 1 21 18 5  o 7  67.9233 3.42874 79.6813     11.0917  85.5229     12.0998  35.8788    334.843     18.2558     154.843     
1 1 1 21 18 6  o 1  85.3562 2.9334  129.927     12.1643  129.838     12.8461  40.6115    231.269     38.7567     51.269      
1 1 1 21 18 7  o 17 98.0243 2.79206 166.936     13.917   175.352     13.4353  65.7578    314.278     6.6973      134.278     
1 1 1 21 18 8  o 14 116.738 2.73135 244.376     16.3213  240.716     15.5891  84.6933    116.038     2.21246     116.038     
1 1 1 21 18 9  o 8  137.376 2.81343 334.093     18.004   337.682     20.6166  81.7994    38.5283     36.4572     218.528     
1 1 1 21 18 10 o 17 108.986 2.68275 203.456     14.5945  219.546     14.6517  69.5131    159.713     16.8894     339.713     
1 1 1 21 18 11 o 15 116.635 2.71042 245.973     15.4267  238.346     16.1906  95.0904    58.4013     24.3196     58.4013     
1 1 1 21 18 12 o 3  53.5902 3.81816 40.5335     9.96714  64.3742     9.69261  25.7021    101.411     11.8225     281.411     
1 1 1 21 18 13 o 13 153.3   2.61746 414.977     20.1148  420.706     20.1016  97.8551    333.134     28.0818     153.134     
1 1 1 21 18 14 o 8  112.223 2.8165  208.46      16.5217  240.797     14.8786  86.1633    333.745     12.732      333.745     
1 1 1 21 18 15 o 9  55.1056 3.78692 51.9713     10.4408  57.5311     10.1684  25.9745    152.341     16.4933     332.341     
1 1 1 21 18 16 o 11 166.99  2.96639 490.659     25.5068  502.698     24.0772  132.892    278.01      22.5568     278.01      
1 1 1 21 18 17 o 9  94.0443 3.19681 152.276     15.4453  163.793     14.5342  72.7877    218.271     14.8259     218.271     
1 1 1 21 18 18 o 13 115.627 3.33771 233.713     18.1937  244.039     20.383   84.4122    221.596     3.55591     221.595     
1 1 1 21 18 19 o 5  245.627 3.55555 1077.95     42.3939  1076.75     45.0948  213.291    315.445     66.3622     315.445     
1 1 1 21 18 20 f 0  112.325 3.08714 223.884     17.095   226.619     17.5931  22.7721    313.912     0           0           
1 1 1 21 18 21 o 18 77.0622 3.48163 103.082     13.0523  109.972     13.7011  36.159     197.842     34.9309     17.8417     
1 1 1 21 18 22 o 17 176.463 2.83458 565.086     25.0238  544.692     25.1024  157.107    99.1357     58.568      99.1357     
1 1 1 21 18 23 o 16 30.8109 5.92609 12.1187     8.76345  23.8502     10.3991  3.25498    157.394     34.0423     157.394     
1 1 1 21 18 24 o 17 207.544 3.05653 773.775     30.9546  763.59      32.5928  175.831    73.6268     49.9101     73.6268     
1 1 1 21 18 25 o 3  148.832 2.82334 387.9       20.4493  402.691     21.629   122.315    53.1076     30.7849     53.1076     
1 1 1 21 18 26 o 12 53.7696 3.71056 53.2343     9.47727  51.3475     10.2289  32.2176    183.641     1.68707     183.641     
1 1 1 21 18 27 o 7  26.621  5.55131 15.1212     7.4758   10.7578     8.58493  6.28572    333.619     32.2529     333.619     
1 1 1 21 18 28 o 6  124.025 2.68947 271.891     15.8444  277.231     17.5201  107.316    67.5402     38.9596     67.5402     
1 1 1 21 18 29 o 15 108.798 2.96398 209.102     15.1383  214.42      17.084   82.6493    314.926     11.3814     314.926     
1 1 1 21 18 30 o 7  19.921  5.47124 2.24115     7.60282  6.91384     8.20191  26.6489    329.73      74.3752     329.73      
1 1 1 21 18 31 o 11 119.627 2.94367 259.716     17.2079  252.507     18.0088  80.4411    146.488     10.223      326.488     
1 1 1 21 18 32 o 10 46.2146 4.67205 39.8313     10.4294  39.0667     10.5927  34.087     214.802     16.8927     214.802     
1 1 1 21 18 33 o 7  68.9805 3.61684 82.5278     12.3558  89.5357     12.4593  48.4879    154.124     1.14601     154.124     
1 1 1 21 18 34 o 13 37.0982 5.28473 33.1609     9.48213  19.4949     9.479    7.19537    188.477     34.2857     8.47751     
1 1 1 21 18 35 o 2  91.2984 3.08339 153.756     14.0105  145.894     14.1123  72.5169    131.442     16.4538     131.442     
1 1 1 21 18 36 o 3  54.9503 3.91534 55.0274     10.593   55.2103     10.6772  17.9505    274.327     40.1406     94.3274     
1 1 1 21 18 37 o 11 48.3647 4.2156  41.8037     9.2284   44.3752     10.7462  40.6854    282.26      22.7453     282.26      
1 1 1 21 18 38 o 18 25.5871 5.47945 11.6226     7.69326  12.9026     7.58103  0.236875   335.168     29.4406     155.168     
1 1 1 21 18 39 o 8  65.3406 3.2885  81.2162     10.5613  73.5118     10.797   58.2177    101.292     28.4934     101.292     
1 1 1 21 18 40 o 2  67.2348 3.13498 84.0472     10.2479  79.4837     10.732   51.7346    155.757     11.332      155.757     
1 1 1 21 18 41 o 15 66.1043 3.16919 78.8922     10.2812  79.3541     10.5905  25.7116    106.307     40.542      286.307     
1 1 1 21 18 42 o 17 131.165 2.63054 302.6       16.9489  315.245     17.6002  106.708    20.2619     28.6203     20.2619     
1 1 1 21 18 43 o 4  27.8833 5.72345 12.8372     8.09681  17.2102     8.89629  4.92103    17.7387     23.853      197.739     
1 1 1 21 18 44 o 8  23.9676 5.84497 11.3301     8.14194  8.77417     9.00985  6.62361    170.575     3.18047     350.575     
1 1 1 21 18 45 o 14 40.7551 5.2216  37.6784     10.412   26.4015     10.0506  29.6118    162.387     9.20458     162.387     
1 1 1 21 18 46 f 0  26.8367 6.02435 11.3158     9.27851  15.9439     9.09035  16.4993    178.126     0           0           
1 1 1 21 18 47 o 15 60.9236 3.7493  73.7557     11.4726  62.9086     11.1559  42.2877    317.922     1.99689     317.922     
1 1 1 21 18 48 o 14 68.0342 3.73869 90.7702     13.5004  79.5887     11.8063  57.4584    50.207      22.8108     50.207      
1 1 1 21 18 49 o 4  42.9926 4.62549 34.3954     10.1168  35.8243     9.12649  25.9113    58.8443     4.73173     238.844     
1 1 1 21 18 50 o 9  29.4607 5.49725 23.8094     8.72849  10.6363     8.43209  13.0493    178.067     10.2114     358.067     
1 1 1 21 18 51 o 19 20.7341 5.64706 5.72437     8.24009  6.8395      8.33562  5.73293    298.787     1.00594     118.787     
1 1 1 21 18 52 o 6  43.0611 4.72824 47.5929     9.57684  25.3667     9.49289  26.1053    254.711     4.3462      74.7114     
1 1 1 21 18 53 o 14 65.1269 3.57988 70.8458     11.5514  86.9231     11.5195  45.5919    308.859     3.19159     308.859     
1 1 1 21 18 54 o 7  59.6835 3.77777 69.7574     11.3096  63.633      11.0411  45.3777    299.077     11.0877     299.077     
1 1 1 21 18 55 o 10 36.5311 5.31792 31.2864     9.49622  22.5761     9.33976  20.9414    86.9325     4.36738     266.932     
1 1 1 21 18 56 o 6  41.3478 5.10086 39.1507     9.9636   29.013      10.2463  21.017     145.19      11.5905     325.19      
1 1 1 21 18 57 o 11 33.6869 5.72072 19.2142     9.67067  27.7626     9.569    20.44      155.488     0.456802    155.488     
1 1 1 21 18 58 o 12 59.4266 3.80791 63.0958     11.2109  70.2811     11.1906  45.7193    91.4165     13.7109     91.4165     
1 1 1 21 18 59 o 8  62.4217 3.97927 66.2669     11.8876  82.1176     12.6973  47.6297    330.243     13.7096     330.243     
1 1 1 21 18 60 o 6  29.6883 6.32052 21.4274     10.9188  16.1852     9.4631   11.8959    136.174     11.3791     316.174     
1 1 1 21 18 61 o 9  33.9837 6.48287 15.8354     12.1403  33.7813     11.6616  19.8632    267.312     1.07372     87.3123     
1 1 1 21 18 62 o 14 24.2846 6.64391 12.2518     11.5867  8.51863     11.5066  10.5053    82.9785     4.86456     262.979     
1 1 1 21 18 63 o 10 23.5482 6.5458  9.41921     11.5574  9.57183     11.0668  10.3654    233.221     2.54315     53.2214     
1 1 1 21 18 64 o 7  34.0612 6.84202 24.1112     12.4572  28.0263     12.0806  24.3885    116.458     15.2785     116.458     
1 1 1 21 18 65 o 12 28.9493 7.35511 19.2805     13.6408  18.9614     13.5347  14.0418    129.737     4.60669     309.737     
1 1 1 21 18 66 o 6  36.2153 8.16944 35.6055     15.27    31.9459     18.7938  15.5688    131.286     11.293      131.286     
1 1 1 21 18 67 o 8  29.0321 7.51859 7.1259      15.3687  31.8139     15.6867  13.8074    110.955     4.27942     110.955     
1 1 1 21 18 68 o 4  29.1134 7.75439 21.3105     15.3524  22.024      15.4504  12.0367    317.677     3.32804     317.677     
1 1 1 21 18 69 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 19 0  o 3  43.0643 4.46247 35.0674     9.02615  35.0674     9.02615  10.5751    180         84.5        180         
1 1 1 21 19 1  o 13 113.836 2.6813  230.302     15.2265  231.23      15.3234  96.8604    64.0057     31.11       64.0057     
1 1 1 21 19 2  o 4  137.834 2.65498 344.733     17.8738  331.673     18.7375  113.671    30.7266     26.8528     30.7266     
1 1 1 21 19 3  o 14 26.3384 5.93357 13.3076     8.78908  11.292      8.88726  12.9519    56.8446     47.6026     56.8446     
1 1 1 21 19 4  o 6  208.524 2.92961 774.648     30.609   773.629     30.6199  202.941    292.197     98.6228     292.197     
1 1 1 21 19 5  o 17 89.9257 3.06194 149.927     13.4423  138.915     14.0284  42.49      210.589     43.6885     30.5886     
1 1 1 21 19 6  o 3  179.313 2.89944 578.171     26.693   566.741     25.4112  168.612    199.666     74.2753     199.666     
1 1 1 21 19 7  o 4  113.057 2.90397 221.102     16.7432  234.755     16.0692  63.6997    239.043     36.7282     59.0428     
1 1 1 21 19 8  f 0  27.6492 6.01154 18.004      9.40579  9.26442     9.34354  2.67479    280.464     0           0           
1 1 1 21 19 9  o 4  61.3952 3.82278 73.3089     11.4328  62.6585     11.7558  23.1769    178.088     36.9737     358.088     
1 1 1 21 19 10 o 11 209.358 3.1825  772.728     32.5206  790.16      34.2532  173.67     308.063     38.2404     308.063     
1 1 1 21 19 11 o 14 118.672 3.01341 249.348     17.3198  253.182     18.4538  84.7848    164.53      2.11415     344.529     
1 1 1 21 19 12 o 6  34.5085 5.76378 32.7679     10.2246  12.3727     10.2642  2.21237    66.9747     28.5113     246.975     
1 1 1 21 19 13 o 11 33.3137 6.19653 20.2423     10.2378  21.5371     10.7278  5.2219     50.3189     46.5958     50.3189     
1 1 1 21 19 14 o 12 40.9413 5.4272  33.1098     10.6204  29.3705     10.8146  13.2571    275.438     13.8585     95.4381     
1 1 1 21 19 15 o 16 96.8561 3.26645 174.812     15.7186  160.974     15.8715  67.8252    164.544     1.91503     344.544     
1 1 1 21 19 16 o 17 236.351 3.25784 1003.5      38.569   991.165     38.6049  194.483    54.534      40.4832     54.534      
1 1 1 21 19 17 o 7  134.128 2.88955 291.343     19.1871  352.134     19.5088  109.009    4.71329     24.0289     4.71329     
1 1 1 21 19 18 o 14 82.0574 2.98683 113.885     12.0109  127.165     12.4638  61.1486    8.40059     9.2712      8.40058     
1 1 1 21 19 19 o 8  145.597 2.81743 376.464     19.976   380.031     21.0894  95.6636    106.909     20.7588     286.909     
1 1 1 21 19 20 o 8  70.137  3.14803 92.2129     10.913   84.2997     11.0759  38.0655    328.124     20.0306     148.124     
1 1 1 21 19 21 o 4  98.8587 2.72925 164.865     13.4252  184.433     13.5387  60.4118    161.993     20.0256     341.993     
1 1 1 21 19 22 o 18 95.5248 3.07735 171.748     14.1581  155.14      15.1291  50.1171    202.108     35.903      22.1075     
1 1 1 21 19 23 o 15 161.189 2.58983 454.074     20.4113  472.248     21.4305  141.11     107.619     48.7081     107.619     
1 1 1 21 19 24 o 1  114.56  2.66605 238.03      14.8953  230.615     15.6499  86.4403    253.677     8.83268     253.677     
1 1 1 21 19 25 o 7  40.6967 5.34267 21.6398     10.4363  41.6816     10.2706  9.01418    39.8263     72.1627     39.8263     
1 1 1 21 19 26 o 17 130.162 2.8502  299.468     18.5515  306.352     18.5857  97.4225    355.983     6.90385     355.983     
1 1 1 21 19 27 o 13 48.7905 4.49206 41.997      10.6695  45.5112     10.7636  34.0449    134.656     8.1691      134.656     
1 1 1 21 19 28 o 10 18.3745 5.43334 0.891624    8.2313   2.02687     8.51859  6.0678     341.307     24.46       341.307     
1 1 1 21 19 29 o 5  126.75  3.01211 290.643     20.0033  285.155     18.1785  95.8911    0.0170658   8.59395     0.0170658   
1 1 1 21 19 30 o 19 160.631 2.83426 457.503     22.2929  465.919     23.3149  120.874    342.363     8.84388     342.363     
1 1 1 21 19 31 o 6  56.1571 3.70884 63.6348     9.78969  51.3064     10.6097  36.3998    353.855     4.34044     173.855     
1 1 1 21 19 32 o 13 80.3574 2.86836 114.409     11.267   117.498     11.76    38.6606    100.282     37.241      280.282     
1 1 1 21 19 33 o 15 62.3256 3.41318 75.4281     10.2003  65.4301     10.8453  38.7716    219.946     9.23471     39.9464     
1 1 1 21 19 34 o 1  61.1738 3.37503 69.8942     10.2316  65.7439     10.2879  26.2992    42.3068     33.1625     222.307     
1 1 1 21 19 35 o 19 99.3789 2.79599 176.067     13.8516  178.695     13.9425  91.0054    356.462     41.5679     356.462     
1 1 1 21 19 36 o 6  134.777 2.8246  324.212     19.9108  328.429     18.147   119.646    45.342      46.8291     45.342      
1 1 1 21 19 37 o 14 37.1081 5.40535 16.992      9.1171   37.3653     10.5262  24.9517    100.476     7.38488     100.476     
1 1 1 21 19 38 o 1  124.056 2.86253 282.609     17.7793  271.3       17.7601  106.477    215.869     36.6663     215.869     
1 1 1 21 19 39 o 14 47.9736 4.20828 49.3416     9.82702  36.4725     9.75807  40.5692    258.421     20.2707     258.421     
1 1 1 21 19 40 o 18 93.0036 2.94087 155.219     13.824   156.929     13.5162  84.9072    195.26      39.7879     195.26      
1 1 1 21 19 41 o 8  70.1196 3.22028 84.7429     11.2159  93.8359     11.2722  39.24      205.165     19.332      25.1651     
1 1 1 21 19 42 o 11 55.6357 3.6237  57.4281     9.96186  56.0172     10.0156  34.345     137.075     7.29527     317.075     
1 1 1 21 19 43 o 15 97.6495 2.8222  167.267     13.7361  176.843     13.8211  89.8451    325.046     43.6022     325.046     
1 1 1 21 19 44 o 18 93.5613 2.81331 158.571     13.0188  157.485     13.3     73.0736    331.036     15.502      331.036     
1 1 1 21 19 45 o 12 13.6204 4.49715 -4.72928    8.01479  -8.24109    7.0821   6.99112    153.319     25.4288     153.319     
1 1 1 21 19 46 o 4  48.1448 4.25229 47.1018     10.5149  39.8759     9.56106  30.6287    174.465     3.44106     354.465     
1 1 1 21 19 47 o 4  65.9244 3.5004  75.1747     10.9958  84.638      11.9709  57.9209    156.179     26.0912     156.179     
1 1 1 21 19 48 o 8  50.0029 4.58499 36.8317     10.9404  59.3208     10.8251  33.3794    239.197     0.536339    59.1968     
1 1 1 21 19 49 o 16 36.6439 5.87336 20.0492     11.0832  34.4081     10.2852  29.0471    353.953     14.401      353.953     
1 1 1 21 19 50 o 16 44.9719 5.24361 60.5988     10.7802  22.4941     10.7874  30.4172    357.975     1.36667     357.975     
1 1 1 21 19 51 o 13 29.0036 6.05557 25.9158     10.4908  7.93699     9.79598  16.6572    130.395     0.93471     310.395     
1 1 1 21 19 52 o 19 30.7258 5.96637 22.4204     9.87355  16.672      9.14622  20.8552    353.82      7.4601      353.82      
1 1 1 21 19 53 o 19 81.0552 3.22089 131.904     12.7154  111.007     13.209   60.2984    145.136     10.0642     145.136     
1 1 1 21 19 54 o 5  39.7611 5.1576  38.3224     9.84049  25.3327     9.81178  29.6245    213.561     9.36822     213.561     
1 1 1 21 19 55 o 16 16.6964 5.17197 -3.77199    8.53779  2.3332      8.26392  1.3579     141.478     4.27433     321.478     
1 1 1 21 19 56 o 4  31.2029 6.00373 21.3088     9.67398  19.6662     9.60825  19.8776    300.797     6.89675     300.797     
1 1 1 21 19 57 o 12 16.5317 5.14462 3.06257     8.51159  -5.87217    8.4943   0.13369    220.4       11.9027     220.4       
1 1 1 21 19 58 o 17 49.1892 4.4913  46.6327     10.7708  47.4505     10.8555  33.0983    227.722     2.38714     227.722     
1 1 1 21 19 59 o 4  57.7261 4.24811 55.641      11.4362  72.9051     12.7436  49.1868    153.323     23.3628     153.323     
1 1 1 21 19 60 o 11 48.0327 6.15876 40.271      14.8017  56.5486     13.3489  23.8949    290.646     15.0263     110.646     
1 1 1 21 19 61 o 8  24.813  6.80678 18.4439     13.5885  3.53291     11.3062  9.8148     65.435      4.0988      65.435      
1 1 1 21 19 62 o 12 28.3564 6.9729  4.32635     13.5364  27.8106     13.41    15.767     223.148     0.0844619   43.1479     
1 1 1 21 19 63 o 10 44.4771 7.01039 49.0533     15.7326  40.9305     14.7523  26.0496    17.2577     4.37549     197.258     
1 1 1 21 19 64 o 6  25.9346 7.01567 23.115      13.8794  3.04202     13.3719  5.72536    218.965     2.55226     218.965     
1 1 1 21 19 65 o 7  35.1531 7.5957  38.715      14.979   23.789      15.1765  19.7099    341.609     1.4497      161.609     
1 1 1 21 19 66 o 14 23.793  7.13809 1.88237     15.1743  16.4755     15.242   6.52717    22.363      1.69307     202.363     
1 1 1 21 19 67 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 19 68 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 20 0  o 16 12.7745 5.89754 -0.924133   9.24513  -0.924133   9.24513  20.6271    3.55503e-05 46.4086     3.55503e-05 
1 1 1 21 20 1  f 0  25.3782 6.17938 11.7178     9.56189  9.79279     9.50027  26.311     286.607     0           0           
1 1 1 21 20 2  f 0  92.5104 3.34594 146.359     15.836   160.305     15.0078  66.3167    182.772     0           0           
1 1 1 21 20 3  o 2  24.2503 5.98988 8.58064     9.10391  10.5738     8.85506  6.36438    209.537     25.8598     209.537     
1 1 1 21 20 4  o 7  95.9004 3.06042 154.988     14.6535  174.084     14.648   69.6059    301.383     2.10975     301.383     
1 1 1 21 20 5  o 1  53.5447 4.12498 46.4715     10.8036  57.8856     10.8566  18.4169    340.266     34.4144     160.266     
1 1 1 21 20 6  o 12 40.8664 5.44955 33.3689     10.8214  29.0515     10.6734  14.4058    20.1851     8.36379     200.185     
1 1 1 21 20 7  o 9  128.185 3.18282 286.687     19.6947  300.855     21.1341  92.2028    77.4711     2.97613     257.471     
1 1 1 21 20 8  o 10 139.404 3.22693 363.531     24.5348  331.751     20.4545  141.999    150.2       82.7557     150.2       
1 1 1 21 20 9  o 19 149.395 3.02405 399.227     22.0514  397.975     23.1669  121.751    73.2748     24.388      73.2748     
1 1 1 21 20 10 o 14 70.9982 3.58758 87.8915     12.6446  93.4962     12.7084  60.1955    104.254     30.2818     104.254     
1 1 1 21 20 11 o 14 185.354 3.0484  606.683     28.31    619.975     28.3198  128.28     242.86      17.6201     62.8595     
1 1 1 21 20 12 o 1  91.0374 2.96731 156.197     13.4671  140.451     13.5033  60.1069    134.636     9.5005      314.636     
1 1 1 21 20 13 o 18 100.58  2.91604 183.116     14.6379  178.547     14.6936  90.1432    77.3249     38.6421     77.3249     
1 1 1 21 20 14 o 16 74.231  3.24114 103.293     12.0079  94.5584     11.9713  40.2233    288.127     23.397      108.127     
1 1 1 21 20 15 o 10 105.859 2.92105 197.197     15.7796  203.501     15.1327  66.028     351.643     20.8431     171.643     
1 1 1 21 20 16 o 13 88.3722 3.0126  146.121     13.3176  133.643     13.2688  58.1025    169.782     9.07561     349.782     
1 1 1 21 20 17 o 2  52.6961 4.0496  48.1413     10.6654  52.9072     10.3337  27.8106    152.721     11.7602     332.721     
1 1 1 21 20 18 o 4  114.272 3.03499 232.467     16.1652  234.893     18.4651  72.1672    200.973     21.5633     20.9731     
1 1 1 21 20 19 o 8  204.8   3.20581 771.181     32.9245  730.112     32.8633  157.42     253.439     13.0476     253.439     
1 1 1 21 20 20 o 13 23.9188 6.10643 8.97066     9.44254  9.00295     9.31593  11.4816    27.4698     46.8907     27.4698     
1 1 1 21 20 21 o 17 117.868 3.54447 243.605     20.8846  255.968     20.8828  63.573     314.289     44.7904     134.289     
1 1 1 21 20 22 o 2  24.3544 6.1238  13.1043     9.35314  5.00568     10.0315  1.34157    162.186     23.26       162.186     
1 1 1 21 20 23 o 5  62.4357 4.28876 69.0095     12.7482  73.1819     13.7537  33.7967    231.63      20.1043     51.6302     
1 1 1 21 20 24 o 8  87.0182 3.54671 154.335     15.3235  119.756     15.2829  47.7299    79.3552     30.332      259.355     
1 1 1 21 20 25 o 19 37.0157 5.75073 30.5047     9.68712  21.7627     11.1217  14.1358    290.367     19.8526     110.367     
1 1 1 21 20 26 f 0  26.6547 6.05702 10.9452     8.7707   15.0155     9.64264  19.0291    163.37      0           0           
1 1 1 21 20 27 o 15 139.001 2.85822 353.966     19.2517  338.593     20.4706  108.772    24.4225     15.1294     24.4225     
1 1 1 21 20 28 o 16 21.6443 5.71884 10.1804     8.14214  1.53188     9.35355  0.517809   290.697     18.303      110.697     
1 1 1 21 20 29 o 15 58.1138 3.63347 60.9437     10.3327  61.8674     10.6128  45.0977    185.041     10.3155     185.041     
1 1 1 21 20 30 o 3  21.9407 5.58602 10.6774     8.07801  4.12093     7.99145  0.188321   280.055     21.3735     100.055     
1 1 1 21 20 31 o 12 54.2684 3.83636 56.0953     10.2916  51.6783     10.2799  38.2812    261.453     2.17602     261.453     
1 1 1 21 20 32 o 3  39.0767 4.84449 32.2707     9.30044  25.5341     8.95052  18.4768    301.492     14.5449     121.492     
1 1 1 21 20 33 o 12 69.4801 3.23232 81.0252     11.1664  94.0321     11.1661  48.6421    65.0714     0.554944    245.071     
1 1 1 21 20 34 o 17 141.98  2.81802 368.918     20.3714  356.068     19.692   108.173    199.54      11.6372     199.54      
1 1 1 21 20 35 o 12 100.994 2.81538 185.252     14.3529  181.972     14.0902  81.4661    259.268     18.8676     259.268     
1 1 1 21 20 36 o 6  89.452  2.90181 147.685     12.91    140.976     13.0284  72.3254    279.605     17.8688     279.605     
1 1 1 21 20 37 o 7  39.6019 5.00293 26.567      9.79034  33.3505     9.23278  30.3893    112.104     18.0974     112.104     
1 1 1 21 20 38 o 8  16.336  4.99638 -3.15273    7.54907  1.85992     7.6538   1.10088    121.966     10.564      121.966     
1 1 1 21 20 39 o 5  20.7165 5.29534 12.9062     8.07245  -3.37616    8.0277   3.60797    233.727     8.8007      53.7274     
1 1 1 21 20 40 o 13 52.5788 3.91727 52.7399     10.1487  49.4195     10.1733  37.5303    21.1812     3.65103     21.1812     
1 1 1 21 20 41 o 3  56.4232 4.14525 66.4929     11.1815  52.0634     11.6648  31.457     13.3503     15.0923     193.35      
1 1 1 21 20 42 o 16 58.5208 3.85844 60.4569     11.1723  66.0423     11.1779  38.4068    37.0668     3.95665     217.067     
1 1 1 21 20 43 o 19 73.5716 3.47193 101.458     12.8006  96.7156     12.652   51.9054    88.7827     1.09345     88.7827     
1 1 1 21 20 44 o 10 29.3146 5.81965 10.2658     9.35094  23.5217     9.32257  4.6773     84.246      28.8576     264.246     
1 1 1 21 20 45 o 16 33.8072 5.42425 9.47558     9.71892  36.765      9.69155  8.65462    248.417     27.7105     68.4172     
1 1 1 21 20 46 o 6  54.2546 4.03759 55.0244     10.7622  55.2494     10.8647  46.0227    359.814     18.8132     359.814     
1 1 1 21 20 47 o 13 30.0793 5.66628 25.7634     9.14714  10.6113     9.22755  18.843     214.758     11.3792     214.758     
1 1 1 21 20 48 o 16 52.1621 4.48903 45.9711     11.7456  58.3281     10.8961  42.4906    86.7052     14.9035     86.7052     
1 1 1 21 20 49 o 7  22.9016 5.9451  10.6298     9.03608  7.90691     8.9044   6.83587    39.5156     12.8747     219.516     
1 1 1 21 20 50 o 1  32.2418 5.90374 25.5953     9.70122  17.5223     9.75225  18.0956    133.051     4.23457     313.051     
1 1 1 21 20 51 o 13 19.6617 5.86514 3.8537      8.96294  2.25998     10.8833  5.10554    164.687     7.90305     344.687     
1 1 1 21 20 52 o 19 21.4292 6.10203 13.109      11.2776  -3.74132    10.2037  6.93745    276.441     6.97089     96.441      
1 1 1 21 20 53 o 11 30.0318 6.68085 21.4578     11.3357  17.2145     11.1805  3.88094    275.837     30.5419     95.8373     
1 1 1 21 20 54 o 12 17.669  5.58774 -3.12618    10.0496  -0.106067   10.2735  1.73279    50.8152     9.48235     230.815     
1 1 1 21 20 55 o 1  16.9125 5.26252 -5.48483    8.78444  3.19861     8.92568  0.130939   26.7528     13.9237     26.7531     
1 1 1 21 20 56 o 5  30.926  6.2596  19.7786     10.151   21.1436     10.244   17.5062    142.314     1.28443     322.313     
1 1 1 21 20 57 f 0  27.7844 6.474   13.7052     11.1944  18.4783     10.0146  15.0001    17.4473     0           0           
1 1 1 21 20 58 o 15 50.6961 5.25946 46.7298     12.8703  56.6942     12.9437  39.3843    65.3476     12.6398     65.3476     
1 1 1 21 20 59 o 13 33.3605 7.50007 33.9097     14.6571  16.9364     14.8231  21.3486    241.105     2.87274     241.105     
1 1 1 21 20 60 o 4  31.5773 7.79337 42.7763     18.9991  2.79651     14.8861  11.4899    75.1678     16.1654     255.168     
1 1 1 21 20 61 o 15 18.7197 6.06115 3.92299     13.3521  -14.9371    13.19    3.54466    272.163     1.53356     92.1632     
1 1 1 21 20 62 o 15 17.8177 5.90645 -5.00524    13.02    -8.83538    13.6173  1.68013    26.2742     12.1709     206.274     
1 1 1 21 20 63 o 5  24.0091 7.14485 12.6413     14.6516  7.76814     14.704   8.16734    185.388     0.250947    5.38803     
1 1 1 21 20 64 o 2  18.8393 6.21945 -3.56478    14.6203  -5.3382     14.3418  0.503408   287.066     0.870375    107.066     
1 1 1 21 20 65 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 20 66 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 21 21 0  o 14 21.6945 8.05309 12.2835     11.5637  12.2835     11.5637  35.3788    180         85.323      180         
1 1 1 21 21 1  o 2  124.328 2.9119  275.829     18.0977  275.829     18.0977  136.785    30          86.653      30          
1 1 1 21 21 2  o 19 203.121 3.09013 735.206     31.4224  735.206     31.4224  152.648    60          0.062722    240.004     
1 1 1 21 21 3  o 5  59.7379 3.90659 65.2596     11.4527  65.2596     11.4527  51.266     270         31.4098     270         
1 1 1 21 21 4  f 0  44.2893 5.0297  37.6787     10.3009  37.6787     10.3009  66.7204    120         0           0           
1 1 1 21 21 5  o 18 79.726  3.29218 114.324     13.05    114.324     13.05    38.4911    150         42.8017     330         
1 1 1 21 21 6  o 14 77.6086 3.36691 108.471     12.9808  108.471     12.9808  51.1916    180         14.1704     8.65145e-06 
1 1 1 21 21 7  o 8  71.2031 3.24526 91.3779     11.4682  91.3779     11.4682  47.5875    210         11.6759     30          
1 1 1 21 21 8  o 4  57.3185 3.92653 60.2387     11.0196  60.2387     11.0196  28.8849    240         27.9936     60          
1 1 1 21 21 9  o 15 35.9932 6.00727 26.7418     9.41034  26.7418     9.41034  7.611      90          0.840042    270         
1 1 1 21 21 10 o 3  127.769 2.80747 291.186     17.937   291.186     17.937   72.3925    300         46.7853     120         
1 1 1 21 21 11 o 14 96.4535 3.09996 166.632     14.9135  166.632     14.9135  91.7484    330         38.9667     330         
1 1 1 21 21 12 o 3  84.1579 3.15667 127.166     13.2272  127.166     13.2272  51.0975    360         23.8336     180         
1 1 1 21 21 13 o 13 14.9606 6.33077 4.31801     8.45066  4.31801     8.45066  12.5492    210         32.8393     210         
1 1 1 21 21 14 o 12 118.577 2.95142 251.181     17.4892  251.181     17.4892  78.0863    60          21.1457     240         
1 1 1 21 21 15 o 19 43.4242 5.75851 37.2039     11.2424  37.2039     11.2424  10.7735    89.9998     6.84658     89.9998     
1 1 1 21 21 16 o 18 125.782 3.2002  282.972     20.113   282.972     20.113   101.841    300         15.9012     300         
1 1 1 21 21 17 o 12 131.214 3.06586 307.661     20.1102  307.661     20.1102  111.754    330         27.7968     330         
1 1 1 21 21 18 o 19 11.5298 5.44081 -2.63397    8.58086  -2.63397    8.58086  45.184     180         104.763     180         
1 1 1 21 21 19 f 0  18.0302 7.10046 8.18029     9.51885  8.18029     9.51885  21.8991    30          0           0           
1 1 1 21 21 20 o 17 50.7406 4.83182 48.6281     11.6604  48.6281     11.6604  37.3489    60          0.669992    240         
1 1 1 21 21 21 o 4  135.224 2.78245 326.406     18.8195  326.406     18.8195  112.361    90          23.8754     90          
1 1 1 21 21 22 o 9  32.8042 6.35626 23.2591     9.03347  23.2591     9.03347  21.1664    300         6.42569     300         
1 1 1 21 21 23 o 10 93.44   2.83772 156.403     13.2322  156.403     13.2322  83.4198    150         28.3917     150         
1 1 1 21 21 24 o 6  57.8285 3.62807 61.1755     10.3151  61.1755     10.3151  25.6555    180         34.261      8.6514e-06  
1 1 1 21 21 25 o 17 77.5826 3.06221 108.371     11.8204  108.371     11.8204  41.3505    210         31.9469     30          
1 1 1 21 21 26 o 7  112.23  2.71179 225.208     15.2115  225.208     15.2115  118.984    240         72.354      240         
1 1 1 21 21 27 o 19 31.0923 6.43199 21.4137     8.70364  21.4137     8.70364  5.60431    270         2.79771     270         
1 1 1 21 21 28 o 17 83.2373 3.1041  124.756     12.8656  124.756     12.8656  39.8279    120         42.809      300         
1 1 1 21 21 29 o 7  14.4758 6.03664 4.51188     7.47912  4.51188     7.47912  1.14327    330         4.77361     330         
1 1 1 21 21 30 o 17 31.563  6.30657 21.8558     8.63715  21.8558     8.63715  17.7682    180         8.73792     8.6514e-06  
1 1 1 21 21 31 o 6  30.4544 6.30778 20.5969     8.36154  20.5969     8.36154  18.6145    30          6.9477      30          
1 1 1 21 21 32 o 11 13.834  5.93341 3.4797      7.62844  3.4797      7.62844  0.198347   240         0.805502    240         
1 1 1 21 21 33 o 15 40.0805 4.75808 31.2888     8.74823  31.2888     8.74823  17.9034    270         22.6349     90          
1 1 1 21 21 34 o 9  45.343  4.26044 38.9133     9.2042   38.9133     9.2042   37.2694    120         8.66647     120         
1 1 1 21 21 35 o 7  21.2137 6.91889 12.0961     8.08587  12.0961     8.08587  0.446974   330         28.8884     330         
1 1 1 21 21 36 o 17 89.5035 2.86299 144.016     12.7816  144.016     12.7816  76.9713    180         24.1087     180         
1 1 1 21 21 37 o 12 66.1891 3.73555 80.2389     12.2038  80.2389     12.2038  78.6969    210         61.9433     210         
1 1 1 21 21 38 o 16 14.0479 6.00386 3.77372     7.75297  3.77372     7.75297  4.96963    60          21.8398     60          
1 1 1 21 21 39 o 14 17.0806 6.611   7.73543     8.09306  7.73543     8.09306  0.736224   270         14.4004     90          
1 1 1 21 21 40 o 15 21.9478 7.03575 12.9838     8.34822  12.9838     8.34822  9.03034    300         1.69777     120         
1 1 1 21 21 41 o 11 28.1907 7.15879 19.4181     9.2498   19.4181     9.2498   20.7106    150         4.93583     150         
1 1 1 21 21 42 o 5  57.2345 3.70462 60.5465     10.4103  60.5465     10.4103  46.1056    180         10.2537     180         
1 1 1 21 21 43 o 17 9.87167 4.79227 -4.78968    7.66674  -4.78968    7.66674  0.936047   30          2.96229     30          
1 1 1 21 21 44 o 6  52.5657 3.98912 51.7784     10.2032  51.7784     10.2032  39.3943    240         3.87372     240         
1 1 1 21 21 45 o 16 35.288  6.34899 27.0167     9.70634  27.0167     9.70634  18.8544    90          12.4405     270         
1 1 1 21 21 46 o 6  23.7688 7.2966  15.3116     8.98599  15.3116     8.98599  3.25224    300         1.63497     300         
1 1 1 21 21 47 o 2  61.623  3.82748 70.576      11.6009  70.576      11.6009  57.4906    330         27.8181     330         
1 1 1 21 21 48 f 0  56.171  4.10437 59.3956     11.2463  59.3956     11.2463  23.6129    4.00046e-06 0           0           
1 1 1 21 21 49 o 13 13.6304 6.05561 2.6176      8.64528  2.6176      8.64528  0.0780024  30          3.84093     30          
1 1 1 21 21 50 o 2  17.7565 7.086   8.69388     9.63832  8.69388     9.63832  1.4866     60          25.5328     60          
1 1 1 21 21 51 o 15 13.6305 6.10307 2.31915     8.97383  2.31915     8.97383  6.61897    270         27.7719     270         
1 1 1 21 21 52 o 12 12.3195 5.70019 -0.104987   8.70707  -0.104987   8.70707  12.9978    300         39.8138     300         
1 1 1 21 21 53 o 19 20.28   7.57886 12.1278     10.2961  12.1278     10.2961  1.43698    150         23.1286     330         
1 1 1 21 21 54 f 0  48.6327 5.21301 46.844      11.8416  46.844      11.8416  39.1145    360         0           0           
1 1 1 21 21 55 o 10 46.6551 6.52736 45.5988     13.566   45.5988     13.566   30.9948    30          2.52984     210         
1 1 1 21 21 56 o 14 95.4254 3.74912 167.784     17.8014  167.784     17.8014  89.2851    240         47.0094     240         
1 1 1 21 21 57 f 0  38.7292 8.22785 36.0511     13.9138  36.0511     13.9138  17.8954    270         0           0           
1 1 1 21 21 58 o 5  43.3551 7.60859 42.4725     14.3063  42.4725     14.3063  30.2085    120         26.5402     120         
1 1 1 21 21 59 o 3  13.6395 6.49018 -2.4926     12.6773  -2.4926     12.6773  0.0394069  330         0.756959    150         
1 1 1 21 21 60 o 14 16.8959 7.96155 0.916067    18.2605  0.916067    18.2605  1.42642    180         13.649      8.70427e-06 
1 1 1 21 21 61 o 14 17.5822 7.78604 7.37673     14.1691  7.37673     14.1691  2.21002    30          10.0027     210         
1 1 1 21 21 62 o 7  11.375  5.68354 -12.1961    13.1352  -12.1961    13.1352  0.745359   60          2.42543     60          
1 1 1 21 21 63 o 5  11.7496 5.87842 -13.1146    14.206   -13.1146    14.206   0.369972   89.9999     1.17881     89.9999     
1 1 1 21 21 64 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 0  0  f 0  160.809 3.37464 459.442     27.1413  459.442     27.1413  215.116    180         0           0           
1 1 1 22 0  1  o 3  207.131 2.44991 760.894     25.4145  760.894     25.4145  133.537    240         34.9759     60          
1 1 1 22 0  2  o 12 738.446 5.87165 9672.38     217.228  9672.38     217.228  667.586    300         256.639     300         
1 1 1 22 0  3  o 18 496.829 4.16323 4376.96     103.624  4376.96     103.624  362.98     180         0.419067    180         
1 1 1 22 0  4  o 2  287.09  2.89219 1461.49     41.5917  1461.49     41.5917  182.358    240         54.4532     60          
1 1 1 22 0  5  o 14 621.669 5.18893 6854.39     161.607  6854.39     161.607  559.849    300         212.25      300         
1 1 1 22 0  6  o 3  393.749 3.59766 2749.14     70.9638  2749.14     70.9638  252.682    180         69.215      8.70172e-06 
1 1 1 22 0  7  o 4  241.306 2.82098 1032.72     34.0926  1032.72     34.0926  240.608    60          131.787     60          
1 1 1 22 0  8  o 2  454.177 4.00898 3657.87     91.2151  3657.87     91.2151  360.597    120         58.9487     120         
1 1 1 22 0  9  o 14 427.137 3.82806 3235.25     81.9124  3235.25     81.9124  462.465    8.17899e-06 302.404     8.17899e-06 
1 1 1 22 0  10 o 13 151.006 2.38351 404.682     18.0171  404.682     18.0171  96.0492    240         19.4321     60          
1 1 1 22 0  11 o 11 332.349 3.21568 1958.65     53.5358  1958.65     53.5358  174.829    300         134.185     120         
1 1 1 22 0  12 o 19 52.5092 2.78468 49.6813     7.23076  49.6813     7.23076  46.9372    180         130.282     180         
1 1 1 22 0  13 o 6  19.0263 5.61888 9.0426      5.3604   9.0426      5.3604   56.3931    240         116.619     240         
1 1 1 22 0  14 f 0  127.142 2.19791 286.962     13.9853  286.962     13.9853  64.5372    120         0           0           
1 1 1 22 0  15 o 14 190.486 2.51282 643.684     23.9687  643.684     23.9687  163.924    180         126.808     180         
1 1 1 22 0  16 o 12 904.5   7.86979 14528.4     356.602  14528.4     356.602  589.353    240         133.186     60          
1 1 1 22 0  17 o 17 544.276 4.82959 5254.95     131.685  5254.95     131.685  297.286    120         194.13      300         
1 1 1 22 0  18 o 12 608.046 5.47929 6560.17     166.902  6560.17     166.902  460.07     360         39.8824     360         
1 1 1 22 0  19 o 10 652.865 5.83338 7564.18     190.787  7564.18     190.787  492.047    240         39.9184     240         
1 1 1 22 0  20 o 14 467.5   4.56588 3877.4      106.925  3877.4      106.925  501.172    300         326.972     300         
1 1 1 22 0  21 o 18 32.4751 4.83291 20.996      6.92435  20.996      6.92435  56.4022    180         127.965     180         
1 1 1 22 0  22 o 8  377.349 4.10382 2526.32     77.5641  2526.32     77.5641  253.871    240         36.1309     60          
1 1 1 22 0  23 o 15 141.742 2.61651 356.795     18.5572  356.795     18.5572  83.6621    120         33.6498     300         
1 1 1 22 0  24 o 16 149.45  2.55153 396.534     19.0847  396.534     19.0847  78.4311    360         56.9188     180         
1 1 1 22 0  25 f 0  308.438 3.26856 1687.49     50.4969  1687.49     50.4969  226.539    60          0           0           
1 1 1 22 0  26 o 1  323.962 3.34351 1861.64     54.256   1861.64     54.256   306.793    120         149.131     120         
1 1 1 22 0  27 o 1  346.646 3.54946 2131.62     61.6316  2131.62     61.6316  345.977    1.16272e-10 195.706     1.16272e-10 
1 1 1 22 0  28 o 1  377.328 3.5631  2525.49     67.3493  2525.49     67.3493  207.458    60          124.435     240         
1 1 1 22 0  29 o 16 87.7732 2.32775 137.113     10.2063  137.113     10.2063  39.2749    300         21.8        120         
1 1 1 22 0  30 o 7  309.738 3.15408 1701.73     48.9356  1701.73     48.9356  248.318    180         55.3159     180         
1 1 1 22 0  31 o 14 619.859 5.52634 6821.94     171.607  6821.94     171.607  421.324    60          39.0503     240         
1 1 1 22 0  32 o 18 622.607 5.82367 6884.69     181.635  6884.69     181.635  557.202    120         230.336     120         
1 1 1 22 0  33 o 17 314.458 3.4807  1754.53     54.8214  1754.53     54.8214  248.417    180         51.1227     180         
1 1 1 22 0  34 o 7  57.3455 3.26449 59.4266     9.23731  59.4266     9.23731  2.86922    60          66.1878     60          
1 1 1 22 0  35 o 9  361.033 3.9276  2313.3      71.0237  2313.3      71.0237  207.948    120         93.9121     300         
1 1 1 22 0  36 o 5  37.5969 4.28455 26.9414     7.44429  26.9414     7.44429  20.8677    180         62.2296     180         
1 1 1 22 0  37 o 8  52.7521 3.67312 50.7664     9.47888  50.7664     9.47888  0.0803439  240         21.1565     60          
1 1 1 22 0  38 o 15 305.656 3.66672 1658.28     56.1293  1658.28     56.1293  292.634    120         156.262     120         
1 1 1 22 0  39 o 10 592.405 5.71683 6235.94     169.649  6235.94     169.649  435.05     1.72666e-06 40.3929     1.72666e-06 
1 1 1 22 0  40 o 19 57.5305 3.2955  59.8344     9.3532   59.8344     9.3532   4.9096     240         19.7006     60          
1 1 1 22 0  41 o 10 21.4769 6.44715 11.6159     7.03564  11.6159     7.03564  11.6096    120         25.7027     120         
1 1 1 22 0  42 o 14 337.027 3.4434  2015.67     58.1311  2015.67     58.1311  279.427    180         89.982      180         
1 1 1 22 0  43 f 0  341.648 3.32289 2071.15     56.8683  2071.15     56.8683  128.181    60          0           0           
1 1 1 22 0  44 o 19 10.8684 4.88895 0.553099    5.83673  0.553099    5.83673  25.7486    120         52.8705     120         
1 1 1 22 0  45 o 3  419.755 4.13476 3128.59     86.9395  3128.59     86.9395  292.174    3.33347e-08 4.58185     3.33345e-08 
1 1 1 22 0  46 o 14 205.88  2.85926 752.492     29.4747  752.492     29.4747  154.535    60          25.4227     60          
1 1 1 22 0  47 o 1  259.979 2.9731  1199.67     38.7126  1199.67     38.7126  220.434    300         83.6054     300         
1 1 1 22 0  48 o 13 20.8263 6.25804 10.9398     6.62789  10.9398     6.62789  37.0595    360         86.8828     360         
1 1 1 22 0  49 o 1  55.7107 3.13969 56.1021     8.63375  56.1021     8.63375  1.98564    240         0.324891    240         
1 1 1 22 0  50 o 7  29.5344 5.76736 18.6457     7.38173  18.6457     7.38173  19.8495    120         64.0594     120         
1 1 1 22 0  51 o 8  256.977 3.232   1173.19     41.5926  1173.19     41.5926  199.413    180         49.4945     180         
1 1 1 22 0  52 o 16 79.3647 2.95433 112.703     11.6754  112.703     11.6754  59.3933    240         39.4935     240         
1 1 1 22 0  53 o 17 72.838  2.88307 95.0385     10.4479  95.0385     10.4479  34.2723    120         23.6735     120         
1 1 1 22 0  54 o 11 98.4236 2.67524 172.676     13.151   172.676     13.151   79.7635    1.15778e-06 27.1137     1.15778e-06 
1 1 1 22 0  55 o 2  55.0153 3.60417 55.1651     9.72999  55.1651     9.72999  30.9402    60          3.3102      240         
1 1 1 22 0  56 o 3  103.277 2.74233 190.185     14.1478  190.185     14.1478  46.6053    120         45.1223     300         
1 1 1 22 0  57 o 14 12.8598 5.52638 2.71463     6.64543  2.71463     6.64543  2.88759    180         6.36461     180         
1 1 1 22 0  58 o 9  108.446 2.67937 209.654     14.5212  209.654     14.5212  78.1712    240         12.0019     240         
1 1 1 22 0  59 o 2  10.2339 4.82819 -2.17063    6.75071  -2.17063    6.75071  4.62121    120         9.92039     120         
1 1 1 22 0  60 o 17 35.5632 4.86893 24.9433     7.74167  24.9433     7.74167  10.8694    180         16.7826     360         
1 1 1 22 0  61 o 10 55.2937 3.33285 55.6051     9.07487  55.6051     9.07487  30.4515    240         11.9063     60          
1 1 1 22 0  62 o 12 241.781 3.2029  1042.2      38.7777  1042.2      38.7777  158.679    300         0.21746     120.001     
1 1 1 22 0  63 o 19 82.3609 2.69629 121.441     11.0743  121.441     11.0743  38.5648    180         30.6769     360         
1 1 1 22 0  64 o 9  199.757 3.13926 712.32      31.391   712.32      31.391   144.011    240         27.4651     240         
1 1 1 22 0  65 o 14 18.9036 7.27641 9.32955     9.74861  9.32955     9.74861  2.15182    120         15.6468     120         
1 1 1 22 0  66 o 11 43.9965 5.55994 38.0349     11.0936  38.0349     11.0936  13.7007    180         10.4042     180         
1 1 1 22 0  67 o 3  69.6233 3.83924 88.3853     13.203   88.3853     13.203   59.62      240         29.4192     240         
1 1 1 22 0  68 o 3  78.518  3.0663  111.04      11.9808  111.04      11.9808  40.555     120         19.8224     300         
1 1 1 22 0  69 o 17 24.3258 6.75192 14.7716     7.88419  14.7716     7.88419  0.944401   8.7476e-06  31.2536     8.7476e-06  
1 1 1 22 0  70 o 1  27.8368 6.57437 18.0711     8.17337  18.0711     8.17337  15.9439    240         67.3637     240         
1 1 1 22 0  71 o 14 112.251 2.89397 225.981     16.2304  225.981     16.2304  61.3955    300         19.8504     120         
1 1 1 22 0  72 o 16 66.5586 3.3697  80.6495     11.1047  80.6495     11.1047  54.6074    8.47713e-07 24.97       8.47713e-07 
1 1 1 22 0  73 o 7  18.7189 6.64539 9.6274      7.65548  9.6274      7.65548  2.8361     240         11.1319     60          
1 1 1 22 0  74 o 2  21.4542 6.80843 12.3736     7.81437  12.3736     7.81437  7.33975    120         5.47043     300         
1 1 1 22 0  75 o 5  41.2332 6.13507 35.106      11.1609  35.106      11.1609  30.9757    360         10.6828     360         
1 1 1 22 0  76 o 7  26.3789 8.2542  19.1841     11.4861  19.1841     11.4861  12.8654    60          2.44498     60          
1 1 1 22 0  77 o 11 107.04  3.46159 208.131     18.48    208.131     18.48    78.4817    300         24.2407     300         
1 1 1 22 0  78 o 8  83.88   3.84987 129.252     16.0247  129.252     16.0247  50.1902    180         3.18054     360         
1 1 1 22 0  79 o 19 11.4995 5.5281  -4.35612    9.67197  -4.35612    9.67197  4.83041    60          14.4257     60          
1 1 1 22 0  80 o 19 33.032  7.96902 26.7129     11.8344  26.7129     11.8344  17.1849    120         5.58195     300         
1 1 1 22 0  81 o 9  13.7501 6.41597 -0.95638    11.3904  -0.95638    11.3904  1.36705    360         10.0307     360         
1 1 1 22 0  82 o 16 36.9018 8.622   33.5979     14.1661  33.5979     14.1661  15.5141    240         13.6954     60          
1 1 1 22 0  83 o 8  71.1463 5.00097 96.8396     17.3964  96.8396     17.3964  47.54      120         9.17325     120         
1 1 1 22 0  84 o 19 13.7832 6.50311 -1.63737    12.2502  -1.63737    12.2502  3.61005    180         14.8032     180         
1 1 1 22 0  85 o 12 16.5618 7.40906 4.94031     13.1924  4.94031     13.1924  0.267897   60          3.05693     60          
1 1 1 22 0  86 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 1  0  o 7  200.355 2.49577 712.009     25.0416  712.009     25.0416  198.108    180         120.98      180         
1 1 1 22 1  1  o 6  390.82  3.60019 2701.44     70.5113  2714.45     70.5124  271.972    159.456     15.9418     339.456     
1 1 1 22 1  2  o 17 814.347 6.61838 11789.8     270.097  11759.6     270.1    693.413    116.187     203.164     116.187     
1 1 1 22 1  3  o 16 381.483 3.61774 2570.62     69.1649  2589.66     69.1603  318.784    320.327     94.6205     320.327     
1 1 1 22 1  4  o 13 475.644 4.21771 4015.6      104.329  4008.33     96.5996  325.41     158.837     35.2575     338.837     
1 1 1 22 1  5  o 6  922.139 7.6774  15120.2     354.779  15100.4     354.8    758.964    122.658     176.308     122.658     
1 1 1 22 1  6  o 9  294.004 3.00192 1528.88     44.2242  1535.53     44.2348  152.177    274.439     113.05      94.4385     
1 1 1 22 1  7  o 13 71.0028 2.4102  83.8259     8.38495  95.4759     8.70739  10.3114    239.045     61.7963     239.045     
1 1 1 22 1  8  o 16 573.239 4.95608 5892.65     139.673  5766.92     144.959  352.116    320.904     125.911     140.904     
1 1 1 22 1  9  o 17 455.803 4.08342 3725.55     91.4957  3643.26     94.9727  325.706    157.292     4.35948     337.292     
1 1 1 22 1  10 o 8  215.863 2.53265 837.23      26.8505  814.63      27.916   132.384    48.9951     31.706      228.995     
1 1 1 22 1  11 o 16 295.831 3.13818 1573.34     44.6543  1529.74     48.2669  261.448    96.5652     111.112     96.5652     
1 1 1 22 1  12 o 15 229.056 2.91444 928.757     33.3878  931.37      33.5218  131.656    52.5906     55.1711     232.591     
1 1 1 22 1  13 o 3  330.899 3.44516 1955.67     59.4689  1927.17     54.7252  222.049    224.083     26.5663     44.0828     
1 1 1 22 1  14 o 9  207.253 2.58692 786.162     26.3374  736.979     27.3372  172.965    236.48      71.1928     236.48      
1 1 1 22 1  15 o 17 385.22  3.75197 2657.42     70.94    2605.95     73.8602  360.347    355.206     175.054     355.206     
1 1 1 22 1  16 f 0  200.421 2.97839 710.603     29.1858  713.648     30.6292  213.233    355.333     0           0           
1 1 1 22 1  17 o 3  643.884 6.27299 7419.64     202.434  7311.57     202.388  515.268    296.401     102.942     296.401     
1 1 1 22 1  18 o 15 318.42  3.72249 1815.8      60.9995  1780.74     57.7861  259.787    110.842     71.8051     110.842     
1 1 1 22 1  19 o 7  121.471 2.53397 263.586     15.0932  259.992     15.7126  28.638     20.1539     97.2018     200.154     
1 1 1 22 1  20 o 3  760.229 7.15146 10294.7     265.899  10266.5     278.843  649.19     169.167     204.873     169.167     
1 1 1 22 1  21 o 1  517.939 5.00756 4798.37     123.898  4727.02     135.691  353.28     138.249     35.0649     318.249     
1 1 1 22 1  22 o 14 229.381 2.75359 925.868     31.0359  939.819     32.2663  153.205    23.2145     9.1177      203.215     
1 1 1 22 1  23 o 5  558.635 4.98172 5581.48     136.641  5500.92     142.189  439.685    147.421     81.3473     147.421     
1 1 1 22 1  24 o 17 411.501 3.82882 2996.14     75.8803  3012.16     81.9348  308.152    255.447     32.5883     255.447     
1 1 1 22 1  25 o 13 152.032 2.3896  406.59      17.5214  412.91      18.8755  66.0563    282.47      70.0802     102.47      
1 1 1 22 1  26 o 7  343.931 3.5835  2089.63     63.086   2107.11     60.4018  313.542    190.298     145.449     190.298     
1 1 1 22 1  27 o 5  439.433 4.11717 3422.38     88.851   3431.6      92.4526  320.055    235.335     16.4998     235.335     
1 1 1 22 1  28 o 12 90.9521 2.445   148.329     10.7291  145.414     11.4967  40.8305    296.375     0.378819    116.375     
1 1 1 22 1  29 f 0  172.092 2.57097 527.5       21.2776  522.688     23.0247  113.45     94.1029     0           0           
1 1 1 22 1  30 o 9  111.4   2.48181 201.004     13.5548  240.365     14.0792  76.5124    223.382     44.4542     223.382     
1 1 1 22 1  31 o 14 225.714 2.82412 894.111     31.294   912.927     32.5937  147.964    286.853     17.2123     106.853     
1 1 1 22 1  32 o 6  341.162 3.73162 2058.84     65.2912  2072.35     62.2615  348.03     276.436     221.981     276.436     
1 1 1 22 1  33 o 6  216.506 3.01509 833.105     33.5384  829.788     31.8709  151.485    350.41      5.14074     350.41      
1 1 1 22 1  34 o 8  89.1942 3.08584 138.089     12.8826  144.88      14.601   42.4737    297.082     13.3238     117.082     
1 1 1 22 1  35 o 6  355.875 3.76565 2277.26     67.1504  2219.09     67.1569  220.236    297.932     57.5802     117.932     
1 1 1 22 1  36 o 8  287.346 3.279   1450.91     47.2041  1479.29     47.2287  213.25     98.0108     28.4842     98.0108     
1 1 1 22 1  37 o 18 124.902 2.7404  272.765     17.6327  281.201     16.5972  87.2278    91.8236     19.5271     91.8236     
1 1 1 22 1  38 o 5  161.322 2.63085 452.389     20.7349  470.836     21.8048  138.36     327.274     70.1328     327.274     
1 1 1 22 1  39 o 12 270.399 3.03428 1316.84     41.1174  1277.79     41.1097  240.631    204.312     112.398     204.312     
1 1 1 22 1  40 o 11 124.46  2.52294 268.001     15.3168  281.99      16.1255  11.247     161.212     143.243     341.212     
1 1 1 22 1  41 o 13 78.5626 2.69592 111.712     10.2907  107.784     10.8533  19.6714    143.625     51.0352     323.625     
1 1 1 22 1  42 o 13 171.328 2.6968  511.901     22.5314  529.594     23.7771  91.1755    309.048     47.6869     129.048     
1 1 1 22 1  43 o 13 189.608 2.62007 632.596     23.7716  642.921     25.9876  141.837    222.552     30.4667     222.552     
1 1 1 22 1  44 o 3  248.764 3.04077 1055.44     37.7985  1142.13     37.98    167.841    31.019      2.82369     211.019     
1 1 1 22 1  45 o 10 68.1208 3.0445  78.6031     9.18597  86.9032     11.4608  20.87      7.8764      31.1813     187.876     
1 1 1 22 1  46 o 13 177.484 2.60702 554.15      23.1633  563.835     23.2118  103.292    188.304     31.8292     8.30383     
1 1 1 22 1  47 f 0  173.17  2.57831 535.26      22.2675  529.131     22.4808  98.1271    144.21      0           0           
1 1 1 22 1  48 o 5  58.9183 3.14648 62.8139     9.21176  61.2254     9.23023  22.1918    61.386      1.57697     61.386      
1 1 1 22 1  49 o 9  44.0428 3.89789 41.3078     8.17198  29.3314     8.37852  5.64147    301.57      18.949      121.57      
1 1 1 22 1  50 o 10 120.431 2.62388 265.588     15.7311  250.139     15.8868  70.9535    53.0478     15.2479     233.048     
1 1 1 22 1  51 o 5  148.805 2.68838 389.963     19.627   397.292     20.434   86.1543    19.0313     24.9214     199.031     
1 1 1 22 1  52 o 8  130.819 2.6817  290.783     17.0568  318.244     18.0723  102.776    141.11      36.3516     141.11      
1 1 1 22 1  53 o 7  142.17  2.53498 361.691     17.9907  356.871     18.1147  98.7879    161.318     11.046      161.318     
1 1 1 22 1  54 o 6  71.7641 2.92216 89.3973     10.1278  94.523      10.8036  34.3218    346.278     18.9422     166.278     
1 1 1 22 1  55 o 14 57.108  3.27288 57.5254     8.84581  59.4972     9.71812  19.2766    277.184     27.9751     97.1844     
1 1 1 22 1  56 o 8  88.8517 2.73989 144.404     11.6595  137.244     12.6298  49.9555    283.162     11.9641     103.162     
1 1 1 22 1  57 o 14 133.656 2.65119 311.834     17.4547  324.831     18.0274  86.8154    161.126     0.0441849   341.125     
1 1 1 22 1  58 o 2  111.916 2.6922  220.976     14.9523  225.781     15.2028  90.9976    33.1776     40.5311     33.1776     
1 1 1 22 1  59 o 19 136.158 2.98829 322.395     17.9208  340.074     22.6432  79.2905    326.737     19.1584     146.737     
1 1 1 22 1  60 o 12 108.215 2.68149 204.843     14.7124  213.338     14.3107  61.9368    357.497     16.5193     177.497     
1 1 1 22 1  61 o 18 47.7392 3.66649 39.3772     8.54359  43.4225     8.70744  8.96726    265.551     41.143      85.551      
1 1 1 22 1  62 o 9  132.604 2.67437 303.544     17.6089  325.124     17.8918  97.4467    84.3656     22.9797     84.3656     
1 1 1 22 1  63 o 11 151.703 2.78157 418.78      21.6742  404.943     20.5832  85.2407    32.2474     26.7321     212.247     
1 1 1 22 1  64 o 16 167.46  2.74471 503.249     24.148   500.404     21.8675  126.969    123.019     37.1283     123.019     
1 1 1 22 1  65 o 1  100.524 2.74207 197.772     15.5694  165.424     12.0074  63.0692    100.861     2.27292     280.861     
1 1 1 22 1  66 o 8  159.178 2.92626 460.895     24.9411  448.992     21.6371  118.723    24.6403     32.825      24.6403     
1 1 1 22 1  67 o 5  152.562 2.87811 408.568     23.0056  427.512     20.8634  114.044    62.6606     32.7806     62.6606     
1 1 1 22 1  68 o 13 45.4315 4.46014 33.8216     10.1965  43.2756     9.24565  26.3402    230.997     0.450692    50.9962     
1 1 1 22 1  69 o 2  38.823  5.0229  31.4426     8.78279  25.9404     9.91622  23.6959    341.291     5.16897     341.291     
1 1 1 22 1  70 o 11 64.1433 3.63927 76.4417     10.7347  73.9433     12.3618  34.3135    232.211     10.8474     52.2115     
1 1 1 22 1  71 o 3  20.9858 5.53133 9.50486     7.38307  2.36796     8.90715  2.23792    66.4246     15.3009     246.425     
1 1 1 22 1  72 o 17 42.2106 4.45126 31.8859     9.0275   35.4718     9.21719  19.6217    13.7076     11.0946     193.708     
1 1 1 22 1  73 o 12 51.5216 4.00671 52.5279     9.93839  46.569      10.3353  31.8647    163.8       1.69093     163.8       
1 1 1 22 1  74 o 11 37.3516 5.03308 26.4492     8.9324   27.9555     9.22333  13.5626    208.063     16.6867     28.0626     
1 1 1 22 1  75 o 16 68.2588 4.12432 89.8517     13.9407  84.9041     13.993   43.9101    140.956     4.71712     140.956     
1 1 1 22 1  76 o 4  35.1165 6.29885 26.5726     11.0704  24.3508     11.1446  12.7708    323.029     14.2437     143.029     
1 1 1 22 1  77 o 7  72.4888 4.14334 100.7       14.8479  97.1455     14.9906  48.7549    26.7669     10.1776     26.7669     
1 1 1 22 1  78 o 12 75.9424 4.00934 106.393     15.2932  110.16      14.9912  47.2042    345.84      2.91377     345.84      
1 1 1 22 1  79 o 16 44.7638 5.67262 33.3946     12.1254  47.484      12.2359  31.6298    242.323     13.9235     242.323     
1 1 1 22 1  80 o 19 26.1163 6.6761  12.2544     11.0618  13.7321     11.3751  10.9746    315.375     2.34021     135.375     
1 1 1 22 1  81 o 16 89.1221 4.10979 153.022     18.4825  147.069     18.0289  60.3723    37.6162     13.7208     37.6162     
1 1 1 22 1  82 o 19 39.3167 7.55581 32.5797     14.2656  37.4744     16.2892  21.0295    27.9085     1.35701     207.908     
1 1 1 22 1  83 o 5  44.5952 7.43681 39.1496     15.2412  51.8057     17.5326  26.3708    231.421     3.48844     231.421     
1 1 1 22 1  84 o 11 34.6052 7.85879 20.0724     15.917   38.0652     16.1903  17.9525    141.38      3.79874     141.38      
1 1 1 22 1  85 o 8  54.3051 9.0706  77.0584     25.5064  76.6671     23.1085  38.3912    335.767     19.3283     335.767     
1 1 1 22 1  86 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 2  0  o 13 771.727 6.30396 10567.9     243.729  10567.9     243.729  553.193    6.04266e-06 22.7432     180         
1 1 1 22 2  1  o 7  406.117 3.75563 2916.91     77.8409  2932.13     74.9954  304.043    82.497      24.3452     82.497      
1 1 1 22 2  2  o 11 514.102 4.53717 4672.8      114.719  4703.66     119.044  311.649    52.1974     122.127     232.197     
1 1 1 22 2  3  o 12 330.812 3.3447  1947.85     55.4535  1932.58     55.4452  261.355    158.451     52.748      158.45      
1 1 1 22 2  4  o 2  449.947 3.86743 3576.58     87.2011  3603.59     87.2094  294.454    348.933     61.0886     168.933     
1 1 1 22 2  5  o 17 512.156 4.58253 4669.25     117.611  4636.87     117.621  413.607    320.255     87.0476     320.255     
1 1 1 22 2  6  o 19 252.838 2.80138 1136.29     36.837   1130.05     34.1089  168.265    183.087     17.8404     3.08718     
1 1 1 22 2  7  f 0  273.065 2.87754 1320.22     40.1051  1323.34     38.6345  181.978    130.653     0           0           
1 1 1 22 2  8  o 9  401.546 3.812   2845.07     73.7069  2873.61     79.6257  352.249    92.397      130.188     92.397      
1 1 1 22 2  9  o 13 381.13  3.49539 2613.5      66.7564  2538.05     66.7568  248.314    29.1558     50.9667     209.156     
1 1 1 22 2  10 o 18 198.934 2.53157 713.642     24.7402  689.399     25.7047  114.34     3.02439     44.9323     183.024     
1 1 1 22 2  11 o 12 174.189 2.47513 534.34      21.5837  541.292     21.6284  80.5753    162.036     75.8854     342.036     
1 1 1 22 2  12 o 11 207.892 2.68668 762.655     27.9758  769.589     28.0054  78.7485    349.1       133.18      169.1       
1 1 1 22 2  13 o 4  142.729 2.40714 367.749     17.5916  354.488     16.8451  97.8786    32.1195     42.8973     32.1195     
1 1 1 22 2  14 o 13 139.86  2.59064 346.208     18.5287  347.755     17.7451  75.2488    255.765     25.8711     75.7646     
1 1 1 22 2  15 o 15 271.796 3.31391 1317.07     44.028   1302.79     46.209   145.25     104.358     94.0727     284.358     
1 1 1 22 2  16 f 0  248.169 3.28473 1069.35     39.7887  1115.08     41.9177  87.3053    277.437     0           0           
1 1 1 22 2  17 o 12 266.836 3.25985 1280.18     41.2838  1245.1      45.7182  165.556    86.7045     44.1929     266.704     
1 1 1 22 2  18 o 5  110.13  2.44285 206.078     12.7824  224.54      14.1542  11.438     185.794     4.18387     185.794     
1 1 1 22 2  19 o 3  219.296 2.78737 869.865     30.5896  835.552     30.6651  124.322    220.096     55.1081     40.0961     
1 1 1 22 2  20 o 10 306.994 3.2941  1681.87     48.5181  1660.91     52.724   242.548    93.0119     53.9063     93.0119     
1 1 1 22 2  21 o 13 260.501 2.89238 1205.29     36.9643  1201.2      38.5354  194.818    328.443     27.692      328.443     
1 1 1 22 2  22 o 18 334.659 3.4249  2017.29     56.23    1955.83     58.5781  303.29     79.7075     137.202     79.7075     
1 1 1 22 2  23 o 9  512.217 4.83112 4670.67     121.248  4646.53     126.7    400.19     11.6402     68.2234     11.6402     
1 1 1 22 2  24 o 17 142.074 2.503   369.779     17.436   346.355     18.1446  95.6196    296.068     11.9469     296.068     
1 1 1 22 2  25 o 14 192.314 2.72318 657.276     24.4946  654.264     27.8783  133.593    230.84      5.08881     230.84      
1 1 1 22 2  26 o 7  537.758 5.2038  5156.42     126.807  5118.98     152.393  392.732    33.5001     17.6594     33.5        
1 1 1 22 2  27 o 11 94.5403 2.47571 165.598     11.4872  151.909     11.893   27.6722    105.651     62.2176     285.651     
1 1 1 22 2  28 o 11 396.486 4.15179 2753.93     84.3966  2827.34     80.4829  269.66     56.6894     23.7893     236.689     
1 1 1 22 2  29 o 12 198.188 2.77731 697.35      26.9766  695.735     28.1776  136.037    336.634     1.36662     156.634     
1 1 1 22 2  30 f 0  246.469 3.15581 1050.73     38.0596  1104.74     39.9051  108.916    116.636     0           0           
1 1 1 22 2  31 o 12 211.677 2.93527 775.253     30.4124  814.422     31.8669  166.457    342.975     42.298      342.975     
1 1 1 22 2  32 o 2  150.752 2.50772 403.023     18.5683  402.939     19.315   99.768     301.912     1.14083     121.912     
1 1 1 22 2  33 o 13 197.373 2.91247 693.848     28.8758  688.13      28.7398  113.744    144.124     44.0906     324.125     
1 1 1 22 2  34 o 1  151.176 2.58184 411.002     18.1463  399.897     20.8224  91.0689    178.988     19.6371     358.988     
1 1 1 22 2  35 o 1  183.301 2.5677  578.643     22.1746  613.325     24.9822  167.782    341.339     95.3025     341.339     
1 1 1 22 2  36 o 1  314.328 3.34187 1738.67     50.4442  1768.11     54.7836  215.033    244.725     7.73307     64.7249     
1 1 1 22 2  37 o 6  89.0973 2.5227  136.968     10.9564  145.107     11.5281  16.2295    47.1344     78.3801     227.134     
1 1 1 22 2  38 o 12 100.477 2.36666 181.703     11.1326  176.763     12.5995  55.4328    162.605     8.01965     342.605     
1 1 1 22 2  39 o 9  214.802 2.61771 799.688     27.1026  837.295     29.252   146.877    119.662     1.05856     119.662     
1 1 1 22 2  40 o 16 128.389 2.46241 295.769     15.8134  289.364     15.8423  96.8074    173.892     34.4502     173.892     
1 1 1 22 2  41 o 17 35.7548 4.25018 23.2604     7.47842  23.411      7.20997  11.2318    282.231     34.8083     282.231     
1 1 1 22 2  42 o 7  41.6718 3.85348 31.1559     7.98643  31.5861     7.71752  14.836     333.101     58.5118     333.101     
1 1 1 22 2  43 o 10 188.733 2.67252 621.822     25.83    642.222     24.688   147.87     12.1416     43.445      12.1416     
1 1 1 22 2  44 o 17 70.798  3.05816 84.3586     10.3772  94.4065     11.2252  11.6609    136.849     4.06048     136.849     
1 1 1 22 2  45 o 8  244.637 2.94608 1055.14     35.2681  1069.86     36.959   145.202    200.394     43.6212     20.3942     
1 1 1 22 2  46 o 11 183.044 2.7149  570.717     23.6452  619.234     26.1705  115.973    346.402     15.0454     166.402     
1 1 1 22 2  47 o 13 62.3294 3.26418 62.6667     9.35     76.4932     10.9173  14.7087    205.08      43.9803     25.0797     
1 1 1 22 2  48 o 11 230.415 3.22341 952.592     35.9895  934.728     38.3877  172.57     45.4884     33.3905     45.4884     
1 1 1 22 2  49 o 16 144.64  2.60554 369.383     18.6441  374.148     19.0974  96.4644    75.3948     1.31615     75.3947     
1 1 1 22 2  50 o 10 97.7574 2.91343 169.275     13.0805  171.026     15.3213  76.9769    284.206     35.0472     284.206     
1 1 1 22 2  51 o 17 29.7834 5.14944 21.0797     7.26006  11.7173     8.3436   7.77917    300.42      32.4228     300.42      
1 1 1 22 2  52 o 4  145.879 2.82152 382.069     17.9638  375.113     22.9081  131.294    226.034     73.3841     226.034     
1 1 1 22 2  53 o 16 178.533 2.83621 568.44      22.0582  565.988     28.265   133.288    296.062     29.3951     296.062     
1 1 1 22 2  54 o 3  82.0904 2.95706 120.527     11.2889  120.061     12.9009  53.5739    17.6635     6.2373      17.6635     
1 1 1 22 2  55 o 9  48.2508 3.8329  39.1268     8.15761  45.2624     10.0581  17.8604    239.694     11.0761     59.6938     
1 1 1 22 2  56 o 13 76.5341 2.97939 107.374     10.3686  102.113     12.2578  52.2488    8.05677     13.5885     8.05677     
1 1 1 22 2  57 o 9  141.918 2.68783 364.952     17.3656  352.928     20.6373  108.079    39.2445     31.4173     39.2445     
1 1 1 22 2  58 o 19 133.469 2.94204 318.421     16.7841  317.852     22.1379  101.048    162.609     28.4475     162.609     
1 1 1 22 2  59 o 2  134.432 2.77864 319.808     16.4736  325.53      20.7123  94.5224    85.0696     13.2627     85.0696     
1 1 1 22 2  60 o 9  43.2388 4.27533 37.738      8.028    31.0634     9.63681  23.8439    315.047     1.09548     135.047     
1 1 1 22 2  61 o 10 26.8115 5.29484 14.8213     6.85653  11.9919     8.04885  4.25765    328.546     15.0316     148.546     
1 1 1 22 2  62 o 17 104.13  2.88785 203.886     15.9678  184.982     14.1194  59.6664    210.832     15.3684     30.8321     
1 1 1 22 2  63 o 15 29.7665 5.30176 17.8603     7.34684  15.8244     8.51393  6.61044    241.909     17.6686     61.9094     
1 1 1 22 2  64 o 16 119.51  2.59162 263.202     16.1871  248.327     14.8186  93.3749    356.841     33.1768     356.841     
1 1 1 22 2  65 o 19 81.981  3.09521 135.281     14.1467  107.772     11.2336  59.1974    209.055     15.028      209.055     
1 1 1 22 2  66 o 13 166.566 2.7713  518.961     25.5934  476.985     20.548   126.94     239.395     39.4037     239.395     
1 1 1 22 2  67 o 5  87.631  2.93952 144.458     13.9919  132.287     11.7304  44.757     231.654     21.7349     51.6539     
1 1 1 22 2  68 f 0  42.8685 4.8355  35.6772     10.2414  33.5903     9.8389   25.2442    187.691     0           0           
1 1 1 22 2  69 o 12 35.3822 5.50333 29.1385     9.70753  19.6627     9.3616   17.9882    137.287     3.38084     317.287     
1 1 1 22 2  70 o 16 48.9495 4.48154 50.2885     10.5267  39.7238     10.7535  24.876     125.37      9.82852     305.37      
1 1 1 22 2  71 o 8  21.636  5.55486 10.1231     7.45008  4.33798     8.57623  5.49532    122.06      6.50988     302.06      
1 1 1 22 2  72 o 15 37.2697 5.17618 24.9129     8.84543  29.2598     9.81165  23.4421    287.64      5.06048     287.64      
1 1 1 22 2  73 o 4  45.1642 4.88759 38.4268     9.45752  40.0283     11.8414  24.3291    294.178     5.2361      114.178     
1 1 1 22 2  74 o 18 43.791  5.80159 44.624      11.1029  32.1893     13.0804  20.6122    177.184     10.701      357.184     
1 1 1 22 2  75 o 11 45.2805 5.73281 33.0469     12.0511  49.5611     12.9042  26.0493    314.988     0.86573     134.988     
1 1 1 22 2  76 o 9  68.2086 4.09992 94.4315     13.7138  80.7924     13.945   44.9499    121.098     7.46501     121.098     
1 1 1 22 2  77 o 7  48.2068 5.23707 44.3892     12.1759  47.1105     12.3146  31.5265    181.865     7.96558     181.865     
1 1 1 22 2  78 o 14 53.3058 5.21852 57.5429     12.7193  53.9608     14.2554  38.5966    62.6508     15.733      62.6508     
1 1 1 22 2  79 o 18 48.7927 5.95636 46.8682     13.8564  49.4328     14.2207  38.9412    76.4153     24.1951     76.4153     
1 1 1 22 2  80 o 3  69.895  4.93597 96.1856     16.1461  93.4496     17.8619  40.0719    196.441     3.7098      16.441      
1 1 1 22 2  81 o 2  29.0124 7.22127 16.3036     12.3534  19.2571     13.7176  12.8413    194.786     3.5478      14.7858     
1 1 1 22 2  82 o 3  25.134  7.19937 16.8417     13.7217  -0.732816   16.5353  8.93036    340.059     2.87822     160.059     
1 1 1 22 2  83 o 1  13.7987 4.79441 -22.4287    10.8883  -15.5035    11.872   2.10273    28.2642     8.93354     28.2642     
1 1 1 22 2  84 o 9  25.0446 7.42725 10.1605     16.3557  11.2113     15.1137  5.32964    160.883     2.14862     340.883     
1 1 1 22 2  85 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 3  0  o 3  489.13  4.2816  4243.43     104.916  4243.43     104.916  324.772    180         66.7783     8.65195e-06 
1 1 1 22 3  1  o 17 142.056 2.35889 363.911     16.4471  351.496     17.1168  58.468     72.5479     69.8595     252.548     
1 1 1 22 3  2  o 7  507.99  4.48486 4652.88     116.302  4503.91     112.052  379.692    237.391     22.7637     237.391     
1 1 1 22 3  3  o 4  311.22  3.06967 1703.95     47.8671  1730.44     47.8831  250.032    46.1372     57.9515     46.1372     
1 1 1 22 3  4  o 9  288.193 2.99406 1468.13     42.4382  1476.74     44.0353  211.972    206.867     15.3038     206.867     
1 1 1 22 3  5  o 13 401.446 3.86657 2903.29     76.1865  2813.48     79.2952  227.302    293.713     125.606     113.713     
1 1 1 22 3  6  o 8  467.848 4.18064 3875.62     96.1829  3889.69     99.8264  407.508    268.713     140.162     268.713     
1 1 1 22 3  7  o 7  445.626 4.22694 3504.58     96.2487  3540.94     92.4859  415.228    304.61      190.146     304.61      
1 1 1 22 3  8  o 12 402.539 3.81032 2904.03     78.5408  2843.81     75.1817  283.325    210.118     13.1966     30.1185     
1 1 1 22 3  9  o 2  401.823 4.08111 2907.27     85.8805  2821.28     78.4098  272.181    246.14      34.4732     66.1399     
1 1 1 22 3  10 o 16 440.053 4.49377 3437.49     101.435  3434.47     96.7119  353.606    261.653     73.6149     261.653     
1 1 1 22 3  11 o 13 291.303 3.35939 1527.02     50.2151  1482.64     47.8667  207.38     305.866     1.96713     305.866     
1 1 1 22 3  12 o 7  268.672 3.42955 1288.87     47.4045  1271.35     44.9303  217.84     55.5854     59.9313     55.5854     
1 1 1 22 3  13 o 2  322.581 3.6591  1830.34     60.535   1860.94     57.7099  219.372    63.408      21.0167     243.408     
1 1 1 22 3  14 o 11 774.819 7.48019 10737.3     304.694  10630.7     275.608  525.754    97.2758     72.899      277.276     
1 1 1 22 3  15 o 10 600.59  5.5434  6414.17     170.437  6399.78     163.183  434.727    246.678     1.05693     246.679     
1 1 1 22 3  16 o 6  110.643 2.42716 211.998     13.4995  222.502     13.3748  34.0847    279.741     65.1112     99.7414     
1 1 1 22 3  17 o 11 220.283 2.89802 854.299     31.9764  866.479     32.0068  135.441    206.679     34.5525     26.6791     
1 1 1 22 3  18 o 8  87.248  2.42046 131.796     10.4056  138.546     10.7202  17.6845    147.965     43.3318     327.965     
1 1 1 22 3  19 o 14 398.846 3.82627 2868.19     74.8816  2776.67     77.979   260.246    57.3278     50.3652     237.328     
1 1 1 22 3  20 o 19 331.946 3.37194 1955.26     57.1876  1953.44     54.977   210.116    215.275     52.195      35.2753     
1 1 1 22 3  21 o 6  574.029 5.08958 5862.71     149.294  5842.2      143.481  422.337    179.567     19.306      179.567     
1 1 1 22 3  22 o 8  341.567 3.34058 2087.51     57.158   2051.28     57.202   301.015    258.667     119.062     258.667     
1 1 1 22 3  23 o 19 102.701 2.59379 200.452     12.6098  174.486     13.8773  36.4604    126.805     53.7755     306.806     
1 1 1 22 3  24 o 4  53.669  3.22158 48.4514     8.62553  54.5513     8.50589  10.4208    325.314     60.1425     325.314     
1 1 1 22 3  25 o 7  323.003 3.55254 1874.93     56.1097  1827.22     58.8257  234.624    36.7502     10.9576     36.7502     
1 1 1 22 3  26 o 5  443.976 4.61916 3485.62     97.522   3515.73     107.809  321.189    217.247     8.50643     217.246     
1 1 1 22 3  27 o 16 48.1808 3.44875 38.7317     7.84732  44.5838     8.58207  25.9958    251.168     98.9572     251.168     
1 1 1 22 3  28 o 13 224.269 2.99683 872.336     31.2211  912.07      36.0625  202.406    306.834     96.2527     306.834     
1 1 1 22 3  29 o 7  110.192 2.52604 209.812     12.9798  221.319     14.8606  71.1717    266.351     7.95513     266.351     
1 1 1 22 3  30 o 8  83.7009 2.5786  121.954     10.0665  127.007     11.4918  17.7398    358.718     66.6398     178.718     
1 1 1 22 3  31 o 8  179.212 2.67731 556.305     22.8926  583.015     25.1868  128.05     134.82      12.4091     134.82      
1 1 1 22 3  32 o 11 176.451 2.71127 533.416     22.8561  571.286     25.0969  76.834     81.741      89.3165     261.741     
1 1 1 22 3  33 o 9  257.404 2.99606 1176.06     35.3085  1174.72     41.7163  174.691    263.471     9.10055     83.4715     
1 1 1 22 3  34 o 19 274.289 3.21021 1343.38     41.9997  1326.56     46.1292  202.3      43.4389     22.9465     43.4389     
1 1 1 22 3  35 o 9  223.673 2.98012 900.171     32.6118  875.058     34.1527  188.444    247.596     71.5695     247.596     
1 1 1 22 3  36 o 15 129.83  2.4696  291.225     15.3598  307.168     16.7455  68.9846    249.344     32.2644     69.3435     
1 1 1 22 3  37 o 3  193.89  2.7696  639.177     26.281   695.154     27.5442  128.771    158.779     6.29885     338.779     
1 1 1 22 3  38 o 10 116.541 2.57105 234.499     13.9098  247.854     16.0584  68.4677    169.162     10.6575     349.162     
1 1 1 22 3  39 o 17 51.9854 3.23641 44.9844     7.99977  51.806      8.69405  13.7348    53.2878     78.4204     53.2878     
1 1 1 22 3  40 o 19 263.402 2.99402 1190.04     37.862   1273.06     41.1896  198.234    18.3824     34.3884     18.3824     
1 1 1 22 3  41 o 16 71.2495 2.86123 83.3694     9.74029  97.6529     10.6105  25.7907    41.1825     2.7868      221.183     
1 1 1 22 3  42 o 13 225.994 2.94762 915.628     32.699   897.363     34.0379  141.133    221.936     26.9097     41.9359     
1 1 1 22 3  43 o 6  79.3331 3.12849 105.415     11.8128  118.976     12.9737  18.7915    50.5857     60.5843     230.586     
1 1 1 22 3  44 o 6  230.871 2.88592 930.617     32.0146  962.002     34.7472  166.457    250.564     17.9064     250.564     
1 1 1 22 3  45 o 18 56.6863 3.35785 62.0888     9.14619  53.0791     9.6544   23.6819    240.06      117.875     240.06      
1 1 1 22 3  46 o 8  64.2076 3.07843 69.1781     9.4974   78.0991     10.1991  21.2643    208.941     32.7162     28.9407     
1 1 1 22 3  47 o 17 222.063 2.98851 889.447     31.6214  862.927     34.765   198.849    196.043     98.0421     196.043     
1 1 1 22 3  48 o 10 200.348 2.91887 715.856     26.8952  710.675     31.5155  158.693    284.223     47.5193     284.223     
1 1 1 22 3  49 o 14 110.834 2.81682 217.779     13.8925  219.379     17.1812  88.3404    153.676     36.1497     153.676     
1 1 1 22 3  50 o 11 66.8208 3.40542 77.2215     10.3527  82.6186     12.2718  39.839     311.547     17.6097     311.547     
1 1 1 22 3  51 o 4  83.2022 3.01686 131.816     11.8885  115.429     13.0348  14.3242    268.613     79.2687     88.6131     
1 1 1 22 3  52 o 18 96.7538 2.70018 163.985     12.6027  169.515     13.5268  58.8231    164.724     6.53329     344.724     
1 1 1 22 3  53 o 9  166.632 2.64377 489.812     20.9606  498.051     23.1555  134.619    188.727     48.6646     188.727     
1 1 1 22 3  54 f 0  77.7103 2.8338  104.431     10.4399  111.272     11.5558  33.3117    343.169     0           0           
1 1 1 22 3  55 o 8  22.67   5.35182 9.37165     6.63691  8.08227     7.70042  11.3861    185.661     34.109      185.661     
1 1 1 22 3  56 o 11 21.2018 5.26872 8.86914     6.53008  4.95342     7.62013  11.5934    316.262     33.719      316.262     
1 1 1 22 3  57 o 10 41.7199 4.18691 34.962      7.74803  28.9121     9.00124  4.59511    159.059     38.6364     339.059     
1 1 1 22 3  58 o 3  76.4031 3.02836 104.561     11.1105  104.618     11.9701  62.8669    193.777     31.7242     193.777     
1 1 1 22 3  59 o 8  27.7177 5.23385 12.1548     6.94577  16.8884     7.92597  5.38119    144.277     13.2325     324.277     
1 1 1 22 3  60 o 18 95.2156 2.69621 159.74      12.1413  164.578     13.5176  61.3275    107.295     0.64607     287.295     
1 1 1 22 3  61 f 0  142.99  2.51632 374.988     17.9439  355.367     18.0892  98.0326    338.101     0           0           
1 1 1 22 3  62 o 5  118.959 2.66219 247.912     16.169   258.742     15.5049  75.4904    316.36      3.59851     136.36      
1 1 1 22 3  63 o 5  60.3506 3.1513  58.2021     9.24291  73.8199     9.61655  37.5201    323.081     0.135435    323.08      
1 1 1 22 3  64 o 18 50.2584 3.71458 49.039      9.7824   43.3408     8.66179  37.1955    177.793     16.3667     177.793     
1 1 1 22 3  65 o 1  24.8044 5.55573 15.6309     8.90244  7.38482     6.81577  5.50175    93.3303     7.22468     273.33      
1 1 1 22 3  66 o 7  159.603 2.62676 472.354     22.5605  440.912     19.4288  117.76     69.7661     29.8102     69.7661     
1 1 1 22 3  67 o 11 46.136  3.84826 40.9198     9.30381  37.4821     8.14613  24.669     14.4939     5.98494     194.494     
1 1 1 22 3  68 o 13 70.6701 3.28875 87.4802     12.2832  93.8546     10.7513  47.0895    18.01       5.89027     18.01       
1 1 1 22 3  69 o 6  43.6141 4.66397 35.1936     11.0044  36.543      8.48264  23.0231    263.754     6.26484     83.7537     
1 1 1 22 3  70 o 19 116.208 3.24539 235.862     20.0913  255.005     17.3885  90.4528    300.627     33.9073     300.627     
1 1 1 22 3  71 o 11 38.0331 5.40118 21.5746     10.2422  35.5654     9.56187  20.0548    184.25      4.23827     4.24989     
1 1 1 22 3  72 o 16 20.2389 5.62126 2.60804     8.52381  7.71366     8.38979  2.35859    148.098     0.851563    328.098     
1 1 1 22 3  73 o 15 35.6293 5.79268 19.1103     10.7368  32.2281     9.82393  13.0051    54.4259     15.5395     234.426     
1 1 1 22 3  74 o 15 34.7225 6.05573 36.0485     11.5095  14.2048     10.4432  17.3943    91.083      4.01725     271.083     
1 1 1 22 3  75 o 14 43.4442 5.91327 32.2482     11.8293  44.4597     12.9962  23.7749    197.891     2.89971     17.8913     
1 1 1 22 3  76 o 9  65.9239 4.4479  85.1805     13.6887  80.3562     15.2129  41.8244    331.318     4.13172     331.318     
1 1 1 22 3  77 o 17 47.1093 5.83147 50.9016     12.3375  38.8474     13.8396  32.2926    22.0006     11.2711     22.0006     
1 1 1 22 3  78 o 7  51.5792 5.44051 55.4927     12.5924  49.8482     14.4099  38.4708    271.648     17.5891     271.648     
1 1 1 22 3  79 o 13 37.8477 6.81217 33.5251     12.8074  27.6305     13.1985  26.4169    280.878     14.5172     280.878     
1 1 1 22 3  80 o 13 23.6202 6.76163 13.4833     12.9992  1.25885     12.5777  7.55094    39.1764     6.4404      219.176     
1 1 1 22 3  81 o 2  28.6509 7.38926 20.1335     13.7582  14.424      14.0137  10.3842    184.172     8.92648     4.17244     
1 1 1 22 3  82 o 6  22.5724 6.92934 8.78372     14.8276  -0.536217   14.5835  5.04067    59.4473     7.42892     239.447     
1 1 1 22 3  83 o 11 27.4183 7.44423 8.62548     16.54    21.4993     13.7484  7.7102     31.0582     0.871837    31.0581     
1 1 1 22 3  84 f 0  25.3576 8.09788 -33.9841    40.5095  13.6745     15.5087  4.68048    101.519     0           0           
1 1 1 22 3  85 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 4  0  o 11 334.526 3.47612 1984.95     58.2471  1984.95     58.2471  285.811    1.80315e-05 81.2256     1.80315e-05 
1 1 1 22 4  1  o 15 148.939 2.57569 395.018     19.237   391.446     19.2125  3.24334    329.307     212.468     329.307     
1 1 1 22 4  2  o 15 172.936 2.61876 530.123     23.1812  530.197     22.1994  106.708    16.7721     19.2339     196.772     
1 1 1 22 4  3  o 7  380.573 3.87587 2597.78     75.5377  2540.5      72.2979  296.48     235.445     45.2703     235.445     
1 1 1 22 4  4  o 1  334.192 3.6027  1984.42     60.3311  1977.07     60.343   237.362    55.7857     4.50715     235.786     
1 1 1 22 4  5  o 17 444.591 4.46971 3486.51     101.89   3528.42     97.1963  376.883    78.567      111.984     78.567      
1 1 1 22 4  6  o 9  336.456 4.11058 2010.74     73.062   2005.88     65.3503  251.308    95.5102     20.8255     95.5102     
1 1 1 22 4  7  o 1  220.856 3.10154 867.704     33.4051  862.066     35.2205  148.891    239.008     9.43155     59.0079     
1 1 1 22 4  8  o 4  352.366 3.92861 2190.15     69.379   2215.02     69.3662  275.631    88.9019     46.5676     88.9019     
1 1 1 22 4  9  o 5  121.803 2.5939  272.149     15.3788  254.487     16.1994  24.2793    289.469     13.0009     289.469     
1 1 1 22 4  10 o 11 130.171 2.65913 307.315     17.343   294.05      17.3081  70.5321    337.247     18.4488     157.247     
1 1 1 22 4  11 o 12 423.505 4.27495 3214.63     94.8124  3150.85     86.5336  283.619    52.8677     43.992      232.868     
1 1 1 22 4  12 o 1  311.096 3.3414  1730.26     50.9491  1702.56     53.193   236.81     343.655     31.4133     343.655     
1 1 1 22 4  13 o 5  417.06  3.90618 3077.78     81.6307  3094.03     81.6521  329.859    334.386     60.2529     334.386     
1 1 1 22 4  14 o 2  65.97   2.61514 79.9137     8.75257  74.9222     8.46969  3.93797    111.748     42.0085     111.748     
1 1 1 22 4  15 o 5  265.78  3.01745 1248.33     40.1674  1256.88     40.2132  214.115    110.808     56.2629     110.808     
1 1 1 22 4  16 o 16 236.52  2.85778 1014.93     34.6431  969.167     33.1082  135.613    258.993     61.3983     78.9927     
1 1 1 22 4  17 o 12 487.42  4.57117 4263.89     116.257  4171.53     106.957  379.055    299.513     55.9744     299.513     
1 1 1 22 4  18 o 9  326.345 3.30242 1894.81     52.8859  1883.09     55.1029  201.727    270.078     62.9032     90.0779     
1 1 1 22 4  19 o 18 154.755 2.46215 424.954     19.0842  424.206     19.1057  107.412    214.009     11.3809     214.009     
1 1 1 22 4  20 f 0  116.528 2.43833 236.129     14.4729  245.798     13.9542  90.769     79.0182     0           0           
1 1 1 22 4  21 o 8  451.117 4.39064 3566.62     97.0959  3659.29     101.422  328.282    8.89581     8.54622     8.89586     
1 1 1 22 4  22 o 8  128.067 2.57901 265.661     15.7907  317.568     17.2802  59.2051    118.552     52.372      298.552     
1 1 1 22 4  23 o 8  140.085 2.6169  345.575     16.9899  350.616     19.6526  62.2499    125.348     66.622      305.348     
1 1 1 22 4  24 o 1  455.502 4.63895 3701.23     98.0025  3668.87     113.168  387.293    75.1441     122.46      75.1441     
1 1 1 22 4  25 o 9  196.55  2.92475 686.073     25.7292  684.244     31.5811  110.389    240.605     54.2007     60.6049     
1 1 1 22 4  26 o 2  65.2472 2.78295 74.3948     8.42443  77.1621     9.66673  0.721495   285.528     70.3949     105.528     
1 1 1 22 4  27 o 15 171.868 2.6171  522.875     21.3542  524.738     23.6724  150.89     78.2321     72.6219     78.2321     
1 1 1 22 4  28 o 14 37.1062 3.80376 25.472      6.4186   24.424      7.26251  81.8341    113.532     203.917     113.532     
1 1 1 22 4  29 o 13 155.431 2.4489  428.536     18.5883  428.228     19.5497  111.282    112.302     14.2519     112.302     
1 1 1 22 4  30 o 1  47.1859 3.18638 34.0087     7.14765  46.1878     7.66434  27.2743    221.003     99.321      221.003     
1 1 1 22 4  31 o 4  172.9   2.52098 509.079     21.6721  551.623     22.0008  126.395    1.55425     18.6602     1.55425     
1 1 1 22 4  32 o 17 81.0202 2.57919 116.298     10.2856  117.005     10.6035  20.434     198.582     55.0003     18.5823     
1 1 1 22 4  33 o 14 171.357 2.53366 509.848     20.7248  531.763     22.7778  156.141    44.1954     88.8377     44.1954     
1 1 1 22 4  34 o 4  280.358 3.07554 1392.2      43.0944  1397.06     43.3278  125.075    219.788     143.071     39.7883     
1 1 1 22 4  35 o 18 375.59  3.75511 2486.59     70.6787  2523.24     70.6785  291.98     335.556     57.1745     335.556     
1 1 1 22 4  36 o 2  66.8307 2.76092 82.3952     8.96763  76.6564     9.41317  11.2413    266.51      46.0814     86.5098     
1 1 1 22 4  37 o 7  81.0042 2.62567 111.63      10.353   121.748     10.9098  8.97262    192.54      120.933     192.54      
1 1 1 22 4  38 o 2  322.413 3.31694 1822.32     51.2899  1868.33     55.8497  268.447    357.959     89.2459     357.959     
1 1 1 22 4  39 o 6  155.459 2.46083 420.609     18.4194  436.794     19.9174  100.147    130.336     7.65948     310.336     
1 1 1 22 4  40 o 16 145.394 2.42977 360.055     16.9953  390.189     18.4199  91.2899    299.299     10.6644     119.299     
1 1 1 22 4  41 o 4  121.567 2.49447 248.724     14.8714  276.441     15.4844  98.0295    248.641     45.7571     248.641     
1 1 1 22 4  42 o 12 225.728 2.81731 887.531     30.5067  921.437     33.2177  151.181    14.317      7.25883     194.317     
1 1 1 22 4  43 o 5  307.994 3.38627 1579.37     48.7804  1794.96     55.8054  202.774    245.002     19.9693     65.002      
1 1 1 22 4  44 o 7  327.155 3.40497 1840.62     53.5142  1964.68     58.1454  266.466    57.1294     82.0137     57.1294     
1 1 1 22 4  45 o 14 210.964 2.89407 756.824     30.5241  824.834     30.6316  175.211    290.078     63.872      290.078     
1 1 1 22 4  46 o 1  100.78  2.77091 181.904     13.0638  179.44      14.8031  35.0401    129.56      62.7715     309.56      
1 1 1 22 4  47 o 16 24.0427 5.51408 8.00212     7.54698  11.9281     7.75927  12.3988    196.137     34.4116     196.137     
1 1 1 22 4  48 o 19 137.581 2.56841 333.461     16.6593  339.472     18.6849  92.8111    131.72      2.71595     131.72      
1 1 1 22 4  49 o 9  189.764 2.72083 640.914     25.2655  639.172     26.468   141.631    58.3856     27.6095     58.3856     
1 1 1 22 4  50 o 14 122.729 2.56054 273.497     14.982   262.423     16.412   64.5481    178.495     33.7084     358.495     
1 1 1 22 4  51 o 15 78.1699 2.83191 103.96      10.6043  114.165     11.515   40.1272    46.3053     18.1615     226.305     
1 1 1 22 4  52 o 15 79.4954 2.94483 105.508     10.8029  120.416     12.59    62.9139    206.278     37.3081     206.278     
1 1 1 22 4  53 o 1  96.8488 2.84392 175.226     12.7406  159.632     14.6236  65.3897    124.811     7.08311     124.811     
1 1 1 22 4  54 o 10 26.6499 5.39837 17.5074     6.96937  7.02014     9.31962  6.07619    229.27      25.8602     229.27      
1 1 1 22 4  55 o 2  75.6332 2.92229 96.3669     10.3303  108.425     11.7473  50.6774    354.177     9.09921     354.177     
1 1 1 22 4  56 o 5  42.2522 4.22189 37.3173     7.88957  28.3663     9.10013  11.7143    343.393     23.2422     163.393     
1 1 1 22 4  57 o 8  17.2237 4.93501 3.80271     6.30044  0.345453    7.13322  12.1149    66.2743     35.3892     66.2743     
1 1 1 22 4  58 o 9  105.436 2.78556 211.344     14.3995  186.517     14.9038  64.1869    103.542     9.90418     283.542     
1 1 1 22 4  59 o 4  74.393  3.00943 101.541     10.6436  97.1594     11.6491  43.9097    228.887     7.66415     48.8865     
1 1 1 22 4  60 o 19 103.428 2.7264  190.158     13.5478  192.808     14.6504  76.7377    277.547     19.2367     277.547     
1 1 1 22 4  61 o 17 109.37  2.74318 210.53      15.0808  218.086     14.9355  95.1221    126.738     49.1928     126.738     
1 1 1 22 4  62 o 17 66.932  3.23115 81.9654     11.6393  79.8645     9.84632  54.3331    182         26.2156     182         
1 1 1 22 4  63 o 10 30.4387 5.03914 17.3208     7.76213  18.0448     7.34225  6.04691    5.49575     21.7038     185.496     
1 1 1 22 4  64 o 2  48.8671 3.75041 45.2803     9.35997  42.2087     8.71754  28.3814    61.5094     2.35092     241.509     
1 1 1 22 4  65 o 9  81.6731 2.69141 107.466     11.0865  132.911     10.745   49.9949    110.84      4.04165     290.84      
1 1 1 22 4  66 o 10 65.5349 3.68511 85.2559     13.961   71.7886     9.96426  30.3819    261.195     21.8962     81.195      
1 1 1 22 4  67 o 3  40.7665 4.7204  31.5583     10.3176  31.1431     8.18491  6.33407    178.383     37.2951     358.383     
1 1 1 22 4  68 o 7  35.1878 5.27773 22.9872     10.0927  24.8207     7.90706  20.9952    256.311     3.43054     256.311     
1 1 1 22 4  69 o 16 35.1515 5.22949 23.1531     10.1147  24.7279     7.67294  13.2843    319.512     14.917      139.512     
1 1 1 22 4  70 o 5  24.7031 5.75694 16.1348     8.35233  5.16561     9.29529  9.82861    114.999     1.61785     294.999     
1 1 1 22 4  71 o 12 32.046  5.67695 14.3247     8.68301  27.2253     9.88074  15.7146    81.1132     4.47936     261.113     
1 1 1 22 4  72 o 1  75.0161 3.7954  114.141     14.5391  95.127      13.7743  53.4199    134.33      13.7776     134.33      
1 1 1 22 4  73 o 2  22.4589 6.43661 12.7072     13.3794  0.43898     9.34441  3.08342    272.661     16.2977     92.6613     
1 1 1 22 4  74 o 1  28.4387 6.76353 17.1343     12.4802  15.5852     10.3337  12.8948    322.749     3.07529     322.749     
1 1 1 22 4  75 o 10 21.734  6.19927 2.88695     10.0685  9.09406     10.9133  2.53444    279.673     1.31977     99.6727     
1 1 1 22 4  76 o 14 23.6813 6.45216 11.0926     10.3429  6.96935     11.5188  6.07741    239.403     7.52849     59.403      
1 1 1 22 4  77 o 19 41.9908 6.37342 41.6015     12.5602  31.7603     13.4926  24.9586    176.648     2.17011     176.648     
1 1 1 22 4  78 o 12 42.4984 6.55759 45.0092     13.4469  31.0654     13.8146  24.841     126.453     0.761337    126.453     
1 1 1 22 4  79 o 3  43.4654 7.6246  41.4943     18.1807  42.7359     14.9918  28.9154    70.4968     9.13696     70.4968     
1 1 1 22 4  80 o 9  41.8696 6.93523 17.4258     18.3183  59.0777     13.9549  14.5082    184.224     19.7479     4.22369     
1 1 1 22 4  81 o 12 26.4898 6.71133 -10.1373    16.4413  25.4145     12.4235  10.3458    16.6287     2.83585     196.629     
1 1 1 22 4  82 o 4  20.7605 6.55504 -2.60627    15.2612  3.54501     12.8733  0.363766   347.182     0.406136    167.182     
1 1 1 22 4  83 o 7  24.9646 7.02994 1.31254     14.6199  19.4295     13.622   3.80589    320.405     0.98935     140.405     
1 1 1 22 4  84 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 5  0  f 0  539.872 5.42398 5173.63     146.68   5173.63     146.68   343.96     180         0           0           
1 1 1 22 5  1  o 18 243.5   3.13004 1049.73     39.0785  1053.08     37.288   184.123    49.9769     26.8394     49.9769     
1 1 1 22 5  2  o 6  86.865  2.59974 135.499     11.7576  132.524     10.8148  15.8141    163.248     51.9792     343.248     
1 1 1 22 5  3  o 7  451.222 4.56757 3611.66     105.722  3615.88     100.785  359.446    93.1905     65.2582     93.1905     
1 1 1 22 5  4  o 12 29.2392 4.79535 9.55812     7.81546  21.7774     6.4191   32.1446    228.887     71.6009     228.887     
1 1 1 22 5  5  o 10 47.9214 3.19285 49.9557     7.45811  33.0997     7.42214  13.3537    276.009     39.9623     276.009     
1 1 1 22 5  6  o 5  274.241 3.1957  1350.79     43.9182  1316.76     43.9158  221.657    184.681     56.2351     184.681     
1 1 1 22 5  7  o 18 83.6174 2.50186 122.977     11.1508  125.371     9.70284  13.3323    23.7388     16.1371     203.739     
1 1 1 22 5  8  o 14 341.419 3.44653 2071.33     57.7881  2063.67     60.124   216.561    224.892     58.1535     44.8916     
1 1 1 22 5  9  o 11 188.798 2.48326 636.456     23.9313  627.36      23.0563  153.954    50.619      57.9642     50.619      
1 1 1 22 5  10 o 17 307.184 3.11625 1689.57     48.859   1657.26     47.0831  264.491    125.976     93.423      125.976     
1 1 1 22 5  11 o 12 423.66  3.98498 3172.68     87.7833  3196.89     81.278   304.632    195.826     2.88791     15.8257     
1 1 1 22 5  12 o 2  146.041 2.36105 383.104     17.2769  373.096     17.2804  101.483    170.761     18.6833     170.761     
1 1 1 22 5  13 o 14 327.056 3.23055 1914.33     53.9189  1879.91     51.9761  219.378    184.48      30.3316     4.47971     
1 1 1 22 5  14 o 3  97.9996 2.25045 174.447     11.2111  166.448     10.8651  41.9986    295.783     17.8479     115.783     
1 1 1 22 5  15 o 1  203.516 2.64193 755.894     27.45    713.135     26.4432  144.825    66.2442     7.47739     66.2442     
1 1 1 22 5  16 o 10 455.488 4.49816 3731.59     107.32   3635.35     97.9273  378.694    178.679     100.417     178.679     
1 1 1 22 5  17 o 9  480.07  4.78379 4130.66     117.833  4055.23     112.324  402.241    86.2974     111.688     86.2974     
1 1 1 22 5  18 o 5  276.086 3.28491 1352.09     46.5496  1351.99     44.3219  200.145    13.2032     7.41528     13.2032     
1 1 1 22 5  19 o 14 137.133 2.60981 341.717     17.582   325.734     18.2269  88.0012    247.162     6.07257     67.1615     
1 1 1 22 5  20 o 16 177.606 2.75903 564.932     24.5756  553.814     24.5369  112.851    187.272     21.2494     7.27234     
1 1 1 22 5  21 o 11 115.45  2.58257 238.097     15.373   235.051     14.4648  67.4069    268.105     15.5364     88.1054     
1 1 1 22 5  22 o 11 270.259 3.01931 1298.32     40.9171  1292.66     40.8686  187.687    230.408     9.13389     50.4078     
1 1 1 22 5  23 o 1  508.803 4.61094 4616.27     119.895  4580.57     115.216  426.547    276.153     121.669     276.153     
1 1 1 22 5  24 o 15 298.947 3.0999  1592.34     46.4139  1578.27     46.4674  252.294    109.805     80.6678     109.805     
1 1 1 22 5  25 o 10 399.105 3.76549 2837.85     73.7443  2816.55     76.837   259.467    90.5156     52.4109     270.516     
1 1 1 22 5  26 o 16 193.357 2.52396 659.885     24.3936  666.057     24.5205  140.877    130.297     14.0218     130.297     
1 1 1 22 5  27 o 3  288.552 3.03778 1495.51     43.8776  1458.71     43.9721  192.696    235.747     23.3538     55.7473     
1 1 1 22 5  28 o 3  327.64  3.20515 1923.58     52.5831  1885.79     52.6652  229.565    55.6345     5.63284     235.634     
1 1 1 22 5  29 o 19 149.264 2.34533 400.867     17.4405  389.287     17.6404  59.63      300.256     85.3775     120.256     
1 1 1 22 5  30 o 19 169.064 2.40909 500.01      19.9454  513.736     20.8758  66.0873    202.286     101.86      22.2855     
1 1 1 22 5  31 o 10 194.63  2.57444 667.75      25.5125  675.919     24.6959  151.828    155.492     37.1463     155.492     
1 1 1 22 5  32 o 18 91.4405 2.46872 146.23      10.8221  150.786     11.7548  39.6933    182.203     201.575     182.203     
1 1 1 22 5  33 f 0  286.57  3.1019  1446.32     42.522   1468.17     46.5104  176.154    276.821     0           0           
1 1 1 22 5  34 o 1  309.917 3.16158 1695.52     49.0357  1713.49     49.1702  215.509    89.1474     3.73778     269.147     
1 1 1 22 5  35 o 4  73.2072 2.69076 97.0444     9.29499  93.6197     10.3302  25.4056    231.345     2.83784     51.3453     
1 1 1 22 5  36 o 10 83.1965 2.52307 118.317     9.94178  127.765     11.05    19.373     172.854     63.8159     352.854     
1 1 1 22 5  37 o 3  94.2534 2.62456 149.196     12.1466  166.723     12.5905  54.2406    353.587     2.50318     173.587     
1 1 1 22 5  38 o 18 213.435 2.62259 794.623     26.1155  821.848     29.9162  113.57     152.605     67.7958     332.605     
1 1 1 22 5  39 o 3  91.0129 2.62883 146.086     11.0058  148.343     12.8638  54.5456    148.243     2.85349     148.243     
1 1 1 22 5  40 o 19 409.04  3.86678 2924.87     74.3946  3023.81     83.9837  332.085    172.314     93.7284     172.314     
1 1 1 22 5  41 o 13 130.829 2.52547 303.758     15.8355  304.137     17.2208  94.5189    158.995     16.6481     158.995     
1 1 1 22 5  42 o 13 27.7831 5.31169 14.5689     6.87864  13.7861     8.31316  7.69482    3.65774     23.1132     3.65774     
1 1 1 22 5  43 o 6  165.618 2.53181 470.103     20.1138  503.895     21.9181  88.6004    50.0749     48.8633     230.075     
1 1 1 22 5  44 o 16 158.288 2.60461 440.815     19.7957  448.896     21.505   80.5452    258.996     54.3281     78.996      
1 1 1 22 5  45 o 4  221.899 2.84277 827.454     30.9272  923.462     32.2862  176.686    109.733     50.3191     109.733     
1 1 1 22 5  46 o 11 142.76  2.67537 338.624     18.2425  386.779     20.018   89.9635    58.0172     11.8786     238.017     
1 1 1 22 5  47 o 2  229.024 2.92611 911.851     32.0601  953.462     35.0939  157.435    176.652     2.25394     176.652     
1 1 1 22 5  48 o 8  162.389 2.62234 450.079     20.9646  487.586     21.7142  124.61     350.19      31.2295     350.19      
1 1 1 22 5  49 o 12 193.111 2.9133  643.392     28.8245  683.877     27.4855  99.6547    287.377     62.8863     107.377     
1 1 1 22 5  50 o 9  267.188 3.02453 1205.99     40.3907  1337.99     40.5302  182.81     53.1111     2.20555     53.1115     
1 1 1 22 5  51 o 1  103.396 2.63414 195.17      13.4014  185.789     13.8312  71.9695    336.75      10.049      336.75      
1 1 1 22 5  52 o 19 51.1107 3.57325 51.8916     8.72801  42.5792     9.19401  23.6155    236.379     1.5244      236.379     
1 1 1 22 5  53 o 17 25.6788 5.31889 14.532      7.14797  9.4925      7.65353  2.08306    322.628     8.98973     322.628     
1 1 1 22 5  54 o 3  61.5788 3.3212  73.2434     9.98109  63.2213     10.2882  40.1984    163.299     11.9403     163.299     
1 1 1 22 5  55 o 9  63.4076 3.11955 74.645      9.66021  69.7053     10.0152  47.7572    77.0817     30.6855     77.0817     
1 1 1 22 5  56 o 5  73.7219 3.24276 98.9664     10.8624  96.214      12.8557  49.9353    358.633     6.01374     358.633     
1 1 1 22 5  57 o 11 86.6662 3.02668 139.974     12.6884  129.367     13.4606  68.3203    322.739     24.7877     322.739     
1 1 1 22 5  58 o 9  19.9334 5.37344 -0.0321309  6.74772  9.73799     8.69155  12.5462    115.925     44.7563     115.925     
1 1 1 22 5  59 o 7  151.978 2.58413 427.705     18.882   397.927     20.3591  116.646    117.041     32.769      117.041     
1 1 1 22 5  60 o 10 21.0044 5.23423 9.91474     6.6621   3.322       7.6361   10.3339    347.726     42.2734     347.726     
1 1 1 22 5  61 o 1  72.9073 2.9267  99.0438     10.3207  92.2837     10.9341  53.6135    329.923     14.7962     329.923     
1 1 1 22 5  62 o 4  22.323  5.50706 5.68722     8.17701  10.5285     7.2959   2.1792     26.7906     25.8976     26.7906     
1 1 1 22 5  63 o 14 22.1895 5.44241 9.28909     7.42076  7.50386     7.38627  2.73465    301.046     6.84256     121.046     
1 1 1 22 5  64 f 0  18.6088 5.44379 -0.698554   9.57145  4.2079      7.32786  15.5353    112.882     0           0           
1 1 1 22 5  65 o 18 63.641  3.41432 85.632      11.8446  62.5519     9.79475  38.103     203.414     3.74581     23.4144     
1 1 1 22 5  66 o 18 65.6988 3.84352 74.2077     13.9191  84.0682     10.6059  40.4928    56.5675     1.65742     236.568     
1 1 1 22 5  67 o 9  57.4902 3.74715 62.7645     10.4993  58.6792     10.8219  26.2589    302.412     19.7077     122.412     
1 1 1 22 5  68 o 17 49.8908 3.88184 47.1952     9.82463  45.0055     9.26671  29.6529    223.295     2.06253     43.2948     
1 1 1 22 5  69 o 3  95.1023 2.8102  166.075     13.6705  161.323     13.0567  64.613     93.5799     8.43965     93.5799     
1 1 1 22 5  70 o 7  19.8673 5.37648 7.29772     7.57823  4.02432     7.47428  4.41343    219.709     4.94634     39.7088     
1 1 1 22 5  71 o 3  28.1556 6.06411 15.1209     9.18765  16.6712     9.47148  12.2641    271.878     5.23426     91.8779     
1 1 1 22 5  72 o 13 19.9083 5.75086 8.10064     9.7233   -0.688515   8.88419  3.79873    48.6816     4.55599     228.682     
1 1 1 22 5  73 o 3  51.4701 4.86783 44.1355     11.9519  58.8297     12.3344  34.1723    93.8704     6.77563     93.8704     
1 1 1 22 5  74 o 18 36.2969 6.05982 36.1911     11.1596  18.6888     11.0749  21.5315    105.927     4.06656     105.927     
1 1 1 22 5  75 o 18 24.6301 6.67247 12.4624     11.4407  8.14421     11.7549  3.0806     209.421     32.9254     209.421     
1 1 1 22 5  76 o 6  31.4314 7.27305 22.2532     13.897   19.9706     12.4994  14.9114    297.466     2.88905     117.466     
1 1 1 22 5  77 o 19 24.4232 6.69592 5.99786     12.8136  12.7653     11.1132  8.29166    326.514     7.07643     146.514     
1 1 1 22 5  78 o 3  29.4977 7.43099 22.2168     15.5719  14.6831     12.1015  10.6846    273.213     10.549      93.2134     
1 1 1 22 5  79 o 6  34.8166 7.65667 38.6469     17.0825  17.8126     13.0902  21.344     254.299     6.88284     254.299     
1 1 1 22 5  80 o 1  25.7446 7.24687 16.7288     15.5795  8.1353      12.4705  8.07325    331.467     8.75808     151.467     
1 1 1 22 5  81 o 16 35.525  7.2276  35.1367     13.9505  24.0198     13.5373  16.7591    272.219     4.35019     92.2194     
1 1 1 22 5  82 o 12 24.1248 6.74441 17.7204     12.2005  -0.19633    14.1251  5.40325    332.403     4.07663     152.403     
1 1 1 22 5  83 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 6  0  o 14 338.423 3.99047 2032.44     67.635   2032.44     67.635   320.95     4.91688e-06 144.697     4.91688e-06 
1 1 1 22 6  1  o 14 242.544 3.24263 1027.18     38.4056  1059.61     40.4205  187.547    294.038     33.6891     294.038     
1 1 1 22 6  2  o 9  277.899 3.33262 1347.51     45.3421  1392.16     47.4837  144.467    342.721     110.431     162.721     
1 1 1 22 6  3  o 12 255.397 3.24155 1142.18     39.4322  1171.59     43.492   161.362    257.853     41.2762     77.8534     
1 1 1 22 6  4  o 6  411.53  3.94626 3025.93     77.9282  2984.26     84.6537  326.784    347.102     57.4538     347.102     
1 1 1 22 6  5  o 17 64.9171 2.66036 76.944      8.26136  73.0187     8.937    13.6665    164.72      86.3757     164.72      
1 1 1 22 6  6  o 19 75.1523 2.45001 99.5999     9.1011   101.08      9.30364  14.3793    22.1334     114.038     22.1334     
1 1 1 22 6  7  o 6  247.294 2.8293  1096.41     35.0448  1072.39     35.0783  171.915    292.969     7.10442     112.969     
1 1 1 22 6  8  o 8  41.27   3.25037 29.831      6.31626  31.3411     6.89865  53.5918    335.839     139.505     335.839     
1 1 1 22 6  9  o 9  127.85  2.34902 289.339     14.7245  290.59      15.3456  69.3015    352.056     26.415      172.056     
1 1 1 22 6  10 o 18 366.782 3.65646 2391.84     65.8334  2381.64     68.5515  298.733    314.994     68.5633     314.994     
1 1 1 22 6  11 o 6  185.995 2.66564 617.524     24.8289  609.24      24.8627  166.036    21.0605     83.5056     21.0605     
1 1 1 22 6  12 o 15 292.061 3.47787 1531.64     52.096   1494.86     49.7064  192.301    118.248     34.7903     298.248     
1 1 1 22 6  13 o 2  62.7822 3.04883 70.2117     9.32506  70.2538     9.73869  44.2201    108.149     164.07      108.149     
1 1 1 22 6  14 o 2  337.309 3.86539 2000.64     65.3538  2037.57     65.3229  326.69     58.2674     171.145     58.2673     
1 1 1 22 6  15 o 5  327.249 3.62768 1948.35     59.5128  1852.5      59.4468  271.565    24.101      73.1995     24.101      
1 1 1 22 6  16 o 2  565.676 5.61154 5710.35     159.089  5667.79     159.065  440.249    32.4622     59.1308     32.4622     
1 1 1 22 6  17 o 13 353.831 3.98417 2225.64     74.1118  2218.7      67.0134  222.7      268.764     65.5786     88.7638     
1 1 1 22 6  18 o 18 231.053 2.95859 960.144     35.8366  933.623     32.6436  116.905    336.534     96.3191     156.534     
1 1 1 22 6  19 f 0  76.8053 2.57564 106.419     9.87601  103.264     9.89295  91.5197    225.102     0           0           
1 1 1 22 6  20 o 9  222.346 2.74849 881.022     31.2331  872.46      30.0112  109.953    216.192     96.6468     36.1915     
1 1 1 22 6  21 o 17 71.0782 2.59977 92.2487     9.57523  87.4367     8.88324  7.90757    19.3252     66.8689     199.325     
1 1 1 22 6  22 o 2  244.718 2.82308 1075.22     35.9278  1049.14     33.294   180.107    354.286     13.5814     354.286     
1 1 1 22 6  23 o 5  361.876 3.44513 2363.36     63.6305  2284.56     61.3294  270.738    48.8681     22.9722     48.8681     
1 1 1 22 6  24 o 7  197.813 2.55568 707.466     25.3297  680.486     25.3332  149.487    319.447     23.8197     319.447     
1 1 1 22 6  25 o 15 111.523 2.38935 235.326     13.2703  206.615     13.3574  55.7159    255.553     33.7067     75.5533     
1 1 1 22 6  26 o 12 130.774 2.47279 311.509     16.4946  295.562     15.8895  43.0977    43.6808     92.2192     223.681     
1 1 1 22 6  27 o 1  67.3035 2.66133 78.9023     9.08592  82.2954     8.78257  5.00907    223.99      64.5898     43.9898     
1 1 1 22 6  28 o 17 431.024 4.05336 3319.91     89.2796  3279.32     85.8134  343.872    247.791     72.952      247.791     
1 1 1 22 6  29 o 16 165.168 2.45765 494.327     20.7065  473.366     19.9806  138.172    69.6207     55.6383     69.6207     
1 1 1 22 6  30 o 12 414.783 4.12916 3035.86     91.1625  3076.74     80.0581  299.983    359.66      10.0303     359.66      
1 1 1 22 6  31 o 19 79.0143 2.7446  118.116     10.7496  104.135     10.8773  21.0818    242.019     50.8154     62.0192     
1 1 1 22 6  32 o 16 99.6041 2.60212 174.378     12.5905  178.053     13.3381  28.529     138.512     72.0907     318.512     
1 1 1 22 6  33 o 2  55.3037 3.52065 54.6308     9.4414   54.8452     9.86051  25.2248    194.012     113.489     194.012     
1 1 1 22 6  34 o 7  97.2537 2.61323 166.716     12.5947  169.327     12.8318  38.0265    176.482     47.798      356.482     
1 1 1 22 6  35 o 17 71.5648 2.80045 92.3345     9.83627  89.9677     10.1639  26.4252    138.714     17.9198     318.714     
1 1 1 22 6  36 o 5  185.602 2.63174 617.28      24.3224  605.041     24.629   127.123    59.0081     0.123513    239.008     
1 1 1 22 6  37 o 6  208.743 2.9659  760.285     32.9636  786.602     28.8765  140.085    142.436     8.10337     322.436     
1 1 1 22 6  38 o 12 162.869 2.63544 476.681     21.2626  464.741     21.7471  122.811    329.634     25.5891     329.634     
1 1 1 22 6  39 f 0  157.921 2.55001 441.436     20.0311  443.64      20.3303  107.955    32.271      0           0           
1 1 1 22 6  40 o 1  280.292 3.18402 1389.32     45.5168  1401.75     43.9103  233.466    7.85936     77.8841     7.85936     
1 1 1 22 6  41 o 15 312.539 3.37971 1727.09     51.6115  1744.98     54.2384  195.362    294.703     44.7825     114.703     
1 1 1 22 6  42 o 11 70.2019 3.03189 91.169      10.5276  84.6507     10.6851  41.2086    162.547     4.81313     162.547     
1 1 1 22 6  43 o 14 212.164 2.79626 781.982     29.5086  817.383     29.9507  163.803    327.289     36.3524     327.289     
1 1 1 22 6  44 f 0  42.5124 4.10126 34.8045     8.42949  30.8501     8.55161  21.0337    141.193     0           0           
1 1 1 22 6  45 o 14 51.1837 3.44283 47.1998     8.31858  46.888      9.10665  18.2678    281.124     5.4457      101.124     
1 1 1 22 6  46 o 17 268.07  3.02771 1198.91     40.5354  1359.96     40.7022  206.339    285.22      44.5456     285.22      
1 1 1 22 6  47 o 18 105.898 2.6466  185.799     13.4542  213.876     14.5977  42.0411    66.5782     57.1031     246.578     
1 1 1 22 6  48 o 10 102.5   2.76841 173.394     14.2391  201.43      14.0748  70.5616    194.535     7.54078     194.535     
1 1 1 22 6  49 o 8  59.5149 3.33622 54.5247     9.46995  73.2518     10.1891  32.3108    131.551     2.74548     311.551     
1 1 1 22 6  50 o 5  193.04  2.59037 650.996     24.6192  675.177     25.5014  115.607    258.895     30.4485     78.895      
1 1 1 22 6  51 o 15 111.4   2.58482 219.909     14.2172  222.341     14.6035  80.665     86.2364     15.7704     86.2364     
1 1 1 22 6  52 o 7  35.0739 4.61846 20.3608     7.37685  25.4202     8.27417  1.67022    44.7028     3.37775     224.703     
1 1 1 22 6  53 o 11 82.4374 2.76138 123.469     10.9139  119.361     11.8008  43.17      158.504     19.9661     338.504     
1 1 1 22 6  54 o 1  174.244 2.59181 531.848     22.5457  550.341     22.7157  132.929    296.114     32.5203     296.114     
1 1 1 22 6  55 o 17 70.7309 3.03486 91.4962     10.1562  87.9725     11.2039  58.9232    183.679     29.9707     183.679     
1 1 1 22 6  56 o 3  76.0857 2.87611 104.618     10.5945  102.85      11.2421  36.014     234.521     27.4966     54.5211     
1 1 1 22 6  57 o 7  17.5714 5.07155 3.00085     6.8256   1.48414     7.32921  5.58661    21.3096     22.0594     21.3096     
1 1 1 22 6  58 o 7  30.4568 5.23601 15.0654     7.39436  20.3827     8.47882  4.13471    163.806     25.8199     343.806     
1 1 1 22 6  59 o 13 78.2247 2.90188 110.721     11.4553  109.173     11.2168  52.388     267.266     3.80166     267.266     
1 1 1 22 6  60 o 19 32.0394 5.24512 24.3256     8.13181  15.0474     8.56252  14.3359    332.171     1.54023     152.171     
1 1 1 22 6  61 o 14 61.1509 3.46594 70.4298     10.3599  65.3983     10.6763  32.9879    333.382     11.6858     153.382     
1 1 1 22 6  62 o 6  64.9487 3.59737 88.4381     12.2599  65.8979     10.9321  57.3432    187.626     35.7934     187.626     
1 1 1 22 6  63 o 16 41.5796 4.42617 31.9411     9.03277  32.6076     8.83704  17.1283    73.9317     16.116      253.932     
1 1 1 22 6  64 o 18 55.7771 3.62788 59.6309     9.44451  54.1463     10.493   30.2487    341.42      9.3256      161.42      
1 1 1 22 6  65 o 6  26.0301 5.19299 -2.38518    9.48723  22.9965     8.25005  9.07339    42.6241     0.191753    222.624     
1 1 1 22 6  66 o 15 24.8525 5.19156 2.84461     7.28372  19.6013     8.16315  1.44815    200.612     24.9297     20.6122     
1 1 1 22 6  67 o 17 50.3447 3.81233 47.9053     9.77664  45.8466     9.16038  31.2986    63.9376     0.404335    63.9375     
1 1 1 22 6  68 o 9  52.4641 3.74354 52.2571     10.0193  49.6495     9.39741  29.0338    356.462     7.22425     176.462     
1 1 1 22 6  69 o 2  29.857  5.46971 19.8959     8.47935  15.5897     8.07191  16.8689    262.152     2.90117     262.152     
1 1 1 22 6  70 o 18 61.353  3.72421 64.0591     11.7707  75.9209     10.6857  34.7547    353.522     7.10856     173.521     
1 1 1 22 6  71 o 1  27.942  6.6142  17.4735     10.4847  13.4839     11.5174  11.7964    21.3643     5.51391     201.364     
1 1 1 22 6  72 o 18 35.4788 6.24821 34.847      11.7744  17.8756     10.9494  19.6672    343.963     0.324511    163.963     
1 1 1 22 6  73 o 2  23.5672 6.39387 4.45893     11.7428  12.4348     10.134   5.91114    296.663     9.68915     116.663     
1 1 1 22 6  74 o 19 28.4115 6.99347 14.5855     13.7832  17.7257     10.9936  9.21071    21.9202     2.92107     21.9202     
1 1 1 22 6  75 o 7  62.3806 5.4186  74.2323     18.2004  79.3602     14.3556  31.0475    183.008     14.1738     3.00768     
1 1 1 22 6  76 o 18 18.9223 5.98614 -5.33798    13.1433  0.521885    10.4395  3.16567    113.271     7.32572     293.271     
1 1 1 22 6  77 o 6  20.0977 6.38951 5.64904     15.574   -8.67856    11.0377  3.43099    332.666     1.30846     152.666     
1 1 1 22 6  78 o 2  59.356  5.31562 73.2041     15.5406  67.5623     15.3558  47.7942    157.401     25.6603     157.401     
1 1 1 22 6  79 o 1  19.1617 5.88167 -1.08766    9.40827  4.73821     11.5106  2.05103    352.886     11.6251     172.886     
1 1 1 22 6  80 o 19 37.4395 6.59248 35.9456     11.4716  26.5898     13.5941  17.233     130.896     7.0793      310.896     
1 1 1 22 6  81 o 17 16.458  5.43594 -1.82982    10.4369  -14.0222    12.4371  0.786035   275.037     7.44166     275.037     
1 1 1 22 6  82 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 7  0  o 18 590.7   5.59419 6195.49     165.535  6195.49     165.535  536.639    180         204.389     180         
1 1 1 22 7  1  o 14 161.378 2.61637 468.741     20.6831  454.811     21.608   62.6458    125.827     100.782     305.827     
1 1 1 22 7  2  o 11 246.68  2.90589 1096.54     35.8841  1061.79     35.9539  143.698    70.7658     66.8016     250.766     
1 1 1 22 7  3  o 4  160.489 2.69464 457.343     22.1534  456.059     21.1819  116.283    138.314     14.8348     138.314     
1 1 1 22 7  4  o 19 385.568 4.19872 2670.92     81.1161  2606.88     81.1338  321.375    179.4       83.2887     179.4       
1 1 1 22 7  5  o 12 145.109 2.78172 371.55      19.2287  375.766     21.1553  83.5223    144.736     30.473      324.736     
1 1 1 22 7  6  f 0  183.783 2.78069 597.593     25.04    600.268     26.1709  107.288    242.4       0           0           
1 1 1 22 7  7  o 2  161.911 2.72961 458.076     22.742   471.668     21.5159  103.372    36.6502     16.9064     216.65      
1 1 1 22 7  8  o 15 290.212 3.53313 1490.03     52.7919  1498.47     49.9293  115.41     213.389     190.011     33.3889     
1 1 1 22 7  9  o 17 384.702 4.57651 2637.7      85.6563  2618.52     90.7123  254.422    116.795     50.6247     296.795     
1 1 1 22 7  10 o 17 86.0784 2.85482 131.301     12.6734  132.073     11.8718  24.5126    91.6189     56.6722     271.619     
1 1 1 22 7  11 f 0  161.278 2.89229 464.528     24.0522  458.363     22.6673  168.554    315.785     0           0           
1 1 1 22 7  12 o 1  71.2946 2.96135 80.7723     10.5845  100.698     10.3535  2.4265     254.168     92.4194     254.168     
1 1 1 22 7  13 o 11 76.6957 3.00394 99.3132     11.2456  110.124     11.7529  19.4885    328.226     139.455     328.226     
1 1 1 22 7  14 o 1  408.588 4.16634 2973.58     81.3291  2954.29     89.0872  356.673    241.856     121.285     241.856     
1 1 1 22 7  15 o 15 130.293 2.40706 303.279     15.9644  299.127     15.4413  44.7552    257.361     90.8559     77.3606     
1 1 1 22 7  16 o 1  457.549 4.30743 3679.18     96.7639  3756.24     100.765  356.869    230.211     49.8287     230.211     
1 1 1 22 7  17 o 13 233.202 3.0568  996.195     35.686   933.653     35.7321  136.735    61.9465     59.9675     241.947     
1 1 1 22 7  18 o 19 65.0508 2.68249 79.3599     8.44001  71.3438     8.92023  6.97378    335.858     90.5132     335.858     
1 1 1 22 7  19 o 18 207.862 2.72205 768.108     28.3266  764.419     28.3834  172.56     288.872     53.9013     288.872     
1 1 1 22 7  20 o 8  275.143 3.31898 1336.75     44.6852  1349.78     46.8272  191.841    75.5234     9.8842      255.523     
1 1 1 22 7  21 o 16 391.676 3.82555 2727.51     73.544   2719.45     76.5996  303.886    202.345     43.8104     202.345     
1 1 1 22 7  22 o 2  199.922 2.5901  719.697     25.3547  698.025     26.5102  130.901    182.043     19.2825     2.04265     
1 1 1 22 7  23 o 14 110.128 2.47495 219.408     13.5431  211.207     13.7325  77.5564    88.6252     23.057      88.6252     
1 1 1 22 7  24 o 4  318.459 3.36882 1791.46     53.7248  1808.18     53.8026  240.62     255.212     26.4517     255.212     
1 1 1 22 7  25 o 1  286.723 3.10549 1470.89     44.5736  1446.47     44.668   231.244    109.197     55.5308     109.197     
1 1 1 22 7  26 o 4  318.172 3.38339 1798.91     53.9002  1794.55     53.9956  299.179    153.594     147.733     153.594     
1 1 1 22 7  27 o 11 236.578 2.88434 1000.56     34.1328  985.323     34.2575  120.376    93.726      94.2036     273.726     
1 1 1 22 7  28 o 6  259.038 2.82329 1206.18     37.3314  1174.68     35.9701  163.487    65.8227     39.503      245.823     
1 1 1 22 7  29 o 9  79.9317 2.72923 116.417     11.2384  110.817     10.5632  31.9753    71.8447     5.90188     71.8447     
1 1 1 22 7  30 o 2  251.345 2.97389 1128.25     37.3859  1113.65     37.5296  165.667    293.067     22.6485     113.067     
1 1 1 22 7  31 o 18 91.5647 2.46352 154.948     11.2255  143.002     11.3237  54.519     323.683     19.2896     323.683     
1 1 1 22 7  32 o 9  116.284 2.74565 250.672     15.6466  229.874     16.2532  41.4707    295.664     72.7569     115.664     
1 1 1 22 7  33 o 2  109.908 2.47325 215.614     14.0969  213.354     13.0999  43.3199    3.27391     58.7184     183.274     
1 1 1 22 7  34 o 7  386.446 3.76286 2663.59     71.3196  2642.67     74.3811  366.532    346.023     188.679     346.023     
1 1 1 22 7  35 o 4  87.5134 2.57431 133.495     11.1031  138.749     11.4284  51.5224    304.857     23.7614     304.857     
1 1 1 22 7  36 o 5  279.642 3.01487 1388.92     42.1189  1387.58     42.3814  211.125    246.851     30.6769     246.851     
1 1 1 22 7  37 o 10 114.062 2.61371 228.309     15.3117  233.954     14.5067  73.8485    248.59      1.9889      68.5903     
1 1 1 22 7  38 o 8  79.7285 2.80219 117.831     10.6428  108.515     11.602   13.0145    204.711     77.6763     24.711      
1 1 1 22 7  39 o 10 181.042 2.55613 570.11      23.0019  593.492     23.3795  126.021    225.253     2.35596     225.253     
1 1 1 22 7  40 o 4  103.244 2.57147 189.723     12.8172  189.193     13.7333  36.1378    316.956     66.4865     136.956     
1 1 1 22 7  41 o 16 182.308 2.56014 582.91      23.2076  597.365     23.5728  97.702     103.11      56.469      283.11      
1 1 1 22 7  42 o 12 99.5066 2.56428 178.993     12.561   173.172     12.9581  44.6199    302.469     43.0808     122.469     
1 1 1 22 7  43 o 11 88.9487 2.67235 142.343     11.6867  139.287     12.0747  60.1958    145.214     7.72779     145.214     
1 1 1 22 7  44 o 2  110.526 2.64145 209.571     13.702   225.187     15.5118  83.1577    59.5078     21.4117     59.5078     
1 1 1 22 7  45 o 3  175.921 2.55163 528.621     22.2544  571.69      22.7268  124.226    186.121     8.28349     186.121     
1 1 1 22 7  46 o 2  47.543  3.73521 39.2791     8.49446  42.3704     9.00675  13.6931    97.3104     22.6152     277.31      
1 1 1 22 7  47 o 8  70.7377 3.21797 87.6338     10.8118  91.4241     11.8752  51.5737    313.197     27.5223     313.197     
1 1 1 22 7  48 o 12 49.7683 3.65646 47.0066     8.86437  42.4538     9.0728   10.4882    39.6408     37.4441     219.641     
1 1 1 22 7  49 o 18 110.619 2.58666 215.869     13.9897  220.143     14.6473  69.741     279.002     7.02305     99.0025     
1 1 1 22 7  50 o 19 88.654  2.81712 139.431     12.5377  141.224     12.4289  31.7813    120.18      53.0124     300.18      
1 1 1 22 7  51 o 2  132.26  2.60132 306.874     17.2753  316.733     17.1697  83.1666    291.038     10.4184     111.038     
1 1 1 22 7  52 o 19 20.3251 5.36444 5.10242     7.25784  6.43972     7.42677  11.2564    304.284     34.3098     304.284     
1 1 1 22 7  53 o 15 55.113  3.40499 51.1436     9.01779  58.5341     9.59943  36.4458    66.2447     7.91544     66.2447     
1 1 1 22 7  54 o 9  151.86  2.51274 390.788     18.7678  431.946     19.4705  105.187    129.603     6.22975     129.603     
1 1 1 22 7  55 o 12 30.2665 5.32375 19.1807     7.73824  15.4838     8.41644  5.83398    267.392     20.9794     87.3924     
1 1 1 22 7  56 o 15 81.8878 2.97761 119.973     12.334   120.733     12.0192  53.0283    140.189     1.07443     320.189     
1 1 1 22 7  57 o 2  70.3212 3.29967 101.976     12.0689  77.2959     11.0065  56.3533    140.784     23.4887     140.784     
1 1 1 22 7  58 o 4  59.1558 3.38881 65.834      10.379   60.9845     9.54498  21.2285    344.267     33.8178     164.267     
1 1 1 22 7  59 o 1  53.6835 3.78364 54.7718     10.2582  50.5415     9.8293   39.1503    39.9983     12.8086     39.9983     
1 1 1 22 7  60 o 18 115.996 2.66506 249.655     15.0256  233.107     15.8614  79.4138    69.6004     6.36196     69.6004     
1 1 1 22 7  61 o 6  50.3648 3.77179 43.386      9.12861  49.6776     9.6136   38.3948    57.3399     17.025      57.3399     
1 1 1 22 7  62 o 1  57.7948 3.60171 60.5898     10.4032  61.2858     10.245   34.9784    327.831     2.81807     147.831     
1 1 1 22 7  63 o 18 139.583 2.65224 334.527     17.641   365.576     19.4391  100.383    211.305     18.3128     211.305     
1 1 1 22 7  64 o 2  73.759  3.30052 90.6089     11.6622  107.326     12.6078  54.9365    171.434     15.9741     171.434     
1 1 1 22 7  65 o 19 52.2162 4.21731 54.4506     11.3071  47.0636     10.3726  26.4776    187.791     12.6571     7.79067     
1 1 1 22 7  66 o 18 31.2729 5.31047 28.6146     8.75535  10.0806     8.62309  6.67577    80.0612     24.0043     260.061     
1 1 1 22 7  67 o 8  48.5883 3.96945 39.1306     9.40542  49.1682     9.44896  26.963     303.72      6.41754     123.72      
1 1 1 22 7  68 o 11 33.8737 5.50723 21.2524     8.97994  24.3973     9.33864  21.6371    250.99      13.7539     250.99      
1 1 1 22 7  69 o 5  19.1855 5.48852 3.13467     8.0901   4.96077     8.29572  2.21917    359.744     12.6999     179.744     
1 1 1 22 7  70 o 19 50.3587 4.95128 53.3954     13.5624  45.1246     10.7426  33.7828    168.999     6.36192     168.999     
1 1 1 22 7  71 o 7  64.9414 4.59301 93.1579     16.8924  69.0521     12.6768  40.06      205.321     0.616683    25.3213     
1 1 1 22 7  72 o 7  42.4518 6.42064 37.6863     15.1486  37.1795     11.2903  28.5879    208.878     9.01684     208.878     
1 1 1 22 7  73 o 18 26.3676 6.73226 8.86821     13.7627  16.1311     10.0729  7.29692    263.471     11.8316     83.4712     
1 1 1 22 7  74 o 5  27.8884 7.00652 14.3985     13.3844  16.5685     11.3881  8.44735    8.49329     12.8382     188.493     
1 1 1 22 7  75 o 12 18.7927 5.82241 2.69075     10.5174  -3.23106    10.6335  4.72803    272.568     29.0802     272.568     
1 1 1 22 7  76 o 9  17.4586 5.58464 -14.9416    11.2319  2.85517     10.8739  2.05413    206.786     3.71157     26.7856     
1 1 1 22 7  77 o 16 37.0291 7.12962 44.5891     15.135   17.2715     13.7712  25.7096    346.587     13.8153     346.587     
1 1 1 22 7  78 o 19 30.2405 7.19405 13.2238     13.4856  26.8345     13.2985  13.5735    42.4745     4.67221     222.475     
1 1 1 22 7  79 o 11 22.7801 6.70181 4.0812      12.7552  10.5461     12.756   5.75686    264.437     5.60831     84.4372     
1 1 1 22 7  80 o 10 37.8445 7.87933 39.3227     15.4453  31.9833     16.8507  20.2835    272.33      0.778625    272.33      
1 1 1 22 7  81 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 7  82 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 8  0  o 2  302.075 3.46442 1619.14     52.414   1619.14     52.414   194.687    3.39883e-06 55.5287     180         
1 1 1 22 8  1  o 4  243.677 3.10316 1058.31     36.9593  1048.17     38.7985  175.005    101.979     1.15862     281.979     
1 1 1 22 8  2  o 6  146.672 2.70411 372.065     20.3601  391.299     19.3218  32.3297    114.184     143.613     294.184     
1 1 1 22 8  3  o 13 137.315 2.82457 332.709     20.4377  336.641     18.3236  53.0909    338.522     86.2144     158.522     
1 1 1 22 8  4  o 15 444.4   4.97489 3489.68     116.737  3528.72     104.435  345.104    15.5787     40.3841     15.5787     
1 1 1 22 8  5  o 3  185.096 3.14212 605.009     28.2275  610.453     30.0439  178.554    337.598     102.957     337.598     
1 1 1 22 8  6  o 11 119.2   2.9035  256.627     16.7407  248.001     17.8546  20.6649    132.081     124.626     312.081     
1 1 1 22 8  7  o 13 179.869 3.04156 586.974     27.3719  560.888     27.4488  81.7119    333.145     93.4108     153.145     
1 1 1 22 8  8  o 1  86.9675 3.00187 135.243     12.6802  133.701     13.3923  42.8252    304.713     15.0162     304.713     
1 1 1 22 8  9  o 7  46.6907 3.5904  39.882      8.17898  38.4065     8.34518  18.6487    231.945     79.0728     231.945     
1 1 1 22 8  10 o 13 135.876 2.71468 347.801     16.5691  307.95      19.9545  68.3185    185.213     51.4481     5.21318     
1 1 1 22 8  11 o 11 117.946 2.49203 247.995     14.459   245.789     14.9608  92.3609    274.17      40.0945     274.17      
1 1 1 22 8  12 o 17 417.416 4.00129 3103.66     82.0136  3082.95     85.3429  309.024    331.017     10.2088     331.017     
1 1 1 22 8  13 o 9  264.644 2.95978 1240.12     37.5827  1244.45     40.8618  164.588    308.367     52.5766     128.367     
1 1 1 22 8  14 o 18 288.419 3.06347 1479.33     42.5378  1471.98     45.9454  231.722    29.457      48.3094     29.457      
1 1 1 22 8  15 o 17 111.862 2.33699 228.812     12.5517  215.409     13.5616  45.3002    148.117     59.8093     328.117     
1 1 1 22 8  16 o 10 211.694 2.62026 801.89      27.2375  787.63      28.3359  97.6826    55.0454     107.629     235.045     
1 1 1 22 8  17 o 16 131.516 2.56234 302.318     15.7376  311.652     17.9629  112.985    169.793     76.033      169.793     
1 1 1 22 8  18 o 1  324.846 3.38591 1867.72     55.0823  1877.58     55.1587  230.026    79.876      8.45114     259.876     
1 1 1 22 8  19 o 6  312.04  3.19077 1761.16     49.8817  1694.45     49.8961  248.372    83.1115     48.4949     83.1115     
1 1 1 22 8  20 o 17 50.6001 3.07145 46.8624     7.31904  44.6697     8.06325  22.286     334.85      96.644      334.85      
1 1 1 22 8  21 o 13 120.691 2.29328 260.354     13.6052  256.594     14.1019  94.8279    73.3088     61.4444     73.3088     
1 1 1 22 8  22 o 6  308.726 3.08546 1689.79     47.7008  1692.45     47.773   229.926    187.521     17.4351     187.521     
1 1 1 22 8  23 o 13 49.7769 3.0545  45.179      7.5359   43.4139     7.54949  15.4217    116.064     77.4116     116.064     
1 1 1 22 8  24 o 15 184.269 2.48074 614.468     22.8499  590.031     22.9573  119.729    59.8556     18.0676     239.856     
1 1 1 22 8  25 o 12 68.9441 2.71001 94.249      8.97237  75.431      9.51754  23.6161    220.132     134.473     220.132     
1 1 1 22 8  26 o 13 286.6   2.9688  1463.38     41.7727  1451.46     43.4825  184.049    301.045     40.4718     121.045     
1 1 1 22 8  27 o 14 116.763 2.34636 242.547     13.3631  241.397     14.0577  67.6928    181.309     17.6944     1.30897     
1 1 1 22 8  28 o 7  265.732 2.898   1245.95     38.4814  1259.85     38.7036  222.051    186.708     69.1869     186.708     
1 1 1 22 8  29 o 4  383.686 3.83418 2628.33     73.6671  2601.58     73.7788  294.574    234.356     41.7587     234.356     
1 1 1 22 8  30 o 9  45.6676 3.45198 40.2661     7.57568  34.7396     7.90614  18.3343    343.891     79.1816     343.891     
1 1 1 22 8  31 o 3  223.588 2.8584  901.629     30.6085  872.681     33.3382  149.306    313.675     15.2001     133.675     
1 1 1 22 8  32 o 19 167.62  2.52736 504.921     20.5639  491.985     21.8572  137.487    135.001     47.29       135.001     
1 1 1 22 8  33 o 8  321.624 3.17874 1825.51     50.1965  1847.72     52.263   265.455    198.447     76.673      198.447     
1 1 1 22 8  34 f 0  125.627 2.49055 296.149     15.5113  264.744     15.7643  90.735     101.772     0           0           
1 1 1 22 8  35 o 13 94.1954 2.54261 154.351     11.4641  161.038     12.4923  67.3134    70.9089     42.6546     70.9089     
1 1 1 22 8  36 o 4  172.295 2.45241 530.398     20.6432  523.151     21.6861  150.427    167.797     65.3281     167.797     
1 1 1 22 8  37 o 9  91.5553 2.80374 143.537     12.4902  154.792     13.1802  13.1274    76.5378     97.1094     256.538     
1 1 1 22 8  38 o 2  193.968 2.59173 665.993     24.0044  669.84      26.3338  131.246    91.4777     7.22381     271.478     
1 1 1 22 8  39 o 12 142.551 2.55037 344.689     17.122   377.513     19.3057  83.3275    131.406     28.931      311.406     
1 1 1 22 8  40 o 12 154.196 2.67647 411.785     20.3234  432.987     21.0429  100.185    117.301     11.3749     297.301     
1 1 1 22 8  41 o 17 69.5753 3.00578 82.3349     9.91928  90.5122     10.9471  21.7456    30.4069     45.0645     210.407     
1 1 1 22 8  42 o 8  154.112 2.53465 416.522     18.8674  427.324     20.2739  114.775    134.055     19.2969     134.055     
1 1 1 22 8  43 o 19 136.031 2.44946 315.927     16.4572  342.014     16.9199  118.046    39.0799     54.1896     39.0799     
1 1 1 22 8  44 o 15 92.0644 2.69839 151.025     12.1854  150.896     12.6551  53.7995    29.0812     13.2497     209.081     
1 1 1 22 8  45 o 8  81.2155 2.75601 119.421     10.9352  115.803     11.4182  66.2968    34.9267     37.8401     34.9267     
1 1 1 22 8  46 o 17 83.6687 2.90173 130.344     11.5756  119.642     12.5979  43.3949    226.53      22.4132     46.5304     
1 1 1 22 8  47 o 16 40.2238 4.25037 25.0771     8.04959  34.5226     8.45282  9.57227    182.37      11.1793     2.36964     
1 1 1 22 8  48 o 18 102.614 2.64475 181.401     13.0207  194.154     14.1378  48.1806    25.5864     40.5242     205.586     
1 1 1 22 8  49 o 1  114.03  2.57539 219.453     14.4821  244.413     14.9015  84.4826    81.3927     18.281      81.3926     
1 1 1 22 8  50 o 13 61.0072 3.19799 60.3478     9.5041   73.6638     9.86657  37.7846    339.964     3.40376     339.964     
1 1 1 22 8  51 o 17 79.0014 2.87841 105.675     11.0475  117.816     11.6673  58.0362    120.977     15.0149     120.977     
1 1 1 22 8  52 o 18 157.926 2.64409 425.042     20.663   465.006     21.1776  112.134    327.232     10.7168     327.232     
1 1 1 22 8  53 o 19 71.8113 3.22233 99.8303     11.9208  85.8228     11.1474  58.5246    312.64      25.0441     312.64      
1 1 1 22 8  54 o 9  61.2434 3.51046 65.919      11.0135  69.6954     10.3068  35.8877    41.7793     7.04666     221.779     
1 1 1 22 8  55 o 4  16.3806 4.97621 -6.2322     7.4361   3.43367     7.87526  11.6773    342.183     36.7578     342.183     
1 1 1 22 8  56 o 9  81.6419 3.20102 128.611     12.6456  111.788     13.3316  53.702     274.155     0.327054    274.155     
1 1 1 22 8  57 o 4  71.1437 3.15967 84.5047     11.0622  98.3812     11.3207  53.0247    233.518     14.5129     233.518     
1 1 1 22 8  58 o 6  24.8098 5.58184 11.2146     7.51933  11.4443     8.10125  2.05982    224.647     20.7869     44.6474     
1 1 1 22 8  59 o 16 64.1637 3.27273 81.2184     10.5298  68.2017     10.3268  41.2096    243.322     0.203681    243.323     
1 1 1 22 8  60 o 6  73.1468 3.00153 96.3566     11.1395  96.7513     10.7669  54.6       295.929     15.2533     295.929     
1 1 1 22 8  61 o 4  42.0582 4.35134 27.5393     8.83601  38.8954     8.70574  24.7437    301.247     0.701054    121.247     
1 1 1 22 8  62 o 9  72.4229 3.24406 95.5184     11.9591  94.6975     11.4642  40.1445    167.101     13.2645     347.101     
1 1 1 22 8  63 o 10 90.4499 2.99151 145.448     13.5779  150.222     13.4618  72.4125    42.6431     27.9833     42.6431     
1 1 1 22 8  64 o 19 55.3728 3.88308 55.9973     10.9152  57.1873     10.3324  25.2031    194.374     20.1438     14.3744     
1 1 1 22 8  65 o 5  23.5102 5.67584 12.4119     7.93309  7.18265     8.42399  1.62008    88.7169     23.0341     268.717     
1 1 1 22 8  66 o 16 35.471  5.71049 31.6609     10.9505  19.0255     9.05696  22.7674    241.215     5.29474     241.215     
1 1 1 22 8  67 o 13 89.5798 3.5356  136.444     16.9582  159.193     14.1946  59.0454    74.2977     3.08072     74.2977     
1 1 1 22 8  68 o 2  23.727  5.91167 3.57754     9.72774  15.0345     8.92435  6.01474    320.807     12.9713     140.807     
1 1 1 22 8  69 o 15 26.7466 6.80783 19.2862     13.6668  8.77747     9.72259  10.7138    171.121     6.11853     351.121     
1 1 1 22 8  70 o 13 24.4397 6.55806 16.7048     12.4956  3.24826     10.2873  8.54189    104.119     0.409716    284.119     
1 1 1 22 8  71 o 9  56.1275 5.55877 75.6281     15.3189  50.6977     14.6418  34.4203    10.7899     0.057388    10.7886     
1 1 1 22 8  72 o 15 24.2999 5.93583 -3.29688    10.6133  20.1432     10.1601  7.46448    130.364     5.64737     310.364     
1 1 1 22 8  73 o 19 43.6159 5.7895  34.6263     12.2922  42.7693     12.0266  33.191     129.123     18.1237     129.123     
1 1 1 22 8  74 o 3  54.8088 5.21919 50.577      13.4668  68.3544     14.2911  36.5921    272.395     6.70681     272.395     
1 1 1 22 8  75 o 14 22.3781 6.43256 7.29276     11.3358  6.24503     11.2714  5.87263    311.416     10.167      131.416     
1 1 1 22 8  76 o 3  34.7741 7.04332 30.4705     12.9752  23.1633     13.0381  10.9371    127.455     18.6134     307.455     
1 1 1 22 8  77 o 14 43.1227 6.68329 41.4666     14.1983  39.776      13.89    28.1089    228.758     6.86168     228.758     
1 1 1 22 8  78 o 18 18.9633 6.00369 1.09905     11.7186  -2.19781    11.8257  1.06577    298.225     12.5461     118.225     
1 1 1 22 8  79 o 1  21.1485 6.45398 -0.84502    12.4189  8.81982     12.8874  2.27948    20.5798     2.68877     200.58      
1 1 1 22 8  80 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 8  81 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 9  0  o 8  84.5375 2.6686  127.436     11.2541  127.436     11.2541  52.5374    180         0.660484    180         
1 1 1 22 9  1  f 0  131.979 2.67866 309.027     16.766   309.285     18.5841  156.086    292.554     0           0           
1 1 1 22 9  2  o 16 207.433 3.01843 759.499     32.9147  767.036     29.7436  129.301    344.736     39.247      164.736     
1 1 1 22 9  3  o 8  172.03  2.70434 523.442     22.7597  526.238     23.859   168.446    249.064     105.612     249.064     
1 1 1 22 9  4  o 13 273.409 3.24317 1318.58     42.35    1333.95     46.4513  245.55     182.928     97.1769     182.928     
1 1 1 22 9  5  o 10 232.015 2.88736 956.029     33.5372  953.571     33.6067  167.192    178.894     0.568435    178.894     
1 1 1 22 9  6  o 1  48.5214 3.10718 38.1969     7.26359  46.2111     7.66125  29.0454    279.297     109.665     279.297     
1 1 1 22 9  7  o 3  234.749 2.7887  978.916     33.408   975.844     32.1966  139.58     146.493     59.8018     326.493     
1 1 1 22 9  8  o 10 253.24  2.9015  1151.18     37.4926  1123.94     36.1525  191.683    241.512     18.3553     241.512     
1 1 1 22 9  9  o 18 163.68  2.5492  483.123     20.7915  467.133     21.0201  95.8156    15.0183     39.0792     195.018     
1 1 1 22 9  10 o 12 435.596 4.60396 3404.64     100.421  3338.52     100.575  354.952    134.76      74.0735     134.76      
1 1 1 22 9  11 o 12 145.223 2.52186 359.271     17.7917  389.007     18.9209  123.868    33.9541     54.7983     33.9541     
1 1 1 22 9  12 o 7  343.295 3.62461 2068.13     63.6077  2115.8      61.0457  255.362    176.026     11.9983     176.026     
1 1 1 22 9  13 o 5  76.1985 2.70669 102.82      10.2427  103.659     10.3628  26.3185    93.0436     32.1167     273.044     
1 1 1 22 9  14 o 12 127.909 2.49035 295.139     15.5436  285.609     16.3267  5.20899    93.5152     190.651     93.5152     
1 1 1 22 9  15 o 16 140.636 2.55221 350.241     17.9498  351.748     17.9958  92.7958    210.578     6.5746      30.5784     
1 1 1 22 9  16 o 5  116.614 2.38455 243.172     13.6645  239.528     14.1679  84.1567    205.83      20.1314     205.83      
1 1 1 22 9  17 o 10 104.355 2.49416 197.137     12.8833  189.596     13.1559  49.0664    114.059     38.4471     294.059     
1 1 1 22 9  18 o 13 126.15  2.55419 288.183     15.7313  276.814     16.5003  33.9686    7.33137     106.843     187.331     
1 1 1 22 9  19 o 3  301.406 3.23916 1624.83     47.92    1599.57     49.8954  173.931    231.808     87.1928     51.8082     
1 1 1 22 9  20 o 11 203.279 2.61443 744.508     26.6346  721.431     26.6276  199.991    65.8713     120.31      65.8713     
1 1 1 22 9  21 o 7  165.442 2.47629 485.89      19.7002  484.968     21.3276  92.9627    308.134     45.5955     128.134     
1 1 1 22 9  22 o 2  377.571 3.53006 2504.9      65.5565  2557.09     68.0296  285.537    279.624     26.6209     279.624     
1 1 1 22 9  23 o 15 368.796 3.43793 2437.58     63.5097  2391.5      63.5643  304.26     270.469     78.1919     270.469     
1 1 1 22 9  24 o 6  280.132 2.98249 1394.63     42.5982  1390.28     41.131   183.819    294.125     33.1698     114.125     
1 1 1 22 9  25 o 16 140.922 2.21647 359.067     15.5874  345.311     15.7117  45.5087    181.744     104.976     1.74387     
1 1 1 22 9  26 o 2  368.627 3.452   2408.42     63.738   2416.78     63.8025  212.389    102.675     105.038     282.675     
1 1 1 22 9  27 o 9  104.618 2.38889 192.34      12.4204  196.313     12.5961  75.7501    270.349     43.4864     270.349     
1 1 1 22 9  28 o 13 63.8877 2.96424 75.662      9.94617  69.8877     8.93168  5.87351    328.741     88.7244     328.741     
1 1 1 22 9  29 o 17 87.1634 2.58532 134.309     10.9346  135.735     11.5946  50.6183    58.8952     1.01056     58.895      
1 1 1 22 9  30 o 4  184.898 2.61352 615.929     24.6527  597.282     23.7824  70.0925    314.759     120.223     134.759     
1 1 1 22 9  31 o 4  153.446 2.34705 420.594     17.6792  414.763     18.4044  91.7006    340.36      28.6726     160.36      
1 1 1 22 9  32 o 19 460.801 4.27648 3804.21     96.6574  3751.73     100.777  363.402    12.8425     69.2903     12.8425     
1 1 1 22 9  33 o 6  201.637 2.52144 724.832     25.4     718.16      25.5563  150.928    162.772     19.7181     162.772     
1 1 1 22 9  34 o 6  159.286 2.31564 443.835     18.3528  456.546     18.6163  84.5698    146.163     52.8156     326.163     
1 1 1 22 9  35 o 6  127.882 2.41321 292.688     15.4405  288.176     15.462   94.2037    227.547     14.8615     227.547     
1 1 1 22 9  36 o 14 32.2027 4.74144 16.1214     7.50653  22.3721     7.30428  2.97147    142.76      16.0722     142.76      
1 1 1 22 9  37 o 11 198.375 2.59317 663.425     26.0297  735.034     25.4453  100.337    277.236     77.4514     97.2364     
1 1 1 22 9  38 o 12 39.9445 4.10479 26.654      7.94856  31.4893     7.95689  3.65194    52.1405     13.5482     232.14      
1 1 1 22 9  39 o 12 83.6779 2.70594 123.35      10.9905  125.981     11.6402  53.6687    266.24      0.739507    266.24      
1 1 1 22 9  40 o 17 27.6349 5.1642  8.56154     7.15462  19.8635     7.88757  3.2413     302.544     12.7221     302.544     
1 1 1 22 9  41 f 0  37.6841 4.48715 22.7966     7.6559   29.5426     8.6977   30.2436    216.535     0           0           
1 1 1 22 9  42 o 8  46.8787 3.86619 42.4224     8.13318  37.1405     9.47721  0.822972   104.904     57.6361     104.904     
1 1 1 22 9  43 o 2  158.015 2.5004  430.801     18.7865  457.101     20.8086  136.614    241.377     57.9056     241.377     
1 1 1 22 9  44 o 2  137.586 2.47016 330.767     16.0777  342.677     17.9464  98.3044    306.347     9.38164     306.348     
1 1 1 22 9  45 o 16 116.903 2.60027 234.235     14.7229  252.764     15.7115  81.0578    307.607     4.99015     307.607     
1 1 1 22 9  46 o 13 65.5995 3.24037 75.3957     9.84976  78.9509     11.2984  37.0308    225.161     6.47818     45.1608     
1 1 1 22 9  47 o 11 95.624  2.69593 154.999     12.0464  171.496     13.7451  70.6485    22.6829     16.7398     22.6829     
1 1 1 22 9  48 o 4  127.428 2.55254 284.645     14.8383  294.221     17.6484  57.5228    176.004     57.8691     356.004     
1 1 1 22 9  49 o 12 84.8854 2.95887 129.16      12.1366  128.68      12.9441  52.4875    18.6909     6.46847     198.691     
1 1 1 22 9  50 o 10 106.447 2.71223 198.092     13.6782  206.696     15.1978  75.1604    263.872     7.7589      263.872     
1 1 1 22 9  51 o 3  72.1018 3.23796 86.0564     10.5996  101.104     12.6962  59.8518    237.253     26.9804     237.253     
1 1 1 22 9  52 o 9  140.573 2.77199 333.319     18.3238  373.88      20.709   101.059    153.022     11.8143     153.022     
1 1 1 22 9  53 o 13 89.1143 3.04726 141.226     13.0287  143.921     14.0951  74.6566    132.114     31.9646     132.114     
1 1 1 22 9  54 o 7  92.9055 3.08889 162.348     13.7175  148.07      14.8603  58.9311    180.461     5.87213     0.460615    
1 1 1 22 9  55 o 2  114.347 2.94382 232.554     15.8475  236.983     17.7928  68.1864    33.4401     16.8032     213.44      
1 1 1 22 9  56 o 11 62.4149 3.6618  76.1818     11.9857  65.7376     10.7271  36.5547    176.386     7.62966     356.386     
1 1 1 22 9  57 o 14 87.0649 2.94357 129.553     12.191   143.52      13.4294  74.6852    94.3111     35.8967     94.3111     
1 1 1 22 9  58 o 8  18.3065 5.17113 5.95409     7.19635  -0.178255   7.53717  1.74514    248.144     15.5694     248.144     
1 1 1 22 9  59 o 15 119.283 2.60936 261.967     15.4758  248.73      15.6689  89.5206    124.16      21.2541     124.16      
1 1 1 22 9  60 o 5  60.4163 3.45405 61.2006     10.3054  71.949      10.3792  41.9741    84.3891     7.16649     84.3891     
1 1 1 22 9  61 o 13 52.8058 3.72233 51.6193     9.60935  50.7305     9.82477  33.1844    4.41549     0.106265    184.415     
1 1 1 22 9  62 o 4  26.7902 6.01226 12.4598     9.68426  14.6521     8.55335  5.10752    62.2088     20.0451     242.209     
1 1 1 22 9  63 o 16 69.4002 3.6274  79.4045     12.6138  97.6112     12.2805  48.0064    261.899     6.69281     261.899     
1 1 1 22 9  64 o 5  90.5695 3.52596 141.16      17.6166  159.355     13.6625  68.0666    14.0446     18.7426     14.0446     
1 1 1 22 9  65 f 0  42.8285 5.31268 29.2421     11.4982  42.6774     10.024   20.8594    96.2427     0           0           
1 1 1 22 9  66 o 10 28.636  5.74328 8.3373      9.83087  23.3593     8.83096  15.8117    195.339     6.58966     195.339     
1 1 1 22 9  67 o 3  19.723  5.9789  2.70704     12.9858  1.78066     7.95058  2.1308     37.5011     1.05693     217.501     
1 1 1 22 9  68 o 18 24.4818 5.92855 -1.75673    12.2449  17.6174     8.642    9.55993    70.5764     4.02051     250.576     
1 1 1 22 9  69 o 4  38.0749 6.01979 38.2757     13.1903  22.3419     9.37057  23.3221    306.944     2.72222     306.944     
1 1 1 22 9  70 o 1  35.7302 6.37938 28.2929     11.9447  25.3505     10.9066  20.1201    90.7437     0.23169     90.7437     
1 1 1 22 9  71 o 12 36.4243 6.27152 34.6519     11.747   21.3515     11.2498  14.0826    194         14.3827     14.0002     
1 1 1 22 9  72 o 7  42.699  5.85139 26.4386     12.2063  49.148      11.7327  23.2609    351.8       4.31252     171.8       
1 1 1 22 9  73 o 17 33.0015 6.6074  21.7749     11.6233  24.5245     11.266   12.612     44.1739     13.0522     224.174     
1 1 1 22 9  74 o 17 21.3513 5.99687 14.6228     10.9535  -9.82288    11.1056  3.42123    290.826     14.9535     110.826     
1 1 1 22 9  75 o 9  36.0137 7.11792 29.4263     13.3603  28.4556     13.3272  16.4823    330.835     8.73204     150.835     
1 1 1 22 9  76 o 8  23.3916 6.54677 16.337      12.0344  -2.13902    12.6719  3.21423    175.914     0.749566    175.914     
1 1 1 22 9  77 o 18 19.8769 6.24042 1.03439     12.4054  0.864528    12.4281  0.384639   151.829     0.347548    331.829     
1 1 1 22 9  78 o 5  28.8876 7.23313 27.7992     14.0007  10.0909     13.6496  11.6352    177.413     1.95977     177.413     
1 1 1 22 9  79 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 9  80 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 10 0  o 14 104.37  2.52041 193.764     13.1479  193.764     13.1479  73.178     180         4.23793     8.67658e-06 
1 1 1 22 10 1  o 13 255.773 2.99997 1180.35     36.861   1140.99     39.9236  180.239    84.8696     10.1343     264.87      
1 1 1 22 10 2  o 17 94.3877 2.82698 161.417     12.5398  155.236     14.0643  59.0842    40.4442     17.1516     40.4442     
1 1 1 22 10 3  o 8  133.675 2.52515 316.786     16.5031  317.449     17.2902  56.8707    356.007     72.9936     176.007     
1 1 1 22 10 4  o 5  275.113 3.10625 1354.55     42.7937  1331.22     42.8552  195.964    21.8922     7.5409      201.892     
1 1 1 22 10 5  o 10 287.619 3.10503 1495.3      43.7956  1440.43     45.6493  191.458    317.042     35.6082     137.042     
1 1 1 22 10 6  o 8  356.464 3.59074 2280.83     62.8112  2230.36     65.4158  258.8      83.489      3.17379     263.489     
1 1 1 22 10 7  o 13 264.916 2.96925 1267.42     39.3812  1222.87     39.4481  169.281    100.86      45.882      280.86      
1 1 1 22 10 8  o 11 316.593 3.27093 1808.49     51.8583  1749.08     51.9215  236.497    299.737     12.2538     299.737     
1 1 1 22 10 9  o 15 242.538 2.81705 1059.07     34.1957  1027.98     34.2776  152.433    256.667     45.7431     76.6673     
1 1 1 22 10 10 o 16 394.82  3.81185 2788.73     76.9218  2747.1      73.9106  340.578    294.507     105.353     294.507     
1 1 1 22 10 11 o 12 222.801 2.89785 890.589     31.5324  870.74      33.1383  125.839    1.30982     69.4195     181.31      
1 1 1 22 10 12 o 5  246.5   2.74245 1066.88     34.4163  1088.79     33.3165  186.48     2.80401     18.287      2.80401     
1 1 1 22 10 13 o 18 223.719 2.77169 892.243     31.5807  883.435     30.5651  142.717    215.346     35.9935     35.3462     
1 1 1 22 10 14 o 11 245.791 2.93705 1077.12     36.0512  1066.55     36.3013  167.763    91.75       18.4154     271.75      
1 1 1 22 10 15 o 6  107.026 2.53634 209.026     13.3544  197.821     13.791   52.9815    348.063     35.5249     168.063     
1 1 1 22 10 16 o 6  107.961 2.6355  196.78      14.6408  217.456     13.7478  61.3522    209.322     18.2087     29.3219     
1 1 1 22 10 17 o 8  99.5366 2.67939 171.952     13.3311  180.091     13.3455  53.4902    16.5063     19.7037     196.506     
1 1 1 22 10 18 o 4  102.095 2.64139 181.209     13.9621  189.109     12.9765  26.1679    39.7595     85.0326     219.759     
1 1 1 22 10 19 o 12 237.696 2.86321 979.214     34.0276  1025.88     34.1745  206.601    250.135     75.511      250.135     
1 1 1 22 10 20 o 11 93.4064 2.71982 146.056     12.9597  164.29      12.3722  38.5088    143.418     42.7251     323.418     
1 1 1 22 10 21 o 2  193.544 2.82927 656.986     27.4541  672.279     27.4267  169.017    49.1487     68.1625     49.1487     
1 1 1 22 10 22 o 14 349.642 3.66061 2157.48     62.781   2184.63     65.4878  281.094    110.673     58.1244     110.673     
1 1 1 22 10 23 o 17 132.115 2.45881 321.615     15.8601  298.025     16.6248  86.3401    56.8466     6.40051     236.847     
1 1 1 22 10 24 o 16 156.509 2.5007  427.323     19.155   441.741     20.0731  118.784    254.902     22.3724     254.902     
1 1 1 22 10 25 o 8  152.824 2.47082 416.59      18.4738  411.98      19.3567  91.2747    296.264     29.7996     116.264     
1 1 1 22 10 26 o 4  37.4156 4.20902 23.71       7.57646  27.3536     7.65743  36.5487    91.1327     108.813     91.1327     
1 1 1 22 10 27 o 18 293.697 3.25768 1521.24     47.8322  1542.06     48.063   238.148    120.161     57.0816     120.161     
1 1 1 22 10 28 o 6  201.478 2.80361 717.183     27.5604  723.713     29.0418  162.626    13.7547     42.4634     13.7547     
1 1 1 22 10 29 o 12 227.23  2.80042 901.736     31.1196  931.327     32.6597  224.578    55.7978     131.391     55.7978     
1 1 1 22 10 30 o 10 172.489 2.7153  522.08      22.7458  534.146     24.1891  110.128    115.541     21.6142     295.541     
1 1 1 22 10 31 o 17 262.95  3.05901 1224.42     38.4518  1231.6      42.0958  175.669    2.99014     22.8215     182.99      
1 1 1 22 10 32 o 15 19.4733 5.00792 -3.21265    7.22421  10.2716     7.04825  23.6989    61.7861     55.5728     61.7861     
1 1 1 22 10 33 o 13 175.232 2.52577 548.56      21.6515  541.553     22.6893  153.865    346.5       64.156      346.5       
1 1 1 22 10 34 o 16 123.564 2.3765  268.085     14.8748  274.321     14.5223  112.771    254.621     62.0722     254.621     
1 1 1 22 10 35 o 19 117.973 2.40196 247.447     14.0318  247.109     14.3382  91.7934    127.363     24.7629     127.363     
1 1 1 22 10 36 o 13 216.241 2.6001  827.698     28.5041  833.358     27.8425  174.538    306.91      45.6692     306.91      
1 1 1 22 10 37 o 13 290.217 3.20622 1478.73     47.3424  1517.89     45.8831  196.793    6.96186     16.3726     186.962     
1 1 1 22 10 38 f 0  253.385 2.77924 1159        34.5064  1123.59     36.0294  154.969    264.945     0           0           
1 1 1 22 10 39 o 14 49.8149 3.55789 45.2128     8.97857  44.1108     8.54088  18.3728    154.257     14.0961     334.257     
1 1 1 22 10 40 o 2  124.404 2.41503 280.298     14.9487  270.141     15.1275  107.588    183.473     48.0561     183.473     
1 1 1 22 10 41 o 10 260.225 2.82694 1217.44     36.7542  1192.45     36.9723  166.694    95.9659     31.0739     275.966     
1 1 1 22 10 42 o 19 42.1597 3.97456 27.0777     8.0149   38.0426     8.17075  11.3364    23.2959     17.562      203.296     
1 1 1 22 10 43 o 5  111.138 2.53829 219.405     13.5992  220.526     14.6217  99.4022    9.43074     52.5966     9.43074     
1 1 1 22 10 44 o 14 51.0575 3.64334 55.4359     8.49083  39.3917     9.43153  5.02013    331.254     2.39312     331.254     
1 1 1 22 10 45 o 4  28.6346 5.37412 16.5039     7.49188  14.1395     8.24428  0.624306   98.7922     7.35106     98.7922     
1 1 1 22 10 46 o 13 44.0628 4.11042 33.4868     8.60555  37.4369     9.1042   15.8038    97.8249     11.8893     277.825     
1 1 1 22 10 47 o 7  165.591 2.64055 475.907     20.8522  501.637     22.9655  103.403    187.993     20.4709     7.99258     
1 1 1 22 10 48 o 4  92.8308 3.03888 140.034     13.552   169.22      14.6315  63.7256    330.157     3.61075     330.157     
1 1 1 22 10 49 o 6  34.2614 5.42361 20.8707     8.9422   23.5462     9.22523  7.6144     81.5324     23.9455     261.532     
1 1 1 22 10 50 o 9  89.7616 2.82345 137.506     12.0283  151.133     13.3165  57.1656    74.8341     6.3927      254.834     
1 1 1 22 10 51 o 18 39.1616 4.77597 31.1422     8.62933  26.17       9.34181  12.7981    224.612     22.5714     44.6119     
1 1 1 22 10 52 o 19 135.653 2.52754 320.28      16.785   337.595     17.553   104.722    350.751     25.7302     350.751     
1 1 1 22 10 53 o 9  62.6552 3.21297 71.6461     9.55675  70.1232     10.4486  27.1015    281.017     28.334      101.017     
1 1 1 22 10 54 f 0  19.72   5.21811 2.5765      7.08754  7.98755     7.11766  31.7405    96.0471     0           0           
1 1 1 22 10 55 o 1  21.0046 5.33196 8.45971     7.1234   5.57184     7.25254  6.01597    82.8472     33.6635     82.8472     
1 1 1 22 10 56 o 16 56.2703 3.86431 54.7308     10.5934  61.303      10.9134  36.7761    354.328     1.70783     354.328     
1 1 1 22 10 57 o 19 62.8416 3.39908 76.3468     10.5601  67.2911     10.6436  40.92      279.218     0.572788    279.218     
1 1 1 22 10 58 o 14 65.4888 3.44725 71.9112     11.1772  84.3148     11.2312  35.1131    285.373     15.1725     105.373     
1 1 1 22 10 59 o 10 26.9104 5.71543 10.8418     8.41366  16.7076     8.46073  8.16571    212.25      11.5324     32.2498     
1 1 1 22 10 60 o 13 47.599  4.38719 39.9036     9.84112  44.7314     10.5953  37.0892    238.102     16.8637     238.102     
1 1 1 22 10 61 o 11 55.6073 4.07852 56.2904     11.6196  58.2375     10.7355  38.8083    324.015     6.97859     324.015     
1 1 1 22 10 62 o 8  30.042  6.13736 17.3271     10.4388  18.3663     9.13354  15.2546    347.388     2.84341     167.388     
1 1 1 22 10 63 o 16 50.6705 4.70498 41.942      11.4943  55.9585     11.5902  31.0606    48.293      1.98429     228.293     
1 1 1 22 10 64 o 10 44.8729 5.03824 38.4452     11.7393  39.386      10.0575  29.0108    218.338     2.46213     218.338     
1 1 1 22 10 65 o 6  25.6098 6.06866 15.048      9.14491  9.98442     9.43111  12.003     33.8295     0.0970258   33.8299     
1 1 1 22 10 66 o 10 65.3065 3.67712 75.5346     12.1024  83.1475     11.7158  37.1801    317.436     9.23695     137.436     
1 1 1 22 10 67 o 15 21.2976 5.7938  4.13215     8.76489  9.50138     8.89174  5.26824    249.682     8.91272     69.6816     
1 1 1 22 10 68 o 4  27.5915 6.46167 17.3036     11.3238  13.7388     9.48985  10.9887    313.828     7.29634     133.828     
1 1 1 22 10 69 o 2  30.1945 6.77471 22.9411     11.6957  15.3776     11.6263  14.196     88.53       6.03407     88.53       
1 1 1 22 10 70 f 0  21.009  6.22057 7.39866     11.2485  0.453263    11.0063  15.34      148.438     0           0           
1 1 1 22 10 71 o 14 23.2542 6.43332 7.20661     11.3727  9.91774     10.4944  7.49851    257.372     1.29348     77.3716     
1 1 1 22 10 72 o 1  45.9059 5.93686 42.2051     13.6454  43.922      12.6284  28.7032    226.582     1.97619     226.582     
1 1 1 22 10 73 f 0  21.9121 6.59575 7.62231     12.7125  -0.0227514  13.0084  13.7239    243.217     0           0           
1 1 1 22 10 74 o 14 32.2964 7.31957 31.674      13.0685  12.1114     16.702   13.5095    115.312     9.77666     295.312     
1 1 1 22 10 75 o 15 27.2893 7.3917  18.5599     12.8827  10.6598     16.4096  10.8431    195.265     6.30312     15.2653     
1 1 1 22 10 76 o 17 26.3921 6.80338 26.4166     12.9675  -10.9745    16.9258  9.25032    21.7508     1.91241     21.7508     
1 1 1 22 10 77 o 2  25.8726 7.52432 18.8448     15.3583  5.48887     17.2022  5.77014    139.387     13.7011     319.387     
1 1 1 22 10 78 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 10 79 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 11 0  o 13 13.7827 5.51868 4.41642     5.87209  4.41642     5.87209  55.7446    180         116.17      180         
1 1 1 22 11 1  o 4  174.148 2.40533 544.023     20.9937  531.66      20.9881  97.1154    268.068     54.5315     88.0681     
1 1 1 22 11 2  o 17 187.128 2.51865 622.866     23.1741  619.219     24.0535  184.733    195.966     111.237     195.966     
1 1 1 22 11 3  o 1  194.87  2.57402 676.333     26.1166  670.721     24.1263  192.206    58.8369     113.448     58.8369     
1 1 1 22 11 4  o 9  282.767 2.97481 1408.19     42.9207  1429.12     41.3615  212.374    194.139     13.3372     194.139     
1 1 1 22 11 5  o 15 214.095 2.70692 802.287     29.0233  823.912     29.0593  140.198    215.217     28.1784     35.2168     
1 1 1 22 11 6  o 9  23.9196 4.91495 13.9035     6.49063  6.51896     6.4123   22.3138    353.193     51.4102     353.193     
1 1 1 22 11 7  o 14 68.055  2.70438 81.0204     9.19796  83.8194     9.17188  12.3467    92.932      52.0188     272.932     
1 1 1 22 11 8  o 17 313.164 3.38429 1717.01     53.0722  1764.78     53.1472  231.436    119.461     6.31919     119.461     
1 1 1 22 11 9  o 2  124.737 2.43103 281.283     15.1049  271.067     15.2523  85.8916    333.537     4.47725     333.537     
1 1 1 22 11 10 f 0  250.346 2.97022 1144.97     37.2094  1079.58     37.2921  148.222    251.948     0           0           
1 1 1 22 11 11 o 10 142.046 2.61813 363.035     17.6698  353.071     19.5098  98.0463    111.655     0.365011    111.655     
1 1 1 22 11 12 o 7  117.167 2.46175 244.192     14.006   243.189     14.8567  86.412     84.3831     21.6101     84.3831     
1 1 1 22 11 13 o 7  307.655 3.18843 1701.51     49.1071  1658.38     49.2032  276.48     189.274     107.686     189.274     
1 1 1 22 11 14 o 13 215.36  2.65852 823.036     28.6143  822.434     28.7701  164.467    254.994     21.1364     254.994     
1 1 1 22 11 15 o 2  165.449 2.53067 479.892     21.2038  491.201     20.7516  95.2991    194.503     43.3499     14.5028     
1 1 1 22 11 16 f 0  151.425 2.44901 417.16      18.4252  396.339     18.7255  131.48     250.403     0           0           
1 1 1 22 11 17 o 12 39.297  4.22109 31.856      7.66396  24.5068     8.24058  14.582     290.858     52.7809     290.858     
1 1 1 22 11 18 o 10 144.432 2.53363 379.306     18.0516  361.106     18.5839  63.8789    289.806     75.1571     109.806     
1 1 1 22 11 19 o 5  75.2681 2.73909 104.861     9.82413  96.7775     10.701   33.171     129.716     2.77568     129.716     
1 1 1 22 11 20 o 2  271.173 3.08093 1336.74     41.7169  1274        41.9951  245.834    299.463     103.174     299.463     
1 1 1 22 11 21 f 0  187.83  2.6328  633.445     24.6971  618.431     24.8627  129.695    190.916     0           0           
1 1 1 22 11 22 o 11 114.112 2.71627 237.397     14.2471  225.298     16.6119  85.6804    198.035     24.079      198.035     
1 1 1 22 11 23 o 12 127.355 2.50078 281.913     15.3003  294.066     16.5858  75.6394    44.0867     23.0595     224.087     
1 1 1 22 11 24 o 9  34.1654 4.65769 24.9368     7.61766  18.2064     7.71512  29.6499    359.7       87.4014     359.7       
1 1 1 22 11 25 o 16 115.281 2.51025 245.805     14.3888  226.429     14.5551  42.7049    45.4726     73.551      225.473     
1 1 1 22 11 26 o 7  72.5244 2.92314 91.1585     10.3506  96.2345     10.8113  16.3302    151.205     59.5429     331.205     
1 1 1 22 11 27 o 7  94.2457 3.01492 160.827     12.8823  155.293     15.3622  44.3605    132.17      36.8359     312.17      
1 1 1 22 11 28 o 4  80.1183 2.91378 115.825     10.5081  112.746     12.6736  32.7892    116.835     38.5441     296.835     
1 1 1 22 11 29 o 16 163.185 2.67738 476.979     20.8846  468.513     22.8427  109.099    147.282     11.4855     327.282     
1 1 1 22 11 30 o 16 161.608 2.63021 485.002     19.7924  443.085     22.5422  110.344    323.088     6.65289     143.088     
1 1 1 22 11 31 o 7  201.171 2.7941  711.793     27.3258  725.749     29.0008  132.756    229.484     19.9223     49.4845     
1 1 1 22 11 32 f 0  127.892 2.57243 280.968     16.046   300.54      16.8987  64.9581    323.276     0           0           
1 1 1 22 11 33 o 19 158.291 2.56183 438.916     19.7767  451.082     20.8647  65.8069    263.138     91.6373     83.1379     
1 1 1 22 11 34 o 14 214.117 2.89205 808.659     30.9033  821.111     31.1618  185.299    346.178     69.0142     346.178     
1 1 1 22 11 35 o 2  141.819 2.51962 369.306     17.347   345.669     18.3848  115.599    165.115     35.7189     165.115     
1 1 1 22 11 36 o 4  176.082 2.64878 552.084     24.1009  549.95      22.6251  146.174    153.727     46.6431     153.727     
1 1 1 22 11 37 o 18 65.0377 3.16393 77.3691     9.73437  73.9426     10.7107  33.5368    46.7177     13.4144     226.718     
1 1 1 22 11 38 o 10 123.179 2.43996 268.288     14.8304  271.427     15.2628  100.616    54.2347     33.7655     54.2347     
1 1 1 22 11 39 o 11 28.2739 5.22656 12.8976     7.3788   16.9337     7.65644  13.9454    272.055     53.0139     272.055     
1 1 1 22 11 40 o 16 130.389 2.48944 299.434     16.003   305.684     16.5009  99.4229    308.627     20.0754     308.627     
1 1 1 22 11 41 o 4  15.8657 4.55323 6.68491     6.7489   -12.0781    6.7819   12.6181    58.0509     29.9929     58.0509     
1 1 1 22 11 42 o 6  239.815 2.8964  1016.52     34.7437  1033.43     34.8738  175.475    86.9052     15.8537     86.9052     
1 1 1 22 11 43 o 9  93.8146 2.92324 151.956     13.7433  162.608     13.6607  60.2421    20.3086     4.61236     200.309     
1 1 1 22 11 44 o 8  46.219  4.11593 39.2532     9.18818  38.6216     9.45088  17.9735    235.562     13.0414     55.5617     
1 1 1 22 11 45 o 10 18.3818 5.18092 7.42442     7.43831  -5.76578    8.4068   3.29196    160.761     9.3332      160.761     
1 1 1 22 11 46 o 16 54.1479 3.89122 54.8707     9.22182  51.5079     11.3719  21.4653    281.166     26.0817     101.166     
1 1 1 22 11 47 o 7  65.7347 3.17874 72.9688     9.85306  82.5079     10.9732  38.3799    329.294     9.74015     149.294     
1 1 1 22 11 48 o 6  162.319 2.55533 454.1       20.7692  486.213     20.7853  129.629    119.678     36.0146     119.678     
1 1 1 22 11 49 o 12 60.0293 3.41826 59.3595     9.82793  71.1084     10.5522  54.3388    332.691     39.0647     332.691     
1 1 1 22 11 50 o 6  154.82  2.56134 419.744     19.4533  436.633     20.2937  97.2651    349.582     17.641      169.582     
1 1 1 22 11 51 o 12 42.1334 4.58117 41.7058     9.10931  25.2811     9.16995  7.39902    231.228     39.3033     51.2276     
1 1 1 22 11 52 o 18 95.3631 2.70001 165.291     12.6882  160.887     13.0566  63.6972    201.585     0.969987    21.5854     
1 1 1 22 11 53 o 14 49.5496 3.85433 41.5208     9.0444   48.6118     9.77871  40.8552    267.481     25.3762     267.481     
1 1 1 22 11 54 o 16 36.832  5.16001 24.04       9.46019  27.6969     8.8914   19.8995    264.083     2.83391     84.083      
1 1 1 22 11 55 o 11 43.2031 4.59442 40.3828     9.6405   29.8525     9.4801   10.9974    141.452     33.3342     321.452     
1 1 1 22 11 56 o 4  75.0309 3.43864 100.844     11.9422  103.636     13.7313  60.9172    79.8624     23.8723     79.8624     
1 1 1 22 11 57 o 11 17.1213 5.18779 1.52972     8.58076  -0.843925   7.2928   2.36358    75.6019     16.2867     75.6019     
1 1 1 22 11 58 o 15 52.2418 4.21763 50.4622     11.877   50.7299     9.64212  28.9084    113.278     9.18997     293.278     
1 1 1 22 11 59 o 11 18.1421 5.35823 0.560695    8.87771  2.9831      7.47489  0.589977   340.439     1.95777     160.439     
1 1 1 22 11 60 o 18 78.638  3.34212 111.748     13.7775  113.643     12.386   51.2201    123.295     0.921412    303.295     
1 1 1 22 11 61 o 11 57.0182 3.73125 57.7514     10.7908  62.332      10.2409  35.796     145.703     1.96438     325.703     
1 1 1 22 11 62 o 12 45.8721 4.39829 44.8566     10.2585  35.0588     9.40526  29.2475    202.017     0.851493    202.017     
1 1 1 22 11 63 o 7  42.7439 4.56702 41.9127     9.30143  28.5493     9.34832  19.2821    228.578     15.4411     48.5777     
1 1 1 22 11 64 o 13 19.5865 5.48572 7.70256     8.12795  1.33572     8.24106  2.54015    260.22      14.0197     80.2203     
1 1 1 22 11 65 o 5  53.7864 4.21803 61.3129     11.9472  48.7339     10.4201  48.3112    180.705     31.4182     180.705     
1 1 1 22 11 66 o 6  65.4693 3.63489 72.0117     12.0368  88.0254     11.4305  45.5412    96.3424     7.64779     96.3424     
1 1 1 22 11 67 o 11 36.3893 6.00064 27.5954     11.8823  27.0414     9.61844  19.4281    79.8726     3.87898     259.873     
1 1 1 22 11 68 o 14 31.8312 6.63623 21.3882     11.7856  21.7221     10.8502  14.8701    136.946     8.04187     136.946     
1 1 1 22 11 69 o 16 50.2534 5.81578 51.8572     13.7241  50.602      14.5273  25.1959    221.336     11.8338     41.3355     
1 1 1 22 11 70 f 0  44.2176 6.39927 42.0869     13.3535  39.6855     14.0418  33.9045    34.4385     0           0           
1 1 1 22 11 71 o 13 49.8709 6.01336 45.5529     13.84    56.6624     15.1368  26.5818    118.209     8.53652     298.209     
1 1 1 22 11 72 o 15 26.5657 6.89528 3.48321     11.9868  22.8056     13.575   7.1726     75.9952     15.3919     255.995     
1 1 1 22 11 73 o 3  24.6768 6.70039 -0.420188   12.3001  19.5266     12.8596  8.51425    4.86229     8.5408      184.862     
1 1 1 22 11 74 o 17 21.53   6.41095 -3.23514    12.2874  11.3093     12.3065  4.96147    249.587     9.6921      69.5875     
1 1 1 22 11 75 o 1  31.6453 7.3843  19.7057     14.0097  27.9922     13.5978  15.2485    285.943     2.59649     105.943     
1 1 1 22 11 76 o 2  39.4236 7.25206 37.7497     14.3868  36.6345     14.5424  25.6193    236.786     14.7723     236.786     
1 1 1 22 11 77 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 12 0  o 5  103.791 2.39138 191.569     12.4086  191.569     12.4086  85.2365    360         50.6643     360         
1 1 1 22 12 1  o 13 70.9532 2.66736 88.5834     9.47008  90.5373     9.4293   26.2888    264.498     13.4718     84.4984     
1 1 1 22 12 2  o 1  193.4   2.51821 660.865     24.3679  665.997     24.4455  149.321    1.01238     22.4132     1.01238     
1 1 1 22 12 3  o 7  191.754 2.58624 638.786     24.8532  665.798     24.8439  129.977    93.6732     15.1058     273.673     
1 1 1 22 12 4  o 4  214.844 2.64156 822.515     28.9354  815.091     27.9419  117.464    58.4956     76.5636     238.496     
1 1 1 22 12 5  o 1  187.262 2.48699 627.782     23.3369  616.194     23.3397  142.31     42.8472     17.7902     42.8472     
1 1 1 22 12 6  o 8  222.136 2.58026 874.506     28.6986  876.056     28.7489  148.915    199.186     23.5078     19.1857     
1 1 1 22 12 7  o 8  334.229 3.30353 1987.38     56.3517  1978.59     54.299   192.096    292.938     106.022     112.938     
1 1 1 22 12 8  o 2  68.1663 2.82746 81.0681     9.77764  84.4001     9.44193  20.5265    1.19828     30.0579     181.198     
1 1 1 22 12 9  o 17 164.219 2.49434 484.205     20.4874  472.5       20.5645  107.956    58.6411     16.6921     238.641     
1 1 1 22 12 10 o 5  113.786 2.62257 241.925     14.8851  218.217     14.9503  87.2813    134.749     29.6845     134.749     
1 1 1 22 12 11 o 19 46.7217 3.74767 46.3806     8.07172  32.7665     8.76107  43.2458    250.793     141.148     250.793     
1 1 1 22 12 12 o 8  170.889 2.63589 535.718     22.5399  500.708     22.5865  89.0238    115.744     66.2617     295.744     
1 1 1 22 12 13 o 11 142.316 2.47337 359.154     16.7643  359.592     18.4595  120.963    87.3983     49.3926     87.3983     
1 1 1 22 12 14 o 13 246.136 2.81797 1081.9      33.3141  1068.09     36.1282  231.157    62.7089     109.384     62.7089     
1 1 1 22 12 15 o 17 208.542 2.72608 780.538     27.7871  762.778     29.1577  91.6014    45.8628     118.28      225.863     
1 1 1 22 12 16 o 7  345.517 3.55154 2161.77     60.1768  2079.28     62.7211  264.276    48.5045     25.0897     48.5045     
1 1 1 22 12 17 o 15 60.5898 3.16981 73.2267     9.46472  58.2603     9.53622  18.3365    323.11      112.729     323.11      
1 1 1 22 12 18 o 1  271.824 3.02723 1320.29     41.9797  1302.87     40.4907  199.589    87.5093     5.77966     87.5093     
1 1 1 22 12 19 o 11 216.146 2.74952 848.921     30.2052  809.452     29.3617  174.291    139.092     39.63       139.092     
1 1 1 22 12 20 o 11 49.508  3.69522 47.4707     8.89262  40.7318     9.09713  23.702     57.4235     105.482     57.4235     
1 1 1 22 12 21 o 5  205.077 2.75533 733.371     28.6767  759.581     27.9332  137.532    349.238     18.7156     169.238     
1 1 1 22 12 22 o 14 258.068 3.19318 1220.15     41.0707  1146.03     41.4787  191.859    34.4832     11.7081     34.4832     
1 1 1 22 12 23 o 15 286.902 3.31035 1463.56     45.2576  1461.08     49.8193  251.522    146.211     89.6772     146.211     
1 1 1 22 12 24 o 15 20.5378 5.13771 -5.12335    6.74833  13.8351     8.62899  21.238     185.319     49.9458     185.319     
1 1 1 22 12 25 o 18 281.453 3.27646 1448.61     47.0597  1367.13     45.3721  200.311    213.566     5.41156     33.5654     
1 1 1 22 12 26 o 19 153.723 2.60807 420.708     19.9078  418.265     20.2728  89.0646    251.776     39.7887     71.7762     
1 1 1 22 12 27 o 19 194.662 2.75504 693.16      25.4645  652.93      28.1238  139.424    271.604     1.11268     271.604     
1 1 1 22 12 28 o 16 33.0689 5.04611 16.932      7.99607  23.7943     8.27794  3.42295    113.735     22.513      113.735     
1 1 1 22 12 29 o 16 99.1744 2.64533 185.758     12.9952  164.411     13.2011  84.925     192.017     42.1636     192.017     
1 1 1 22 12 30 o 9  192.931 2.63926 677.317     24.9375  645.176     26.0476  150.219    148.141     26.6901     148.141     
1 1 1 22 12 31 o 5  230.829 2.88551 958.902     34.6478  935.241     32.0888  158.649    95.9806     12.1624     275.981     
1 1 1 22 12 32 o 19 169.264 2.57501 521.037     20.731   497.049     22.8432  115.818    130.051     7.36748     310.051     
1 1 1 22 12 33 o 18 155.331 2.48998 426.351     18.8512  430.916     19.905   143.843    131.556     72.3358     131.556     
1 1 1 22 12 34 o 9  74.5178 2.85668 88.2164     10.1935  110.493     11.0379  56.8341    183.882     31.7085     183.882     
1 1 1 22 12 35 o 12 97.9848 2.73553 173.336     13.1644  168.68      13.6353  51.1254    307.076     31.7681     127.076     
1 1 1 22 12 36 o 10 224.435 2.81868 909.71      29.497   882.857     33.6978  178.169    214.132     39.0777     214.132     
1 1 1 22 12 37 o 14 48.501  3.95138 45.8459     8.64185  39.4558     9.97819  20.9921    170.15      1.16627     170.15      
1 1 1 22 12 38 o 12 109.039 2.7824  216.692     14.0496  207.229     16.1768  80.0807    283.067     11.6291     283.067     
1 1 1 22 12 39 o 4  93.2907 3.01309 159.472     13.029   151.485     14.9427  26.0394    57.7048     23.0582     57.7048     
1 1 1 22 12 40 o 12 49.471  4.12319 46.637      9.03499  42.361      10.7877  23.5662    9.23766     4.21921     189.238     
1 1 1 22 12 41 o 8  141.711 2.98966 357.893     19.2908  359.243     22.9662  109.606    264.731     23.8333     264.731     
1 1 1 22 12 42 o 19 96.4306 2.93107 167.651     12.9828  164.765     15.17    58.9815    220.695     12.2797     40.695      
1 1 1 22 12 43 o 11 48.2873 3.77916 40.0949     8.70343  44.5845     9.28287  22.1299    205.994     12.266      25.9943     
1 1 1 22 12 44 o 16 109.673 2.57485 219.575     14.2866  209.776     13.9776  85.9034    259.019     22.4489     259.019     
1 1 1 22 12 45 o 9  45.3848 3.84482 42.5662     8.43901  32.8112     8.54177  24.0871    274.797     7.22351     94.7969     
1 1 1 22 12 46 o 17 52.8475 3.54667 52.6544     8.80024  48.5294     9.67875  14.5146    86.2529     41.2758     266.253     
1 1 1 22 12 47 o 6  59.376  3.3738  70.6787     9.22084  57.0212     10.4046  32.0685    67.9377     14.5312     247.938     
1 1 1 22 12 48 o 14 72.4715 3.13023 95.6943     10.3417  93.3655     12.1782  49.8842    222.783     2.89767     222.783     
1 1 1 22 12 49 o 1  51.0238 4.18486 42.567      9.20905  53.3266     11.8254  26.6448    192.791     12.8516     12.7911     
1 1 1 22 12 50 o 2  119.03  2.78336 251.52      16.3695  256.706     16.7911  86.4074    187.245     10.4275     187.245     
1 1 1 22 12 51 o 17 51.623  3.98875 46.9104     9.91212  50.9421     10.3913  32.4159    341.536     1.39598     161.536     
1 1 1 22 12 52 o 5  65.186  3.43476 78.9074     10.7912  75.3724     11.4545  52.8933    96.1843     21.0992     96.1843     
1 1 1 22 12 53 f 0  90.3235 2.99745 153.221     13.3599  141.041     13.6662  46.7945    93.2505     0           0           
1 1 1 22 12 54 o 18 43.2709 4.62713 37.7785     10.2286  32.5439     9.22213  31.8659    359.924     12.997      359.924     
1 1 1 22 12 55 o 16 20.4626 5.5468  8.26697     8.41166  2.87794     7.71743  0.339331   56.7477     17.3165     236.748     
1 1 1 22 12 56 o 7  39.1333 4.85951 24.9181     9.21243  33.5143     9.03678  17.5212    232.402     13.6049     52.4025     
1 1 1 22 12 57 o 3  65.891  3.68068 82.7845     11.6142  76.2616     12.4227  42.3384    118.154     1.83991     298.154     
1 1 1 22 12 58 o 17 34.3565 5.45751 18.22       9.75193  27.9551     8.72094  17.7661    312.448     5.63738     132.448     
1 1 1 22 12 59 o 7  22.4939 5.44325 3.08691     7.84623  13.658      7.87566  7.80925    341.577     2.2467      161.577     
1 1 1 22 12 60 o 18 20.7388 5.60319 8.28594     8.37275  4.20094     7.96932  0.587498   345.181     21.4782     165.181     
1 1 1 22 12 61 f 0  72.1593 3.29038 95.251      12.2373  95.6364     11.4141  39.6712    11.814      0           0           
1 1 1 22 12 62 o 2  35.0868 5.66378 17.2766     9.34268  33.0179     10.4533  19.8762    7.01076     14.7272     7.01076     
1 1 1 22 12 63 o 15 22.1222 5.7302  1.65616     8.15466  14.0055     9.3646   3.49593    65.9203     17.0973     245.92      
1 1 1 22 12 64 o 11 29.4076 6.57063 18.2526     10.565   17.5592     11.125   15.6083    31.6601     0.486723    211.66      
1 1 1 22 12 65 o 6  34.069  6.2348  32.7083     11.38    16.1952     10.7999  21.7329    6.74637     5.80846     6.74637     
1 1 1 22 12 66 o 15 50.7844 5.26027 58.3106     12.8617  44.2117     12.8702  35.0437    287.394     7.25828     287.394     
1 1 1 22 12 67 o 15 70.0159 3.9788  88.489      14.6973  96.6575     12.7624  49.2586    350.56      9.57467     350.56      
1 1 1 22 12 68 o 8  24.533  6.08906 1.38445     11.1818  17.8876     9.56906  6.52128    212.441     1.45969     212.441     
1 1 1 22 12 69 o 14 21.6456 6.22989 -2.14395    10.8974  11.66       11.3456  4.39512    1.8454      13.096      181.845     
1 1 1 22 12 70 o 12 39.9831 6.51512 41.9497     12.8324  26.5482     13.04    23.0417    212.696     1.99507     32.6957     
1 1 1 22 12 71 o 5  24.4366 6.60981 1.20736     12.2532  17.4971     11.9238  10.6578    237.944     1.10358     237.944     
1 1 1 22 12 72 o 9  21.7052 6.21884 -7.35268    11.8645  14.4896     11.5487  5.74298    203.965     9.86439     23.9647     
1 1 1 22 12 73 o 2  19.3799 6.13355 -4.28806    11.8734  3.28689     12.7484  3.1133     221.841     3.49653     41.841      
1 1 1 22 12 74 o 6  20.3111 6.34507 5.70492     12.4746  -2.76648    13.2965  1.94752    199.359     1.79925     19.3594     
1 1 1 22 12 75 o 2  28.3735 7.41551 21.1713     13.5024  17.0609     14.6356  11.1689    64.7291     3.56349     244.729     
1 1 1 22 12 76 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 13 0  o 2  110.755 2.43864 218.093     13.5056  218.093     13.5056  106.091    180         61.8021     180         
1 1 1 22 13 1  o 12 154.708 2.34665 427.641     18.1797  421.385     18.2067  94.9568    266.029     30.0738     86.0287     
1 1 1 22 13 2  o 9  305.979 3.20223 1648.82     49.9956  1675.22     48.1758  223.781    176.506     1.15648     356.506     
1 1 1 22 13 3  o 16 104.757 2.47325 195.046     12.3427  194.708     13.5588  58.179     306.789     24.0546     126.789     
1 1 1 22 13 4  o 14 204.222 2.73871 749.656     27.3682  730.409     28.6547  151.885    288.273     9.13754     288.273     
1 1 1 22 13 5  o 12 148.847 2.52892 412.158     18.8284  374.583     18.8501  95.9915    194.427     18.3596     14.4271     
1 1 1 22 13 6  o 17 222.219 2.60626 869.645     28.4409  882.528     29.6031  158.557    70.8409     5.18321     250.841     
1 1 1 22 13 7  o 14 135.843 2.46356 348.537     16.3364  307.041     17.0806  27.2965    136.111     139.737     316.111     
1 1 1 22 13 8  o 8  171.982 2.46663 528.635     20.7795  520.74      21.7205  120.824    245.869     3.82154     65.8691     
1 1 1 22 13 9  o 15 31.7185 4.69659 14.0013     7.00056  23.5632     7.51288  40.7031    282.223     108.206     282.223     
1 1 1 22 13 10 o 9  283.817 3.10404 1440.15     44.1249  1419.8      44.1721  178.044    318.168     59.1455     138.168     
1 1 1 22 13 11 o 14 121.233 2.45362 265.248     14.2291  256.659     15.502   103.507    128.663     49.878      128.663     
1 1 1 22 13 12 o 18 162.356 2.58195 468         21.3756  467.358     20.6336  133.792    26.5672     39.4674     26.5672     
1 1 1 22 13 13 o 18 61.2542 3.20876 64.5227     9.27007  69.4949     10.2908  16.0679    279.828     30.2253     99.8276     
1 1 1 22 13 14 o 18 245.329 2.99321 1071.42     35.307   1065.45     38.226   183.837    249.46      11.7483     249.46      
1 1 1 22 13 15 o 3  260.057 2.99471 1226.4      38.9585  1175.13     39.0826  170.527    274.823     37.5291     94.823      
1 1 1 22 13 16 o 8  268.621 3.11631 1290.22     41.8749  1272.41     42.0239  192.499    254.32      5.8164      74.3198     
1 1 1 22 13 17 o 8  141.055 2.63249 350.857     18.5085  355.835     18.6763  87.5462    311.926     23.9642     131.926     
1 1 1 22 13 18 o 18 382.78  3.97316 2663.33     76.1875  2549.37     76.2163  286.828    264.347     14.0723     264.347     
1 1 1 22 13 19 o 17 280.345 3.04055 1410        40.9392  1381.64     44.387   236.264    294.218     65.7285     294.218     
1 1 1 22 13 20 o 14 222.328 2.74459 890.682     29.2414  864.476     31.8191  165.531    89.7842     10.0488     89.7842     
1 1 1 22 13 21 o 16 103.771 2.62478 189.462     12.7932  193.344     14.4282  17.5493    277.241     110.956     97.2415     
1 1 1 22 13 22 o 4  165.817 2.5512  493.05      21.5484  483.094     20.851   94.1884    192.734     49.3682     12.734      
1 1 1 22 13 23 f 0  267.286 3.11535 1262.77     39.7943  1276.13     43.5967  155.38     6.78668     0           0           
1 1 1 22 13 24 o 14 33.3869 4.89005 17.2527     7.70413  24.2121     8.14415  3.86316    255.506     26.0469     255.506     
1 1 1 22 13 25 o 7  21.8218 5.54673 3.40944     8.33131  9.89211     7.60886  47.7878    242.171     115.657     242.171     
1 1 1 22 13 26 f 0  166.403 2.60892 484.279     21.3701  499.34      22.1435  94.1025    68.6767     0           0           
1 1 1 22 13 27 f 0  54.9246 3.89202 54.7401     10.363   53.8188     10.7648  32.4332    8.98098     0           0           
1 1 1 22 13 28 f 0  149.896 2.62192 405.622     19.2517  393.022     20.0956  90.7565    46.4528     0           0           
1 1 1 22 13 29 o 11 97.2057 2.72588 170.383     12.6294  166.005     13.8296  80.7709    31.0471     33.4759     31.0471     
1 1 1 22 13 30 o 1  54.4627 3.75142 46.4369     9.65983  60.7843     10.505   18.8865    239.875     6.65025     239.875     
1 1 1 22 13 31 o 10 105.311 2.81164 201.586     14.2277  193.444     15.3457  56.4361    234.831     33.1805     54.8307     
1 1 1 22 13 32 o 8  80.4272 2.85441 120.264     11.326   110.55      11.5813  53.9688    43.6932     2.45085     43.6932     
1 1 1 22 13 33 o 6  25.1992 5.57646 12.2645     7.80361  10.3979     7.87388  3.07527    165.768     11.7501     165.768     
1 1 1 22 13 34 o 16 76.671  3.12447 104.753     12.3897  105.389     11.4982  40.8678    320.4       32.2831     320.4       
1 1 1 22 13 35 o 15 86.5585 3.05837 147.023     12.6191  121.251     13.6132  70.3358    82.2311     27.6123     82.2311     
1 1 1 22 13 36 o 5  83.5358 2.96999 126.584     12.0637  122.751     12.7018  60.5231    324.696     10.767      324.696     
1 1 1 22 13 37 o 3  32.3007 5.57522 22.1088     8.40705  17.0087     9.59942  0.680914   155.471     3.02115     335.471     
1 1 1 22 13 38 f 0  64.0855 3.36937 77.7983     10.405   69.8693     11.0105  25.8192    312.149     0           0           
1 1 1 22 13 39 o 3  78.3186 2.96375 110.586     11.0524  108.907     12.0935  66.052     145.831     36.0692     145.831     
1 1 1 22 13 40 o 16 132.175 2.52747 314.62      16.5203  308.22      16.9239  113.045    109.552     44.1569     109.552     
1 1 1 22 13 41 o 18 59.6998 3.37653 65.8628     9.52369  62.5196     10.4538  35.3178    70.6067     5.09069     250.607     
1 1 1 22 13 42 f 0  27.4721 5.35163 19.0009     7.53644  8.64412     8.40128  22.665     262.19      0           0           
1 1 1 22 13 43 o 11 100.042 2.79407 183.529     12.962   174.52      14.873   68.7146    64.8524     0.337054    244.853     
1 1 1 22 13 44 o 9  44.2679 4.20048 34.3715     8.42839  37.6134     9.73376  25.3251    100.496     4.69303     280.496     
1 1 1 22 13 45 o 18 130.75  2.93585 315.693     16.8396  296.943     21.175   102.924    168.843     24.7679     168.843     
1 1 1 22 13 46 o 8  47.2677 4.29317 43.0055     9.27191  39.2651     10.4588  15.7345    68.8793     30.6204     248.879     
1 1 1 22 13 47 o 18 45.1753 4.39982 40.3912     9.45471  35.1764     9.85295  20.9546    213.196     16.1945     33.1955     
1 1 1 22 13 48 o 19 57.7438 3.54648 57.7372     10.1213  63.5021     10.1835  46.4548    277.8       18.8075     277.8       
1 1 1 22 13 49 o 9  16.3813 4.83993 -9.85043    8.21865  5.33345     6.82286  2.80525    15.4356     13.4033     15.4356     
1 1 1 22 13 50 o 18 44.5611 4.61604 37.4628     10.6027  36.7155     9.36739  15.4516    288.503     26.9576     108.503     
1 1 1 22 13 51 f 0  41.7527 4.61414 35.503      9.85227  29.9879     8.8349   24.4402    248.057     0           0           
1 1 1 22 13 52 o 15 50.8407 3.92192 56.6275     9.78394  39.268      9.59623  28.5807    337.596     8.9118      157.596     
1 1 1 22 13 53 o 7  64.7025 3.38072 76.3645     10.9226  75.8825     10.8466  60.3158    227.04      38.1841     227.04      
1 1 1 22 13 54 o 1  39.2954 4.91221 25.1978     9.41593  33.775      9.09525  22.5208    186.058     3.07539     6.05842     
1 1 1 22 13 55 o 10 46.6131 4.2139  35.7206     9.54714  45.4611     9.54716  31.2016    285.29      3.40491     285.29      
1 1 1 22 13 56 o 6  28.2536 5.81949 18.3406     8.27557  12.324      9.58972  9.14165    126.542     14.6279     306.542     
1 1 1 22 13 57 o 18 118.021 2.73994 228.683     15.3054  275.217     17.0728  76.0324    326.636     6.84467     146.636     
1 1 1 22 13 58 o 6  31.5539 5.86914 15.2629     8.69805  24.8509     10.2921  6.16947    69.7978     27.0845     249.798     
1 1 1 22 13 59 o 7  49.6213 4.42472 51.0238     9.80069  42.2878     11.3362  39.547     33.9163     16.3645     33.9163     
1 1 1 22 13 60 o 6  23.0677 6.07403 8.82106     8.32853  9.0947      10.5015  6.50237    223.692     11.9728     43.6921     
1 1 1 22 13 61 o 10 26.7333 6.35253 13.7547     9.23289  14.4134     10.8984  12.0396    117.294     5.2063      297.294     
1 1 1 22 13 62 o 16 20.035  5.64439 8.54202     8.68123  0.667744    8.87829  5.00741    333.371     3.46855     153.371     
1 1 1 22 13 63 o 9  24.3215 6.06983 10.7031     9.01335  11.7525     9.41706  5.75792    241.278     15.5918     61.2779     
1 1 1 22 13 64 o 19 21.8836 5.97398 9.17208     8.87193  5.66718     9.88894  4.5678     189.062     12.6395     9.06158     
1 1 1 22 13 65 o 11 32.203  6.85938 33.5067     13.7768  11.5357     11.5691  12.2389    7.42876     13.1776     187.429     
1 1 1 22 13 66 o 2  22.755  6.27546 8.81156     10.8592  7.98867     9.79099  6.05836    135.74      1.83487     315.74      
1 1 1 22 13 67 o 10 23.2962 6.31943 9.41579     11.2956  9.12425     9.42204  8.08855    153.598     5.10098     333.598     
1 1 1 22 13 68 o 18 39.7068 6.30232 31.4741     12.4016  34.8196     12.0754  23.2595    354.67      1.56684     174.67      
1 1 1 22 13 69 o 15 55.6399 4.96786 59.9422     13.731   62.0872     13.3358  32.0993    199.974     6.03167     19.9742     
1 1 1 22 13 70 o 3  31.9996 6.89107 21.6941     12.3662  23.698      11.7721  20.6143    86.066      7.92087     86.066      
1 1 1 22 13 71 o 15 23.5328 6.54364 15.996      12.3117  2.30174     11.1199  8.44031    17.263      1.1021      17.263      
1 1 1 22 13 72 o 6  24.7988 6.76983 4.7245      13.049   17.6413     12.0212  6.64462    82.255      1.53167     82.255      
1 1 1 22 13 73 o 5  20.3461 6.29132 -15.332     15.1715  10.4495     12.1753  3.20192    19.1285     6.96232     199.129     
1 1 1 22 13 74 f 0  19.3877 6.14927 6.19827     12.9006  -7.04028    12.404   6.53912    272.049     0           0           
1 1 1 22 13 75 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 14 0  o 4  468.475 4.45781 3899.1      104.614  3899.1      104.614  460.511    1.65822e-06 224.743     1.65822e-06 
1 1 1 22 14 1  o 18 187.19  2.69592 621.875     25.3162  621.782     25.2641  123.639    27.8816     23.7831     207.882     
1 1 1 22 14 2  o 2  292.208 3.23769 1516.41     47.404   1516.27     47.4201  221.244    316.1       13.2559     316.1       
1 1 1 22 14 3  o 15 161.558 2.51702 464.544     19.9396  461.661     20.8055  81.7164    105.449     69.724      285.449     
1 1 1 22 14 4  o 5  200.825 2.78462 708.88      26.745   722.764     29.27    173        61.424      56.5703     61.424      
1 1 1 22 14 5  o 7  198.917 2.74236 714.449     27.2972  690.147     27.3703  129.586    259.961     29.851      79.9605     
1 1 1 22 14 6  o 18 112.127 2.55345 235.221     13.7904  211.722     14.7689  97.5492    218.79      53.9271     218.79      
1 1 1 22 14 7  o 3  84.4268 2.68661 128.777     10.9274  124.748     11.7189  21.3751    292.356     71.3979     112.356     
1 1 1 22 14 8  o 7  43.859  3.84497 32.1697     7.98153  37.3644     8.55461  8.15059    316.693     57.3632     316.693     
1 1 1 22 14 9  o 6  172.533 2.5288  534.357     21.0881  522.108     22.5956  103.446    271.273     42.3884     91.2735     
1 1 1 22 14 10 o 5  281.679 3.28529 1397.93     45.4938  1421.02     47.2523  222.936    124.11      33.2955     124.11      
1 1 1 22 14 11 o 17 305.653 3.23813 1645.33     46.6068  1673.84     52.4665  246.671    271.195     45.0779     271.195     
1 1 1 22 14 12 o 18 200.309 2.6916  723.505     26.032   701.013     27.9372  138.431    25.6984     13.8693     205.698     
1 1 1 22 14 13 o 15 123.792 2.53674 270.931     15.4846  273.473     15.9551  50.2326    103.372     75.8263     283.372     
1 1 1 22 14 14 o 17 60.0508 3.25539 66.3869     9.18396  62.5343     10.1909  8.12153    239.467     94.9242     239.467     
1 1 1 22 14 15 o 1  176.044 2.56386 547.222     21.8156  552.962     23.4024  150.597    185.997     48.9837     185.997     
1 1 1 22 14 16 o 12 36.221  4.58811 18.9512     7.72353  29.7563     8.24003  3.69647    259.747     29.7696     259.747     
1 1 1 22 14 17 o 2  56.8345 3.44525 50.1582     9.66247  66.088      9.60575  11.4581    277.013     97.9459     277.013     
1 1 1 22 14 18 o 6  258.817 3.08504 1199.85     39.3041  1180.63     40.6985  194.319    60.9174     11.1018     60.9174     
1 1 1 22 14 19 o 16 175.389 2.72    570.963     23.4318  522.136     24.3001  115.542    136.019     22.1431     316.019     
1 1 1 22 14 20 o 18 174.546 2.68575 555.086     21.9988  527.202     24.8166  167.064    232.541     85.6857     232.541     
1 1 1 22 14 21 o 4  117.341 2.61584 249.773     14.7417  239.811     15.9315  47.5526    89.7013     71.7486     269.701     
1 1 1 22 14 22 o 12 92.7976 2.89718 161.393     12.8701  145.471     13.9054  65.3588    125.141     5.57565     125.141     
1 1 1 22 14 23 o 2  93.5938 2.74327 158.024     12.4674  153.807     13.1884  54.2122    130.276     20.1618     310.276     
1 1 1 22 14 24 o 17 96.0274 2.79472 170.105     13.0206  158.314     13.7682  80.8549    309.539     35.0527     309.539     
1 1 1 22 14 25 o 8  49.4254 4.15363 50.6545     9.4841   38.1705     10.3256  18.3593    256.897     11.9293     76.8972     
1 1 1 22 14 26 o 13 43.4976 4.34877 30.5069     9.12676  38.6277     9.19806  18.7379    196.159     92.4799     196.159     
1 1 1 22 14 27 o 6  92.4378 2.70692 159.861     12.298   144.64      12.68    75.6417    258.847     29.0253     258.847     
1 1 1 22 14 28 o 14 31.7438 5.17952 23.6043     7.67031  13.9592     8.68911  0.166978   120.695     7.50776     120.696     
1 1 1 22 14 29 o 17 60.4886 3.2633  67.9648     9.39721  63.1805     10.1779  21.1968    348.238     35.8975     168.238     
1 1 1 22 14 30 o 6  35.6571 5.06257 22.263      8.53137  25.03       8.93642  3.84479    352.629     14.3306     172.629     
1 1 1 22 14 31 o 4  87.2191 3.13656 140.572     13.3477  131.288     13.9408  68.6608    354.713     21.5098     354.713     
1 1 1 22 14 32 o 13 121.263 2.89788 263.928     17.2474  260.424     17.9111  81.221     121.132     7.61239     301.132     
1 1 1 22 14 33 o 14 117.398 2.98253 246.587     17.5589  245.279     17.4784  63.1288    8.49293     38.6297     188.493     
1 1 1 22 14 34 o 1  156.748 3.07158 448.232     22.6737  428.961     25.3865  124.744    354.947     28.4413     354.947     
1 1 1 22 14 35 o 7  141.15  2.79863 364.089     19.4168  346.7       20.1042  129.343    348.814     62.4319     348.814     
1 1 1 22 14 36 o 15 102.134 2.81188 182.744     14.4493  189.802     14.2721  65.6553    301.103     9.37493     121.103     
1 1 1 22 14 37 o 10 48.4404 4.18222 42.26       9.64565  43.2915     10.235   23.0119    311.778     7.25471     131.778     
1 1 1 22 14 38 o 15 49.4674 3.89915 47.8551     9.32094  41.1739     9.60111  19.1634    30.8123     22.9263     210.812     
1 1 1 22 14 39 o 13 30.8661 5.48066 23.3093     8.77446  12.8465     8.49102  9.49064    126.373     55.0134     126.373     
1 1 1 22 14 40 o 4  50.5524 3.74059 48.2158     8.96441  44.5803     9.64563  20.9962    111.301     23.8007     291.301     
1 1 1 22 14 41 o 4  154.512 2.64825 443.746     19.7817  409.082     21.1075  139.009    93.1694     61.4399     93.1694     
1 1 1 22 14 42 o 11 79.6814 3.25274 111.728     12.5219  116.695     13.3451  65.5739    173.624     22.8732     173.624     
1 1 1 22 14 43 o 7  94.5555 2.91198 172.695     13.1691  148.416     14.1974  78.7467    314.125     27.5651     314.125     
1 1 1 22 14 44 o 10 87.7489 2.91129 131.735     12.4413  144.865     13.0928  44.3602    346.591     32.5941     166.591     
1 1 1 22 14 45 o 3  108.269 2.89729 216.885     15.8149  204.032     15.5641  82.4045    274.9       15.2005     274.9       
1 1 1 22 14 46 o 15 79.954  3.05311 109.912     12.5919  120.516     11.7009  67.4634    162.697     26.9799     162.697     
1 1 1 22 14 47 o 5  55.7147 3.50449 57.6816     9.8913   55.3        9.47546  38.9216    60.4882     4.77096     60.4881     
1 1 1 22 14 48 o 15 106.686 2.67804 218.028     14.5045  191.06      14.0644  91.8763    139.627     37.783      139.627     
1 1 1 22 14 49 o 18 75.7648 3.07054 93.3453     11.5416  114.576     11.5826  59.3082    9.2429      16.7162     9.2429      
1 1 1 22 14 50 f 0  33.4484 5.57165 21.7388     8.63152  21.6478     9.74472  8.62486    94.381      0           0           
1 1 1 22 14 51 o 5  19.2084 5.44583 5.70808     7.48333  1.09378     8.77002  0.502665   351.229     12.6735     171.229     
1 1 1 22 14 52 o 5  83.6174 3.34818 131.581     12.0679  122.394     15.4878  59.9301    274.549     7.037       274.549     
1 1 1 22 14 53 o 3  49.9934 4.13761 38.9768     9.34887  54.4387     10.9717  34.8369    135.493     5.29847     135.493     
1 1 1 22 14 54 o 6  33.2939 6.18865 22.3703     9.02934  21.4337     12.033   1.43093    333.201     39.6505     153.201     
1 1 1 22 14 55 o 14 67.0777 3.65071 75.4781     10.9113  90.1508     13.4611  47.073     150.793     4.89016     150.793     
1 1 1 22 14 56 o 4  85.7435 3.2046  127.192     12.5649  140.993     14.8675  62.2074    31.1362     9.33235     31.1362     
1 1 1 22 14 57 o 1  93.6005 3.20521 157.167     13.1741  162.772     16.6381  73.9845    156.239     22.558      156.239     
1 1 1 22 14 58 o 12 53.875  4.22704 52.8372     10.2474  56.6066     12.1508  43.8538    283.143     18.3592     283.143     
1 1 1 22 14 59 o 10 23.8864 5.90156 10.9513     8.58181  10.2841     8.81872  9.60628    327.17      5.63035     147.17      
1 1 1 22 14 60 o 8  20.8022 5.70375 6.64242     8.33842  6.31534     8.64993  5.19372    178.399     0.890153    358.399     
1 1 1 22 14 61 o 2  30.5444 5.82965 12.263      9.79342  25.8765     9.34434  7.98437    215.641     21.479      35.6413     
1 1 1 22 14 62 o 19 45.7697 4.75778 30.7453     10.1642  52.0821     10.4512  31.9486    30.3969     6.71545     30.3969     
1 1 1 22 14 63 o 10 18.9957 5.47728 8.71853     8.68956  -4.05964    8.94695  0.656378   237.299     20.2059     237.299     
1 1 1 22 14 64 o 6  39.5222 5.93383 22.8433     11.9346  42.6036     11.0332  29.523     195.641     16.3334     195.641     
1 1 1 22 14 65 o 11 28.2436 6.19584 3.43171     11.8713  26.2177     10.5654  5.16283    178.795     23.0107     358.795     
1 1 1 22 14 66 o 11 26.7607 6.67137 8.14128     13.2243  18.47       10.3811  8.48174    358.411     13.4141     178.411     
1 1 1 22 14 67 o 5  28.3906 6.63177 16.3573     11.4358  17.4901     10.5383  14.5376    288.806     2.34082     108.806     
1 1 1 22 14 68 o 12 21.8781 6.35023 10.4587     11.7096  1.41838     10.9588  3.23204    339.002     0.727898    339.002     
1 1 1 22 14 69 o 4  22.6741 6.38932 -7.0584     13.7887  15.2862     11.1537  4.47193    343.586     15.7437     163.586     
1 1 1 22 14 70 o 12 23.6161 6.68147 11.9309     12.4887  7.69277     11.5093  2.27507    67.6664     0.672437    67.6664     
1 1 1 22 14 71 o 4  21.2686 6.38783 10.6726     12.4489  -1.10373    11.8593  4.96801    157.742     4.18927     337.742     
1 1 1 22 14 72 o 18 31.4761 7.18266 18.9747     13.8533  28.8287     12.7105  16.4831    346.243     2.63926     346.243     
1 1 1 22 14 73 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 14 74 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 15 0  o 19 221.804 3.01098 873.711     33.4408  873.711     33.4408  216.452    180         102.665     180         
1 1 1 22 15 1  o 16 21.9654 5.47365 3.02986     8.10524  10.75       7.51599  14.3496    46.1091     35.4779     46.1091     
1 1 1 22 15 2  o 17 146.412 2.63463 382.317     19.7491  379.002     18.8897  95.3943    228.506     20.1429     48.5065     
1 1 1 22 15 3  o 16 113.76  2.5979  229.543     14.7732  230.375     14.8092  94.9063    192.986     34.146      192.986     
1 1 1 22 15 4  o 12 147.201 2.65426 388.198     19.1381  381.402     19.9858  143.397    141.249     80.6558     141.249     
1 1 1 22 15 5  o 18 233.475 3.13346 968.649     39.2174  968.268     33.9153  141.497    52.8279     60.5159     232.828     
1 1 1 22 15 6  o 8  166.019 2.64756 486.386     22.0389  492.249     22.0154  142.029    296.715     45.1284     296.715     
1 1 1 22 15 7  o 10 261.397 3.07933 1230.45     40.3311  1197.48     40.3398  173.92     104.314     37.256      284.314     
1 1 1 22 15 8  o 14 104.637 2.64747 196.775     13.2112  192.502     14.4652  63.2908    174.271     19.858      354.271     
1 1 1 22 15 9  o 8  137.771 2.53854 341.639     17.456   332.716     17.5638  52.7295    91.3507     94.3051     271.351     
1 1 1 22 15 10 o 8  141.648 2.60415 358.585     17.6306  354.117     19.2736  115.821    263.928     29.4921     263.928     
1 1 1 22 15 11 o 4  23.3795 5.56255 8.42589     7.27499  9.89574     8.13924  16.2599    67.0305     43.9863     67.0305     
1 1 1 22 15 12 o 18 132.913 2.59015 321.131     16.8289  306.734     17.6092  88.2295    181.956     14.0188     1.95582     
1 1 1 22 15 13 o 6  68.9427 2.99784 92.3098     9.86359  77.5583     10.6057  3.5981     159.164     102.441     159.164     
1 1 1 22 15 14 o 11 16.8787 4.94216 -5.75899    7.11709  5.18283     7.45543  18.938     89.2328     43.5532     89.2328     
1 1 1 22 15 15 o 15 340.432 3.47748 2059.41     55.7446  2064.35     62.7108  255.002    32.6973     8.90733     32.6972     
1 1 1 22 15 16 f 0  29.7153 5.36605 17.649      7.79586  15.1224     8.27957  29.593     262.449     0           0           
1 1 1 22 15 17 o 12 62.9298 3.16141 76.5552     9.46676  65.2227     10.2112  34.2187    89.433      7.67709     269.433     
1 1 1 22 15 18 o 13 77.5143 2.98251 110.91      11.326   103.418     11.7284  19.6554    187.064     67.8321     7.0637      
1 1 1 22 15 19 o 2  107.96  2.75642 210.994     13.8379  203.829     15.8319  71.7068    341.175     8.01026     161.175     
1 1 1 22 15 20 o 9  170.084 2.56475 512.512     21.1163  515.353     22.5847  130.182    235.402     15.0701     235.402     
1 1 1 22 15 21 f 0  32.8891 5.13451 20.8101     8.12498  19.4394     8.34914  34.8845    293.613     0           0           
1 1 1 22 15 22 o 16 115.628 2.69579 252.851     14.9363  223.405     16.1192  89.0201    285.24      16.055      285.24      
1 1 1 22 15 23 o 6  75.16   3.19249 98.7347     12.4689  103.126     11.4159  58.7063    162.923     25.7254     162.923     
1 1 1 22 15 24 o 4  117.842 2.87169 259.09      15.2008  235.817     18.3361  88.9024    64.8071     12.176      64.8071     
1 1 1 22 15 25 o 4  109.441 2.74005 218.584     14.8112  208.066     15.1787  73.5761    203.577     6.46279     23.5767     
1 1 1 22 15 26 o 16 178.562 2.82407 575.66      24.2294  559.112     26.2387  119.174    245.137     18.9808     65.1367     
1 1 1 22 15 27 o 3  98.3618 3.05492 179.877     14.7394  165.59      15.2574  86.234     135.864     39.6194     135.864     
1 1 1 22 15 28 o 11 160.66  2.90235 484.132     21.6012  436.138     24.7778  137.038    247.257     45.0367     247.257     
1 1 1 22 15 29 o 12 162.942 3.03091 491.321     22.1382  455.733     26.8835  109.095    206.161     15.2016     26.1606     
1 1 1 22 15 30 f 0  186.042 2.91868 629.425     26.5793  604.288     27.7968  108.827    158.614     0           0           
1 1 1 22 15 31 o 19 83.3433 2.88005 120.513     11.5579  127.737     12.4291  76.4132    97.5721     51.7832     97.5721     
1 1 1 22 15 32 o 5  114     2.72634 251.582     15.1752  212.874     15.7886  74.5655    222.619     10.7402     42.6189     
1 1 1 22 15 33 o 13 96.2071 2.87451 168.918     13.1681  161.862     14.4244  53.3918    130.02      26.8076     310.02      
1 1 1 22 15 34 o 16 92.1931 2.79148 154.65      12.575   149.082     13.1388  74.0433    211.973     23.6435     211.973     
1 1 1 22 15 35 o 12 88.6062 2.90104 136.022     12.4024  144.904     13.2944  84.25      212.148     53.8131     212.148     
1 1 1 22 15 36 o 12 61.4072 3.48085 69.6906     10.0627  66.2887     11.116   22.4694    211.289     37.7105     31.2892     
1 1 1 22 15 37 o 1  117.485 2.97302 251.156     16.1484  242.843     18.6605  92.2425    123.199     19.8865     123.199     
1 1 1 22 15 38 o 7  92.0001 3.27053 159.291     14.3384  144.88      15.6029  83.2287    112.844     40.2017     112.844     
1 1 1 22 15 39 o 9  37.4401 5.49061 26.3007     9.70921  26.7722     10.2176  18.6787    239.057     7.53228     59.0569     
1 1 1 22 15 40 o 3  33.9641 5.39542 22.5881     8.97827  21.2705     8.94129  17.4542    0.424043    0.28278     180.424     
1 1 1 22 15 41 o 13 18.0495 5.22211 -14.5512    9.18774  8.34607     8.57895  2.48215    222.364     14.9631     222.364     
1 1 1 22 15 42 o 8  31.2342 5.94551 22.4914     9.96429  15.0843     9.21801  14.1044    26.3408     1.1715      206.341     
1 1 1 22 15 43 o 5  115.868 2.7784  245.919     15.6553  235.719     16.527   81.4664    111.631     1.11253     111.631     
1 1 1 22 15 44 o 12 38.6085 5.06965 24.8288     9.28457  31.8259     9.58736  15.343     357.292     18.4502     177.292     
1 1 1 22 15 45 o 3  53.6646 3.95617 57.0594     10.2027  48.7862     10.6508  30.7591    259.806     9.99889     79.8059     
1 1 1 22 15 46 o 18 45.5731 4.38213 44.1919     9.07704  33.3849     10.0355  28.2983    37.0816     2.02277     217.081     
1 1 1 22 15 47 o 16 26.5774 5.78174 10.8897     7.9945   15.9334     8.99645  8.89379    170.133     0.958003    350.133     
1 1 1 22 15 48 o 7  49.4082 4.09384 36.8115     9.20561  54.3059     10.5908  38.0945    219.874     13.245      219.874     
1 1 1 22 15 49 o 13 63.54   3.50452 64.9916     10.4675  82.769      11.6616  51.2747    222.164     18.2631     222.164     
1 1 1 22 15 50 o 14 47.1856 4.16823 41.997      9.34045  40.7313     9.91708  31.4186    156.611     2.01978     156.611     
1 1 1 22 15 51 o 18 25.0285 5.65452 15.502      8.26576  7.53809     8.23469  3.5131     226.884     21.7872     46.8839     
1 1 1 22 15 52 o 17 54.3811 3.73212 47.561      9.8442   61.7802     10.1218  36.4101    105.36      0.95706     105.36      
1 1 1 22 15 53 o 8  96.4068 2.76394 163.112     13.0608  172.758     13.5927  77.7967    0.968285    24.6742     0.968285    
1 1 1 22 15 54 o 19 77.1803 3.32926 104.642     12.2732  113.238     13.3627  54.9436    140.489     5.80379     140.489     
1 1 1 22 15 55 o 16 54.2421 4.00741 51.6133     10.0717  58.3733     11.4033  39.4179    322.317     7.53388     322.317     
1 1 1 22 15 56 o 3  57.1193 4.09522 65.6504     10.8752  56.883      12.035   43.6921    128.259     12.3288     128.259     
1 1 1 22 15 57 o 11 18.8309 5.41167 0.344038    8.02161  6.50056     8.26742  1.58391    215.941     0.57381     35.9415     
1 1 1 22 15 58 o 8  36.6996 5.55665 28.5621     9.21034  25.6858     10.6019  21.0634    131.673     3.59932     311.673     
1 1 1 22 15 59 o 5  28.1653 5.83079 10.8333     8.99026  21.4087     9.13396  13.6947    180.408     4.80055     0.40766     
1 1 1 22 15 60 o 17 31.401  5.92221 23.6508     9.62598  17.2617     9.50398  17.3082    7.33254     1.97931     187.333     
1 1 1 22 15 61 o 19 75.4049 3.54532 103.375     13.7053  108.581     12.89    58.3001    96.0115     17.7007     96.0115     
1 1 1 22 15 62 o 12 25.2465 6.16399 14.2432     9.68314  11.0455     9.31466  6.89055    184.581     13.8707     4.5805      
1 1 1 22 15 63 o 17 32.1054 6.36    18.2306     11.9876  25.2386     9.82917  13.5275    334.451     10.8886     154.451     
1 1 1 22 15 64 f 0  34.4823 6.31993 21.2369     12.115   29.0986     10.2979  9.91985    284.027     0           0           
1 1 1 22 15 65 o 16 25.6845 6.42336 21.3511     11.7837  3.0848      10.4372  7.72371    315.585     14.059      135.585     
1 1 1 22 15 66 f 0  23.1667 5.78175 -20.6698    14.4985  19.3515     9.50031  17.8965    230.24      0           0           
1 1 1 22 15 67 o 13 36.5247 6.86939 28.704      12.7582  30.7404     12.8346  22.3817    88.3653     1.27641     88.3653     
1 1 1 22 15 68 o 19 25.5636 6.87973 17.0083     12.6529  8.90298     12.0437  11.8472    223.219     3.12007     223.219     
1 1 1 22 15 69 o 15 26.6219 7.06078 14.5581     13.0984  16.2116     12.4322  12.2962    280.701     1.40165     280.701     
1 1 1 22 15 70 o 18 26.4465 6.9381  8.17744     12.6583  22.0349     12.8449  10.8509    162.991     2.54224     342.991     
1 1 1 22 15 71 o 17 19.9857 6.21195 -1.1574     12.4385  6.09566     11.8954  1.86707    274.435     3.31314     94.4353     
1 1 1 22 15 72 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 16 0  o 12 17.4982 6.5755  7.86021     7.78579  7.86021     7.78579  7.90595    3.65892e-05 18.5903     3.65891e-05 
1 1 1 22 16 1  o 7  69.6268 3.07059 88.1688     10.638   84.8534     10.6796  25.2652    311.615     43.3779     131.615     
1 1 1 22 16 2  o 17 40.815  4.48157 26.0496     8.70109  35.0963     8.92348  2.64802    136.827     33.9177     316.827     
1 1 1 22 16 3  o 9  124.022 2.61192 277.048     16.2103  269.801     16.2189  63.9487    350.49      51.3974     170.49      
1 1 1 22 16 4  o 14 37.9712 4.81305 27.7484     8.6731   25.3064     8.95366  19.5205    42.6934     84.0841     42.6934     
1 1 1 22 16 5  o 17 90.2959 2.8598  142.972     12.6214  147.373     13.1948  71.6604    134.03      22.5082     134.03      
1 1 1 22 16 6  o 3  67.6481 3.19656 83.7061     10.9177  79.7912     10.6317  45.7575    103.337     16.1419     103.337     
1 1 1 22 16 7  o 11 307.856 3.34973 1684.78     51.6695  1687.33     51.6892  251.987    254.568     48.5142     254.568     
1 1 1 22 16 8  o 19 177.121 2.67801 564.593     23.7563  550.086     23.7818  138.112    313.58      17.7407     313.58      
1 1 1 22 16 9  f 0  162.315 2.79762 475.146     22.7104  461.251     22.7977  121.72     210.557     0           0           
1 1 1 22 16 10 o 7  155.308 2.62697 420.651     19.5405  436.423     21.3397  127.794    20.9697     31.0006     20.9696     
1 1 1 22 16 11 o 4  159.895 2.73576 457.929     22.3171  450.712     21.5243  101.758    13.6888     29.511      193.689     
1 1 1 22 16 12 o 3  147.68  2.58907 387.467     18.6125  387.69      19.6786  115.84     94.784      18.5346     94.784      
1 1 1 22 16 13 o 13 105.41  2.72731 201.57      13.5931  193.921     15.0978  99.1445    71.2611     56.4665     71.2611     
1 1 1 22 16 14 o 1  236.058 2.89994 997.794     33.5465  983.775     35.0368  176.844    67.9457     6.94962     67.9457     
1 1 1 22 16 15 o 15 162.901 2.69733 466.452     21.4181  476.872     22.6168  110.687    180.938     15.4928     0.938407    
1 1 1 22 16 16 f 0  187.995 2.65953 627.51      24.4824  628.8       25.6178  133.26     345.687     0           0           
1 1 1 22 16 17 o 19 96.2037 2.67559 161.79      12.5519  167.781     13.1971  66.9263    283.511     0.0661144   283.509     
1 1 1 22 16 18 o 13 97.0418 2.82467 171.161     13.6958  164.402     13.7144  93.9063    196.578     69.9445     196.578     
1 1 1 22 16 19 o 3  56.887  3.52051 60.4866     9.95998  55.8014     9.89924  30.7939    71.3478     5.66079     251.348     
1 1 1 22 16 20 o 7  38.6572 4.57561 27.7842     8.13943  27.1365     8.93709  7.23615    220.362     13.8307     40.3615     
1 1 1 22 16 21 o 13 107.168 2.74879 207.024     14.4816  202.144     14.9828  74.4273    4.92091     2.37625     184.921     
1 1 1 22 16 22 o 19 89.4936 3.09749 146.707     13.7726  139.348     13.9153  53.7801    180.31      17.0582     0.309575    
1 1 1 22 16 23 o 16 157.878 2.89637 438.934     21.7776  449.027     23.9993  118.202    234.157     8.68468     234.157     
1 1 1 22 16 24 o 19 164.251 3.0574  505.101     24.7058  457.349     25.505   138.909    57.6822     41.4246     57.6822     
1 1 1 22 16 25 o 3  165.019 3.01365 462.627     23.0526  509.212     26.7459  131.128    70.8269     24.5783     70.8269     
1 1 1 22 16 26 o 7  74.6074 3.05136 101.796     11.1313  97.3764     11.5694  40.1585    120.721     21.4205     300.721     
1 1 1 22 16 27 o 13 57.3613 3.6627  56.2996     10.2543  62.43       10.568   36.4604    43.1923     17.7412     43.1923     
1 1 1 22 16 28 o 10 132.066 2.77761 319.144     17.8223  303.166     18.852   103.53     83.269      19.5175     83.269      
1 1 1 22 16 29 o 14 162.494 2.76573 475.068     22.6331  466.313     22.411   129.804    329.616     26.996      329.616     
1 1 1 22 16 30 o 1  181.237 2.85069 585.511     24.8054  586.321     26.9342  154.731    18.9699     49.8268     18.97       
1 1 1 22 16 31 o 15 52.5989 3.89135 47.5453     9.60963  52.8844     10.609   18.6995    113.857     30.0771     293.857     
1 1 1 22 16 32 o 4  35.8619 5.36898 30.2082     8.36253  18.2991     10.3256  9.44495    216.811     13.3089     36.8107     
1 1 1 22 16 33 o 14 129.358 2.86472 307.04      17.1266  291.205     19.7871  107.726    221.223     32.4815     221.223     
1 1 1 22 16 34 o 9  20.5027 5.58154 2.53109     7.37309  7.97159     8.93076  5.24615    158.469     22.7459     158.469     
1 1 1 22 16 35 o 2  92.9386 2.98096 151.464     12.6187  158.14      15.0153  67.6934    50.5852     5.07        50.5852     
1 1 1 22 16 36 o 15 68.0484 3.50169 86.9682     11.309   80.2576     12.324   46.7061    24.8702     0.312671    204.87      
1 1 1 22 16 37 f 0  69.7766 3.73182 96.9695     12.0922  79.7607     13.5066  56.7747    315.464     0           0           
1 1 1 22 16 38 o 13 90.9776 3.03275 155.52      13.4864  141.982     14.0348  78.0959    238.45      29.5967     238.45      
1 1 1 22 16 39 o 3  17.8063 5.40412 -0.267128   7.92187  0.435789    9.34656  9.86025    129.492     36.7668     129.492     
1 1 1 22 16 40 o 4  31.3008 5.85399 14.5288     8.69603  23.4679     10.1277  6.11446    220.562     26.2325     40.5621     
1 1 1 22 16 41 o 4  39.8577 5.03282 35.8499     8.84349  24.5288     10.1764  19.9987    230.55      10.7416     50.5498     
1 1 1 22 16 42 o 4  63.3947 3.56709 70.6002     10.8183  75.6373     11.663   40.4366    120.032     5.6039      300.032     
1 1 1 22 16 43 o 8  16.137  5.10295 -5.28291    8.03519  -0.859276   8.92433  4.47754    196.226     19.7569     196.226     
1 1 1 22 16 44 o 14 38.0281 4.81918 29.7939     9.00503  25.0514     8.67825  25.8336    269.74      7.43028     269.74      
1 1 1 22 16 45 o 11 62.4211 3.6625  76.6692     11.5337  65.8851     11.1463  49.2089    122.495     14.7051     122.495     
1 1 1 22 16 46 o 8  132.164 2.68807 304.704     17.7537  323.365     17.8063  93.9822    226.875     3.55658     226.875     
1 1 1 22 16 47 o 7  52.4574 3.73947 57.0041     9.45064  44.4484     9.74895  31.5742    236.351     6.8157      56.351      
1 1 1 22 16 48 o 14 17.2615 5.20611 0.851804    7.47959  0.444209    8.39654  1.01021    279.017     13.7664     279.017     
1 1 1 22 16 49 o 12 57.2145 3.70242 55.576      10.6278  64.8626     10.2732  41.8796    49.0309     7.54583     49.0309     
1 1 1 22 16 50 o 18 58.7107 3.84873 58.3963     11.2198  68.9579     11.0827  34.0373    326.777     11.1093     146.777     
1 1 1 22 16 51 o 15 47.262  4.24781 50.8056     9.85437  33.726      9.49052  20.851     114.687     21.3789     294.687     
1 1 1 22 16 52 o 2  21.2597 5.76618 5.99931     9.23652  7.17588     8.04088  1.85389    63.1434     28.8789     63.1434     
1 1 1 22 16 53 o 4  23.1451 5.80852 11.1267     8.66342  7.91057     8.29797  7.77931    212.966     9.62273     32.9658     
1 1 1 22 16 54 o 15 99.0685 2.98527 176.182     15.2629  181.562     14.2733  87.412     298.094     40.3485     298.094     
1 1 1 22 16 55 o 10 16.2235 5.04838 -5.45681    8.27166  2.03442     8.03002  0.296862   258.105     13.6077     78.1054     
1 1 1 22 16 56 o 17 64.967  3.77499 78.2024     11.8751  79.5512     12.4846  39.1382    297.942     8.72474     117.942     
1 1 1 22 16 57 o 15 47.3168 4.66993 42.7039     10.3606  44.1063     11.1755  26.8734    309.988     8.05285     129.988     
1 1 1 22 16 58 o 15 43.8128 5.429   26.1655     10.1336  53.031      12.7789  30.0149    50.0335     4.46212     50.0335     
1 1 1 22 16 59 o 19 16.3074 5.16118 1.76103     8.44424  -8.98577    9.65781  0.76972    341.08      7.57154     161.08      
1 1 1 22 16 60 o 2  22.0533 6.01999 3.20553     9.0348   12.1951     10.2247  6.31946    202.785     2.56797     22.7854     
1 1 1 22 16 61 o 14 74.5768 3.53462 108.808     13.6164  99.1576     12.657   55.1869    264.859     12.417      264.859     
1 1 1 22 16 62 o 7  22.2099 5.91841 -3.24775    11.3937  14.2534     9.10156  6.86798    77.092      0.7934      257.092     
1 1 1 22 16 63 o 3  25.9475 6.45856 12.4057     11.302   14.3363     9.7017   12.053     264.116     4.58452     264.116     
1 1 1 22 16 64 o 1  28.9906 6.65811 19.5926     11.8909  16.4338     10.2522  14.1897    335.9       5.20851     155.9       
1 1 1 22 16 65 o 1  43.588  6.03606 35.9277     12.9299  44.1031     12.4475  33.6548    148.411     14.0748     148.411     
1 1 1 22 16 66 o 11 33.7127 7.1799  34.3708     15.5802  19.0862     10.7958  18.2808    133.257     3.47187     313.257     
1 1 1 22 16 67 o 5  21.0391 6.14403 14.0621     11.578   -9.88869    12.0954  3.84309    338.768     0.215519    158.768     
1 1 1 22 16 68 o 10 41.5316 7.32327 38.4652     16.4926  44.0688     14.128   23.9174    113.406     2.23881     293.406     
1 1 1 22 16 69 o 6  20.7587 6.54651 10.488      14.9288  -8.27194    13.4489  2.15409    211.626     1.773       31.6265     
1 1 1 22 16 70 o 17 24.9801 7.21808 21.0558     15.3584  3.32709     14.3454  7.41146    314.966     5.60494     134.966     
1 1 1 22 16 71 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 17 0  o 19 15.7394 6.359   5.69243     7.89358  5.69243     7.89358  26.3165    360         60.4023     360         
1 1 1 22 17 1  o 2  89.9884 2.7932  143.929     12.5691  144.553     12.5624  33.6721    345.285     60.8788     165.285     
1 1 1 22 17 2  o 19 49.3123 4.1017  36.9791     10.1179  51.6134     9.31824  9.05534    359.878     43.0666     179.878     
1 1 1 22 17 3  o 14 60.6782 3.35029 71.1891     10.0487  60.9114     10.1081  5.80696    148.017     71.173      328.017     
1 1 1 22 17 4  o 17 33.1656 5.23639 17.5487     8.51822  23.5248     8.49225  1.91546    193.058     27.239      193.058     
1 1 1 22 17 5  o 8  78.2829 2.95085 116.77      11.4773  102.09      11.5457  41.1805    169.987     25.6435     349.987     
1 1 1 22 17 6  o 9  108.875 2.86971 207.083     15.2923  215.145     15.9695  79.9025    147.762     5.01252     147.762     
1 1 1 22 17 7  o 5  159.471 2.64551 453.263     21.0914  450.791     21.1925  147.635    306.03      64.0879     306.03      
1 1 1 22 17 8  o 14 25.893  5.63106 15.1132     8.21014  8.74793     8.10673  16.1292    283.616     52.4508     283.616     
1 1 1 22 17 9  o 11 111.003 2.73741 225.325     15.5216  213.46      14.8895  97.2872    279.575     38.7551     279.575     
1 1 1 22 17 10 o 10 21.1217 5.46011 10.6819     7.93854  0.106832    8.1276   11.2984    90.3934     31.095      90.3934     
1 1 1 22 17 11 o 12 127.857 2.6236  281.582     16.7878  300.298     16.7843  54.9458    206.462     76.4204     26.462      
1 1 1 22 17 12 o 6  121.099 2.64056 260.95      16.0448  261.037     15.9668  79.3077    243.996     16.0145     63.9965     
1 1 1 22 17 13 o 16 71.9411 3.01235 85.5842     10.5164  99.576      11.0955  39.0044    202.275     19.6862     22.2751     
1 1 1 22 17 14 o 3  104.753 2.64625 200.231     13.4936  190.614     14.2111  35.5485    247.86      80.1318     67.8599     
1 1 1 22 17 15 o 12 61.3113 3.52418 69.9814     10.8057  65.0411     10.6573  14.1214    319.935     55.2127     139.935     
1 1 1 22 17 16 o 14 123.98  2.99574 299.945     18.9757  249.305     18.1425  75.3586    165.523     28.4713     345.523     
1 1 1 22 17 17 o 5  21.5314 5.81457 6.49869     8.51507  5.16923     8.9749   2.66863    241.209     8.17467     241.209     
1 1 1 22 17 18 o 12 82.0999 3.56177 108.79      13.8049  133.414     15.3653  73.117     308.712     39.9187     308.712     
1 1 1 22 17 19 o 5  168.92  2.96587 512.263     24.323   504.824     25.8325  155.954    138.698     67.1431     138.698     
1 1 1 22 17 20 o 12 182.062 3.15543 595.199     27.0596  587.452     30.3703  140.988    20.6057     16.5269     20.6056     
1 1 1 22 17 21 o 18 123.493 3.11406 281.726     18.5807  263.106     19.8197  99.3624    52.1934     22.2868     52.1934     
1 1 1 22 17 22 o 15 195.415 2.82936 673.452     27.2888  687.536     28.1276  160.22     339.269     35.8506     339.269     
1 1 1 22 17 23 o 6  67.8281 3.46597 89.6889     11.3074  75.9225     11.9586  34.2725    70.2629     23.3984     250.263     
1 1 1 22 17 24 o 8  61.0815 3.77401 72.9116     11.1508  61.9689     11.6071  42.5819    193.264     10.5787     193.264     
1 1 1 22 17 25 o 7  119.068 2.81534 254.249     15.389   251.93      18.04    92.8925    229.407     16.5858     229.407     
1 1 1 22 17 26 o 16 122     2.63193 271.038     15.0861  260.017     16.9575  103.409    338.751     34.0663     338.751     
1 1 1 22 17 27 o 12 105.163 2.75994 196.257     13.9044  198.786     15.1169  65.1072    277.514     18.873      97.5135     
1 1 1 22 17 28 o 18 153.605 2.72098 413.31      19.2845  428.752     22.5114  144.729    252.563     69.839      252.563     
1 1 1 22 17 29 o 18 31.9739 5.5917  19.6185     8.23786  19.0492     9.60335  4.52305    120.955     21.3602     300.955     
1 1 1 22 17 30 o 14 50.266  3.99844 47.3536     9.90322  44.6988     9.88469  24.1915    265.852     17.1941     85.852      
1 1 1 22 17 31 o 6  102.099 3.07564 189.129     15.7195  184.55      15.6805  73.7568    318.126     2.57219     318.126     
1 1 1 22 17 32 o 5  100.542 3.0289  179.067     15.498   183.364     14.9406  72.6812    50.0358     2.38914     50.0357     
1 1 1 22 17 33 o 16 57.0079 4.07319 58.3349     11.4388  60.1377     11.5144  23.4098    7.17276     32.2732     187.173     
1 1 1 22 17 34 o 10 20.2488 5.62664 4.20706     8.31476  5.15115     8.39998  8.70815    225.417     38.9031     225.417     
1 1 1 22 17 35 o 11 66.6691 3.53046 87.1951     11.625   73.9601     11.718   56.7724    269.618     22.7844     269.618     
1 1 1 22 17 36 o 5  62.6865 3.57715 85.2852     10.5207  58.486      11.2506  30.2228    30.5988     26.751      210.599     
1 1 1 22 17 37 o 9  83.0001 3.21721 129.169     11.825   119.382     14.5495  61.3196    93.4983     6.38221     93.4983     
1 1 1 22 17 38 o 10 70.3664 3.27988 94.0121     10.818   85.1622     12.0559  52.8433    56.653      8.48874     56.653      
1 1 1 22 17 39 f 0  12.9075 4.26054 -4.30148    6.68594  -8.62723    7.01304  23.7143    105.566     0           0           
1 1 1 22 17 40 o 2  27.7238 5.55473 9.94587     8.40811  19.2256     8.24612  5.038      68.956      22.8414     248.956     
1 1 1 22 17 41 o 12 26.5764 5.53792 10.156      7.93743  16.6407     8.07534  9.00206    196.294     9.35176     16.2937     
1 1 1 22 17 42 o 12 122.877 2.7295  280.514     15.9746  262.457     17.4951  104.63     153.242     36.5027     153.242     
1 1 1 22 17 43 o 15 81.3731 3.11548 117.457     12.1506  122.192     13.1594  48.2834    140.539     16.7881     320.539     
1 1 1 22 17 44 o 17 75.6576 3.21877 98.2492     11.7632  109.53      12.5346  43.5845    356.71      17.7429     176.71      
1 1 1 22 17 45 o 12 33.4742 5.44608 23.3952     8.6067   20.161      9.31072  7.22079    289.866     28.6896     109.866     
1 1 1 22 17 46 o 6  24.6633 5.72288 18.3709     9.21799  1.78345     8.89658  3.19055    331.645     22.2634     151.645     
1 1 1 22 17 47 o 5  51.8939 4.28805 43.8439     10.614   56.998      11.1611  44.9635    57.6791     22.6718     57.6791     
1 1 1 22 17 48 o 17 63.8558 3.56906 86.0374     11.8829  64.322      10.7236  41.6824    202.456     3.73171     22.4556     
1 1 1 22 17 49 o 7  53.2847 4.10085 53.4        11.6187  52.476      9.84579  34.0436    301.563     3.67703     121.563     
1 1 1 22 17 50 o 4  86.447  3.12968 134.987     13.4881  137.412     13.5381  56.865     37.6191     5.32989     217.619     
1 1 1 22 17 51 o 7  81.3674 3.06141 123.693     12.5308  117.887     12.3443  58.7932    286.112     6.13986     286.112     
1 1 1 22 17 52 o 16 43.8172 4.85966 42.7411     9.71347  31.8672     10.5824  20.0819    111.89      18.1016     291.89      
1 1 1 22 17 53 f 0  37.1627 5.33668 30.0909     9.83498  25.0136     9.37192  33.1002    100.458     0           0           
1 1 1 22 17 54 o 10 32.9072 5.56698 29.123      9.33755  15.2629     9.21696  22.7903    112.373     6.84034     112.373     
1 1 1 22 17 55 o 18 24.0794 5.8164  14.9427     8.72994  6.94628     8.62705  1.81411    77.5192     25.606      257.519     
1 1 1 22 17 56 o 14 29.8736 5.75664 12.1934     9.45728  24.4373     9.01605  16.1417    68.0099     2.92619     248.01      
1 1 1 22 17 57 o 12 21.8764 5.67204 13.9816     8.92685  0.98846     8.56133  3.30921    143.055     17.5972     323.055     
1 1 1 22 17 58 o 14 55.9745 4.82878 63.453      12.7012  59.227      13.7228  44.6137    219.97      16.8814     219.97      
1 1 1 22 17 59 o 5  80.0241 3.58012 127.618     13.5275  112.25      14.8472  59.8276    126.318     13.2832     126.318     
1 1 1 22 17 60 o 8  25.9212 6.17888 19.0144     9.58189  6.42048     10.842   8.7182     107.947     11.9534     287.947     
1 1 1 22 17 61 o 3  56.2503 5.19165 65.5894     15.4345  60.2843     13.0912  36.905     96.2946     0.481119    96.2946     
1 1 1 22 17 62 o 5  18.6959 5.77295 6.60759     10.8805  -9.54158    10.7057  4.72642    20.3387     3.22699     200.339     
1 1 1 22 17 63 o 17 29.2916 6.76897 24.8658     12.0944  12.1554     11.5336  16.1275    67.6067     1.19596     247.607     
1 1 1 22 17 64 o 1  37.3662 6.63548 34.8319     12.6634  27.1637     12.2528  24.3786    319.986     3.42671     319.986     
1 1 1 22 17 65 o 16 45.3088 6.94526 43.9654     15.4551  48.9232     15.184   35.3168    18.7993     15.4938     18.7993     
1 1 1 22 17 66 o 11 52.225  6.85193 55.6561     17.9184  68.3629     16.3745  40.0936    279.964     15.4053     279.964     
1 1 1 22 17 67 o 15 25.1704 7.21175 3.02762     15.3285  20.2359     14.5252  7.31612    310.943     0.963743    310.943     
1 1 1 22 17 68 o 8  28.7518 7.65161 13.6187     15.9475  27.0469     15.1355  11.5754    204.696     2.83525     204.696     
1 1 1 22 17 69 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 18 0  o 17 48.0249 4.08308 42.7818     9.45076  42.7818     9.45076  22.9977    1.10958e-05 19.5059     180         
1 1 1 22 18 1  o 18 51.0198 3.90337 49.5971     9.54836  44.5553     10.0283  22.1938    61.7997     7.80851     61.7997     
1 1 1 22 18 2  o 11 128.731 2.76754 302.61      16.9022  287.78      18.6655  100.353    234.654     13.8034     234.654     
1 1 1 22 18 3  o 14 109.152 2.81371 213.023     15.3563  211.617     15.3744  80.0298    119.187     3.24937     119.187     
1 1 1 22 18 4  o 2  51.776  3.99091 52.0063     10.131   45.0779     10.1892  8.30448    239.556     52.0484     59.5555     
1 1 1 22 18 5  o 10 74.7575 3.2441  92.1945     12.0649  108.096     12.0634  39.2913    126.862     25.3793     306.862     
1 1 1 22 18 6  o 18 249.089 3.15626 1112.98     39.4011  1098.45     39.3962  177.288    357.716     15.4924     177.716     
1 1 1 22 18 7  o 3  81.5338 3.2358  122.709     13.1545  115.108     13.171   55.081     150.125     3.128       330.125     
1 1 1 22 18 8  o 2  148.959 2.89439 402.497     21.5381  388.377     21.6268  130.27     322.604     43.4526     322.604     
1 1 1 22 18 9  o 9  70.4229 3.42824 81.7926     11.8713  96.3217     12.1343  49.4772    157.6       5.11742     157.6       
1 1 1 22 18 10 o 12 125.575 2.97447 288.348     18.2278  274.221     19.1135  107.208    97.0065     33.3063     97.0065     
1 1 1 22 18 11 o 3  84.5576 3.38641 132.519     14.3275  123.57      14.2442  63.1294    30.7433     8.85901     30.7434     
1 1 1 22 18 12 o 7  52.1131 4.47589 44.9111     11.3495  54.1631     11.4634  25.4809    62.0437     13.6477     242.044     
1 1 1 22 18 13 o 19 126.123 3.09332 277.272     19.4821  290.747     19.5548  91.3873    130.815     0.22266     310.814     
1 1 1 22 18 14 o 16 123.549 3.19437 268.571     19.1393  276.865     20.3464  74.991     87.8089     29.6913     267.809     
1 1 1 22 18 15 o 12 85.9008 3.26399 130.416     13.7763  133.783     14.2228  45.1943    14.3418     31.4947     194.342     
1 1 1 22 18 16 o 17 61.6363 3.73445 73.275      10.9703  63.84       11.7529  45.8364    2.83423     19.896      2.83423     
1 1 1 22 18 17 o 15 50.2629 3.89546 46.2522     8.80988  45.3403     10.3902  21.2608    27.5253     20.3692     207.525     
1 1 1 22 18 18 o 10 102.273 2.74322 186.403     13.7954  186.952     14.27    86.6679    107.964     29.3332     107.964     
1 1 1 22 18 19 o 14 89.5501 2.91422 149.91      12.5284  136.935     13.4739  71.4543    209.286     18.5839     209.286     
1 1 1 22 18 20 o 17 157.147 2.59322 436.969     19.937   443.035     20.9021  122.161    168.551     15.6374     168.551     
1 1 1 22 18 21 o 17 143.878 2.69858 375.399     18.9742  363.286     19.8766  116.742    301.892     25.3315     301.892     
1 1 1 22 18 22 o 7  95.9261 2.94456 164.546     13.2085  164.621     14.9764  70.6793    218.14      6.2907      218.14      
1 1 1 22 18 23 o 6  154.717 2.62219 443.014     19.8608  411.06      20.7195  113.723    251.985     2.65529     251.985     
1 1 1 22 18 24 o 4  99.1993 2.98995 175.119     14.2832  177.13      15.3616  71.9788    232.035     3.04765     232.035     
1 1 1 22 18 25 f 0  30.74   5.92107 18.6092     9.63358  17.1686     9.1027   16.3885    130.934     0           0           
1 1 1 22 18 26 o 7  173.192 2.90721 549.24      24.9222  522.916     25.5135  165.196    163.743     79.2729     163.743     
1 1 1 22 18 27 o 6  63.8646 3.71952 82.7282     11.3822  65.3519     11.9829  36.8399    15.8919     14.8755     195.892     
1 1 1 22 18 28 o 14 46.5032 4.49897 36.5384     10.2885  43.2762     10.0312  28.372     60.13       3.86983     240.13      
1 1 1 22 18 29 o 1  134.677 2.73177 335.468     18.2644  313.465     18.5449  110.589    157.367     26.4347     157.367     
1 1 1 22 18 30 o 6  73.2946 3.32699 99.9329     12.0601  93.7872     12.2346  60.7961    108.656     19.1852     108.656     
1 1 1 22 18 31 o 7  48.0563 3.98027 34.6807     8.88585  50.6216     9.77744  32.934     180.055     2.22631     180.055     
1 1 1 22 18 32 o 5  67.0057 3.23719 84.3241     10.1827  77.7938     11.3272  14.7318    232.092     65.806      52.0918     
1 1 1 22 18 33 o 19 61.1736 3.43117 69.8642     9.80079  65.7792     10.9769  51.0071    328.016     18.7983     328.016     
1 1 1 22 18 34 o 19 24.0109 5.78883 11.152      8.23453  8.92895     8.51918  2.85576    49.051      33.753      49.051      
1 1 1 22 18 35 o 9  31.3381 5.68265 24.1234     8.69845  13.4883     9.75482  15.9218    229.581     1.81741     229.581     
1 1 1 22 18 36 o 19 121.584 2.97399 257.954     18.6368  274.255     17.4795  102.918    203.806     32.4835     203.806     
1 1 1 22 18 37 o 10 39.1282 5.06374 19.2082     9.27178  40.5613     9.57841  20.5018    279.334     9.59344     99.3339     
1 1 1 22 18 38 o 4  51.8152 3.97389 41.5639     10.1586  57.938      9.79215  44.8807    355.315     22.54       355.315     
1 1 1 22 18 39 o 11 20.2731 5.48926 9.97311     8.54096  -0.315875   7.82198  4.42647    64.48       31.01       64.48       
1 1 1 22 18 40 o 8  120.181 2.76086 260.678     16.8639  259.14      16.3451  105.781    325.622     41.608      325.622     
1 1 1 22 18 41 o 6  113.45  2.74593 243.787     15.408   219.883     15.7185  83.7812    321.964     7.19918     321.964     
1 1 1 22 18 42 o 11 106.165 2.82172 217.999     14.8342  188.86      15.0586  85.4531    243.849     21.6029     243.849     
1 1 1 22 18 43 o 6  59.3092 3.4666  63.253      10.1312  65.3442     10.2919  45.9432    142.784     11.3864     142.784     
1 1 1 22 18 44 o 2  60.3967 3.48186 64.4933     10.3288  69.0285     10.5627  35.59      130.567     11.9142     310.567     
1 1 1 22 18 45 o 12 27.0162 5.57069 6.11263     9.14273  20.7819     8.34198  12.836     85.3393     4.03672     265.339     
1 1 1 22 18 46 o 6  30.328  5.74527 18.7948     9.00163  17.6318     8.81641  7.69361    30.3348     23.5497     210.335     
1 1 1 22 18 47 o 8  20.3501 5.63851 7.22387     8.06255  3.24763     8.88675  4.96258    190.992     1.3776      10.9922     
1 1 1 22 18 48 o 18 29.3429 6.04349 12.658      9.6148   21.7189     9.66793  15.0115    78.9635     5.65663     258.964     
1 1 1 22 18 49 o 1  60.0615 3.95034 61.4871     11.5628  73.5417     11.8883  38.0073    180.813     6.03054     0.812698    
1 1 1 22 18 50 o 9  24.7603 6.28902 10.2371     9.71047  12.3704     10.1722  9.59423    219.768     9.48756     39.7677     
1 1 1 22 18 51 o 6  49.6016 4.57234 54.0707     11.9959  40.9373     10.2068  33.0212    62.3363     0.303835    242.337     
1 1 1 22 18 52 o 16 21.7313 5.92134 10.6664     9.83288  4.14181     8.56992  8.2678     171.186     3.27516     351.186     
1 1 1 22 18 53 o 17 21.9003 5.78092 12.1305     9.07687  3.68118     8.44347  6.19891    165.423     11.4505     345.423     
1 1 1 22 18 54 o 2  26.2448 5.88427 20.2395     9.42182  7.10418     8.97734  13.4075    177.077     1.63614     357.077     
1 1 1 22 18 55 o 19 80.9932 3.26183 135.809     13.3902  107.9       12.8904  54.7576    272.868     0.307919    92.8679     
1 1 1 22 18 56 o 17 39.8818 5.35321 43.0761     10.5015  22.6099     9.99054  16.7533    288.674     18.0693     108.674     
1 1 1 22 18 57 o 10 26.8389 6.08852 19.5382     9.80541  10.184      9.21686  12.1428    304.695     4.26394     124.695     
1 1 1 22 18 58 o 4  38.3074 5.61214 29.6199     10.5723  30.747      10.2646  22.4965    335.352     3.05777     155.352     
1 1 1 22 18 59 o 12 20.9877 5.9957  4.56492     9.67891  7.38816     9.86741  3.17268    275.634     16.7356     95.6344     
1 1 1 22 18 60 o 13 28.1531 7.0533  10.6559     14.595   20.8177     11.6142  14.5891    331.551     3.22316     151.551     
1 1 1 22 18 61 o 1  38.2183 7.59849 46.2236     18.5683  23.5599     11.9742  26.512     260.832     6.51064     260.832     
1 1 1 22 18 62 o 10 24.3224 6.94861 3.7781      13.9931  14.7671     13.0152  7.05828    56.8352     2.97369     56.8352     
1 1 1 22 18 63 o 1  47.6243 6.82678 49.8553     16.6796  51.6347     14.7451  34.5478    185.24      9.00634     185.24      
1 1 1 22 18 64 o 19 23.2501 6.82682 -3.82685    14.7515  16.3219     13.4849  7.28497    222.112     0.561494    222.111     
1 1 1 22 18 65 o 5  31.1237 7.86527 25.8486     15.9853  24.2223     15.0469  16.8383    200.789     7.08877     200.789     
1 1 1 22 18 66 o 19 23.2094 6.85338 21.0257     14.9128  -10.6228    14.9324  5.53106    110.059     1.6015      290.059     
1 1 1 22 18 67 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 18 68 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 19 0  o 14 149.355 3.05939 397.573     22.8554  397.573     22.8554  130.152    180         36.211      180         
1 1 1 22 19 1  o 17 57.848  4.45378 73.9575     13.1729  48.9812     11.9846  28.1823    302.822     20.5653     122.822     
1 1 1 22 19 2  f 0  17.2055 5.3011  -0.657563   8.8301   -2.12199    8.33012  14.7017    122.088     0           0           
1 1 1 22 19 3  o 19 96.3629 3.04376 166.339     14.5886  165.603     14.7339  64.0197    342.231     10.4404     162.231     
1 1 1 22 19 4  o 3  93.0698 3.08934 163.462     14.3218  146.55      14.3787  65.3462    107.484     2.18273     287.485     
1 1 1 22 19 5  o 3  153.922 2.92606 420.895     22.4914  424.63      22.609   133.787    15.3046     41.6133     15.3046     
1 1 1 22 19 6  o 11 113.592 3.2625  222.173     19.1442  239.646     17.8248  89.0524    124.476     13.796      124.476     
1 1 1 22 19 7  o 16 109.763 3.35102 215.067     18.2856  216.319     18.4931  78.3528    351.969     2.21163     171.969     
1 1 1 22 19 8  f 0  74.7314 3.55066 96.581      13.4798  104.205     12.915   73.128     233.056     0           0           
1 1 1 22 19 9  o 13 113.422 3.10339 229.576     18.0706  230.432     17.1273  111.558    266.535     62.4385     266.535     
1 1 1 22 19 10 o 8  134.038 3.00653 312.931     19.6752  329.073     20.6678  104.094    230.799     12.4158     230.799     
1 1 1 22 19 11 o 16 94.3623 3.17083 163.116     14.9471  155.749     14.9497  40.0698    5.85257     56.4192     185.853     
1 1 1 22 19 12 o 14 102.821 2.91186 183.449     14.7027  194.507     15.2463  47.4918    275.189     54.409      95.1894     
1 1 1 22 19 13 o 3  187.685 2.86417 628.806     26.9549  628.163     26.924   161.866    305.89      47.1827     305.89      
1 1 1 22 19 14 f 0  33.5379 5.5326  18.9481     9.20976  23.5761     9.08663  34.7105    235.025     0           0           
1 1 1 22 19 15 o 1  83.769  3.08717 124.085     12.8818  127.346     12.9478  53.5738    177.409     11.0427     357.409     
1 1 1 22 19 16 o 7  129.184 2.88037 300.615     19.0456  295.772     18.1986  77.1533    229.142     34.4333     49.142      
1 1 1 22 19 17 o 2  103.726 2.93313 186.37      15.4673  198.599     14.93    72.3432    165.482     4.55402     345.482     
1 1 1 22 19 18 o 11 95.7648 3.05872 155.034     14.7238  173.722     14.508   64.9608    310.827     7.31422     130.827     
1 1 1 22 19 19 o 12 76.3466 3.5361  112.875     13.1591  97.3205     13.645   62.8979    18.385      20.927      18.385      
1 1 1 22 19 20 o 18 60.7296 3.95731 59.4606     11.7117  74.7736     12.0003  36.557     24.9521     9.78072     204.952     
1 1 1 22 19 21 o 1  135.91  3.68863 356.401     24.0326  309.068     25.8485  108.725    62.749      19.2898     62.749      
1 1 1 22 19 22 o 16 153.318 3.0772  405.007     23.6813  437.327     23.524   106.776    4.01931     11.2039     184.019     
1 1 1 22 19 23 o 16 55.977  4.26236 59.9721     12.2387  54.5768     11.3047  38.8427    21.5586     1.56387     21.5587     
1 1 1 22 19 24 o 15 77.4812 3.65188 114.95      14.3812  102.123     13.8065  54.7397    53.5184     1.23742     233.518     
1 1 1 22 19 25 o 15 44.1156 4.73162 37.8667     9.49799  34.4164     10.6471  25.6322    57.3385     7.46996     237.339     
1 1 1 22 19 26 o 10 19.7498 5.67216 2.48045     8.98663  4.05059     8.59932  12.5577    15.6748     47.5169     15.6748     
1 1 1 22 19 27 o 15 90.6716 3.04473 157.599     13.4179  138.204     14.0718  89.2318    160.332     49.8809     160.332     
1 1 1 22 19 28 o 12 26.7129 5.82985 13.7486     8.39947  12.8269     8.78338  8.45171    245.093     8.26684     65.0931     
1 1 1 22 19 29 o 2  71.6919 3.32801 92.6636     11.9498  93.1062     11.8308  52.3565    124.606     3.28388     124.606     
1 1 1 22 19 30 o 18 84.6338 3.05127 119.837     12.7124  138.488     13.0549  48.9812    133.736     23.5106     313.736     
1 1 1 22 19 31 o 10 62.4246 3.46887 62.7544     10.7133  79.2133     10.6858  42.8607    81.5889     1.59717     261.589     
1 1 1 22 19 32 o 18 44.506  4.51422 42.7787     9.56378  31.4649     9.75145  11.7333    357.996     37.9395     177.996     
1 1 1 22 19 33 o 11 56.0466 3.73109 59.5375     10.3532  55.3928     10.3471  48.4683    199.729     21.6146     199.729     
1 1 1 22 19 34 o 3  50.5539 3.99504 52.6429     9.91272  41.8376     9.86018  30.6483    2.86245     7.94438     182.862     
1 1 1 22 19 35 o 10 128.176 2.63478 290.672     17.167   299.42      16.6298  106.597    86.6157     29.2141     86.6157     
1 1 1 22 19 36 o 17 72.5908 3.3838  93.0494     12.0142  98.5326     12.469   62.9492    99.5954     24.7288     99.5954     
1 1 1 22 19 37 o 7  26.8884 5.45618 7.27857     8.40012  19.7693     8.07977  3.49187    60.5488     26.2155     240.549     
1 1 1 22 19 38 o 12 22.9948 5.6221  12.3019     8.11047  5.75871     8.02254  0.597475   234.297     28.1825     234.297     
1 1 1 22 19 39 o 17 65.1955 3.37032 79.4136     10.9551  75.4916     10.911   56.2274    303.964     22.803      303.964     
1 1 1 22 19 40 f 0  48.9088 4.11955 37.0542     9.88889  52.4664     9.51593  42.2001    96.2624     0           0           
1 1 1 22 19 41 o 3  39.5665 5.08104 24.5547     10.0063  35.9571     9.15405  24.0714    27.2906     3.49972     207.291     
1 1 1 22 19 42 o 1  19.0372 5.47276 5.2752      8.50362  1.51412     7.94252  4.26782    91.4131     30.1477     91.4131     
1 1 1 22 19 43 o 4  46.5413 4.4906  45.4379     10.389   36.517      9.94695  34.391     171.38      6.60483     171.38      
1 1 1 22 19 44 o 11 84.495  3.30425 120.503     14.5367  140.682     13.1009  66.9808    199.17      15.7342     199.17      
1 1 1 22 19 45 o 12 42.0462 5.06778 33.6409     9.92987  34.8889     10.6586  31.5217    148.994     7.85337     148.994     
1 1 1 22 19 46 o 3  58.602  3.9429  76.7539     11.9025  52.5602     10.8106  53.8798    251.105     28.6166     251.105     
1 1 1 22 19 47 o 2  58.3437 4.08193 53.8468     12.1056  74.7981     10.8099  40.9089    330.39      1.83145     330.39      
1 1 1 22 19 48 o 14 63.3918 3.70183 79.5953     12.1526  70.3302     11.1647  61.4629    1.46446     37.3636     1.46446     
1 1 1 22 19 49 o 17 23.4091 5.91952 10.3226     9.03858  9.90715     8.54173  9.54972    320.438     6.85011     140.438     
1 1 1 22 19 50 o 13 24.4966 5.92918 15.5058     9.1495   7.43588     8.82073  4.09517    218.557     22.0211     38.5567     
1 1 1 22 19 51 o 6  16.5301 5.18955 3.01203     8.61278  -9.86445    9.55591  0.106009   276.575     15.2452     96.5746     
1 1 1 22 19 52 o 12 19.7543 5.88764 -1.59218    10.8588  6.44633     9.61337  3.14729    24.0093     0.887655    204.009     
1 1 1 22 19 53 o 15 95.2464 3.43117 161.276     16.4663  176.491     16.133   84.4023    349.843     38.6856     349.843     
1 1 1 22 19 54 o 13 52.4305 4.55811 58.0821     12.5103  49.1358     10.9562  47.3097    51.5774     27.5783     51.5774     
1 1 1 22 19 55 o 13 38.81   5.82139 41.2466     12.0404  22.6374     10.0976  15.1768    72.6414     19.8795     252.641     
1 1 1 22 19 56 o 15 33.5626 6.09877 23.3251     10.6712  24.4998     9.9755   17.9285    89.7151     5.56695     269.715     
1 1 1 22 19 57 o 16 26.5927 6.38017 9.77149     11.054   18.5102     9.97166  10.3169    243.791     10.803      63.7914     
1 1 1 22 19 58 o 14 25.1764 6.52965 11.573      11.1456  13.2171     10.4749  5.95173    86.8697     18.5865     266.87      
1 1 1 22 19 59 o 19 65.9741 5.52217 88.7975     17.3344  88.2629     18.4343  53.2179    43.6481     19.0326     43.6481     
1 1 1 22 19 60 o 19 28.624  7.50623 16.4536     14.9758  19.7036     13.8204  13.5289    188.924     6.59994     8.92399     
1 1 1 22 19 61 o 4  29.1572 7.26865 32.0167     15.325   5.4313      13.4738  17.2831    44.363      2.63267     44.363      
1 1 1 22 19 62 f 0  20.4765 6.35434 11.2703     13.69    -10.3502    12.7059  12.2564    118.651     0           0           
1 1 1 22 19 63 o 12 18.1927 5.97746 -11.0322    13.8969  0.0186847   12.8369  0.917636   154.475     1.42838     334.475     
1 1 1 22 19 64 o 5  19.1301 6.07469 -21.3302    13.2577  11.0406     13.453   1.30336    56.7548     13.4622     236.755     
1 1 1 22 19 65 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 19 66 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 20 0  o 15 95.4103 2.92114 162.818     13.9075  162.818     13.9075  88.4299    7.41928e-06 33.4268     7.41928e-06 
1 1 1 22 20 1  o 8  137.562 2.97434 333.978     21.1006  342.647     19.8198  114.533    160.06      27.0674     160.06      
1 1 1 22 20 2  o 11 92.5424 3.20127 149.841     15.0665  157.235     14.5098  49.5342    271.806     35.0462     91.8063     
1 1 1 22 20 3  o 6  116.208 3.0309  232.03      17.1783  251.38      18.0663  95.0231    145.989     21.0285     145.989     
1 1 1 22 20 4  o 2  63.862  3.74949 80.364      12.0424  67.2823     11.6917  50.5159    126.575     19.91       126.575     
1 1 1 22 20 5  o 2  58.136  3.89559 61.8823     11.1866  60.6081     11.2398  16.3025    184.571     48.2004     4.571       
1 1 1 22 20 6  o 12 103.727 2.92347 193.232     15.6301  191.672     14.6911  80.7761    332.546     11.5479     332.546     
1 1 1 22 20 7  o 7  101.173 3.03072 179.553     15.3837  186.979     15.2719  74.4852    237.861     2.51455     237.861     
1 1 1 22 20 8  o 3  108.188 2.88546 210.576     15.961   208.054     15.2672  68.8592    36.0777     20.4011     216.078     
1 1 1 22 20 9  o 19 76.0552 3.33034 103.393     12.7607  104.536     12.4981  33.6849    274.115     41.7733     94.1151     
1 1 1 22 20 10 o 5  118.372 2.98531 265.344     18.8859  236.547     16.4878  68.8357    96.2611     36.4446     276.261     
1 1 1 22 20 11 o 8  167.563 2.95258 512.091     24.7445  491.883     24.8127  135.548    99.1055     23.0154     99.1055     
1 1 1 22 20 12 o 5  99.9836 3.11353 171.202     15.9248  187.356     15.1263  60.675     59.3774     24.5436     239.377     
1 1 1 22 20 13 o 7  101.997 3.06965 191.816     15.1734  181.137     16.0841  55.9997    138.765     37.3247     318.765     
1 1 1 22 20 14 o 6  97.2983 3.00375 171.128     14.6223  168.156     14.5992  51.4502    130.365     39.3915     310.365     
1 1 1 22 20 15 o 9  16.3621 5.18709 -5.76626    8.51795  -1.71602    9.13225  4.24378    322.777     13.1763     322.777     
1 1 1 22 20 16 o 1  85.1909 3.31534 138.578     14.1099  122.704     14.0507  70.4505    67.7824     18.6459     67.7824     
1 1 1 22 20 17 o 10 38.5928 5.5613  21.2621     10.5266  35.742      10.2502  15.782     59.2042     18.3498     239.204     
1 1 1 22 20 18 o 2  195.802 3.29826 689.467     31.4592  686.222     33.2386  175.998    57.1761     62.0361     57.1761     
1 1 1 22 20 19 o 18 122.799 3.1062  288.311     19.0884  253.413     19.023   100.834    48.0084     21.2991     48.0084     
1 1 1 22 20 20 o 5  63.1249 3.85929 70.7853     11.5342  74.0441     12.6368  57.7852    183.831     28.5528     183.831     
1 1 1 22 20 21 o 6  119.979 2.76667 242.505     15.8044  273.614     17.4339  82.6895    193.327     10.8361     13.3274     
1 1 1 22 20 22 f 0  83.5583 2.93775 127.051     12.0431  123.809     12.4715  70.3793    177.478     0           0           
1 1 1 22 20 23 o 1  53.1071 3.66827 50.2043     9.24585  52.5202     10.028   33.8101    332.589     6.37785     152.589     
1 1 1 22 20 24 o 14 103.311 2.7817  197.632     13.5581  185.406     15.087   69.42      267.718     11.8573     87.7184     
1 1 1 22 20 25 o 13 55.2114 3.70304 57.1943     9.37935  53.9683     10.7528  27.9197    44.5987     22.1516     224.599     
1 1 1 22 20 26 o 19 75.867  3.39535 109.998     11.8489  98.527      13.6266  51.4475    6.521       6.03906     186.521     
1 1 1 22 20 27 o 13 97.4399 3.00519 164.209     13.12    177.904     16.1018  75.5837    232.236     10.1519     232.236     
1 1 1 22 20 28 o 2  51.6611 4.29211 46.6295     10.1809  52.1439     11.6256  41.0039    358.963     12.0688     358.963     
1 1 1 22 20 29 o 4  85.9209 3.0354  145.388     12.1976  121.546     13.5993  51.5857    306.896     20.8299     126.896     
1 1 1 22 20 30 o 8  23.4246 5.41424 -0.47901    7.78956  17.7987     8.86411  4.53506    276.925     15.049      96.9249     
1 1 1 22 20 31 f 0  17.7672 5.02856 7.76459     7.40583  -6.41521    7.75656  6.5778     23.9092     0           0           
1 1 1 22 20 32 o 3  45.8311 4.25791 44.0566     9.20677  34.3828     9.65288  32.6664    235.219     3.87022     235.219     
1 1 1 22 20 33 o 11 64.1791 3.38333 78.9539     10.5531  71.1446     10.9966  32.8874    317.015     25.3397     137.015     
1 1 1 22 20 34 o 16 68.6875 3.20794 82.7041     10.7238  88.6946     11.2392  47.6262    3.20501     1.89043     183.205     
1 1 1 22 20 35 o 5  27.1701 5.71574 13.3618     8.21464  15.1255     8.50958  8.21112    257.521     16.1901     77.5206     
1 1 1 22 20 36 o 8  44.6544 4.4759  34.2041     9.42106  40.8247     10.0334  35.4793    351.747     12.6185     351.747     
1 1 1 22 20 37 o 13 37.6123 5.30711 29.7671     9.2977   25.0632     9.97632  23.9353    278.027     0.466022    98.0267     
1 1 1 22 20 38 o 7  15.383  4.81754 -6.94002    7.54118  1.43072     7.61501  1.02903    256.093     10.1183     256.093     
1 1 1 22 20 39 o 4  28.1712 5.70779 18.8285     8.38     12.0458     8.8951   13.7351    129.327     5.78833     309.327     
1 1 1 22 20 40 o 6  40.9597 4.9025  34.4743     9.3882   29.9397     9.94661  21.3075    229.599     12.8444     49.5995     
1 1 1 22 20 41 o 17 49.1266 4.28221 53.0424     10.1383  38.2508     10.2007  19.7481    149.773     28.8497     329.773     
1 1 1 22 20 42 o 3  26.9582 5.84131 16.7436     8.62469  11.7558     8.84188  15.8084    58.8078     5.36567     58.8078     
1 1 1 22 20 43 o 15 37.6169 5.27553 28.8309     9.31499  26.9074     9.86045  18.901     239.526     12.647      59.5259     
1 1 1 22 20 44 o 9  75.201  3.29721 103.982     12.1558  103.975     12.5698  65.0269    40.7528     25.1358     40.7528     
1 1 1 22 20 45 o 18 18.6892 5.50943 2.77225     8.67339  2.93455     8.46632  0.629126   226.475     22.921      226.475     
1 1 1 22 20 46 o 6  19.205  5.62659 3.21948     8.8842   3.72889     8.83722  3.70647    157.067     12.99       337.067     
1 1 1 22 20 47 o 1  63.6048 3.83289 82.206      11.6597  70.0187     12.3804  59.7086    148.628     32.815      148.628     
1 1 1 22 20 48 o 11 54.6515 4.63474 63.3729     11.4106  52.5368     13.0369  38.5779    186.049     2.69989     186.049     
1 1 1 22 20 49 f 0  34.2875 5.81608 25.1047     9.42237  23.6822     10.328   24.9006    140.234     0           0           
1 1 1 22 20 50 o 16 66.3858 3.8684  84.3477     12.53    82.2499     12.9669  49.3512    8.77113     7.8692      8.77113     
1 1 1 22 20 51 o 2  23.1282 6.10755 7.28119     9.06144  12.184      10.05    9.00112    292.352     0.770054    112.352     
1 1 1 22 20 52 f 0  19.8979 5.78722 5.80514     9.51492  3.48827     9.06747  9.7052     202.276     0           0           
1 1 1 22 20 53 o 8  24.2828 6.39689 12.8091     10.2503  9.34729     10.7217  3.26533    109.813     22.3701     289.813     
1 1 1 22 20 54 o 5  64.3421 4.58714 78.4619     13.2387  82.8097     15.8416  38.8482    222.928     9.56178     42.9278     
1 1 1 22 20 55 o 5  65.9745 4.87994 87.3888     15.2715  83.9235     16.4404  60.75      258.991     33.545      258.991     
1 1 1 22 20 56 o 1  70.1697 4.97814 105.512     15.7231  89.3965     18.2199  66.7094    17.3069     39.7619     17.3069     
1 1 1 22 20 57 f 0  41.0003 7.08479 30.5317     14.4155  45.7499     14.7898  23.3323    147.844     0           0           
1 1 1 22 20 58 o 15 77.6306 4.69123 126.086     17.5482  112.257     18.4461  67.8302    281.067     31.5534     281.067     
1 1 1 22 20 59 o 18 22.6178 7.05791 5.50464     13.3367  2.74936     18.2155  9.18812    131.424     0.920291    311.424     
1 1 1 22 20 60 o 7  20.7754 6.7644  0.28826     17.9212  -3.08306    14.372   5.38245    323.198     1.97603     143.198     
1 1 1 22 20 61 o 17 35.615  7.23023 49.4259     15.2656  12.1962     16.9833  25.0102    225.544     11.1458     225.544     
1 1 1 22 20 62 o 19 27.3237 7.56801 5.19332     14.881   29.9604     16.9318  11.7931    247.702     3.80646     67.7023     
1 1 1 22 20 63 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 20 64 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 21 0  o 17 24.3055 8.0297  15.775      10.9115  15.775      10.9115  3.72513    8.65133e-06 37.8091     8.65134e-06 
1 1 1 22 21 1  f 0  40.4794 5.69082 26.521      11.378   35.7798     10.8474  1.83206    31.5419     0           0           
1 1 1 22 21 2  o 17 58.9958 4.09781 66.0497     11.8984  60.7975     11.9954  36.9596    218.939     9.3292      38.9393     
1 1 1 22 21 3  o 6  45.7061 5.34405 44.0561     11.7571  34.4329     11.7553  32.5904    220.932     7.95544     220.932     
1 1 1 22 21 4  o 8  54.7414 4.64826 65.2543     12.6301  45.8103     12.0889  22.7576    320.175     32.311      140.175     
1 1 1 22 21 5  o 2  101.26  3.3555  176.546     16.9967  192.421     16.936   72.1936    349.618     5.00924     169.618     
1 1 1 22 21 6  o 1  28.6333 6.06192 14.1204     9.40733  16.5971     9.38301  8.60009    298.385     10.1716     118.385     
1 1 1 22 21 7  o 1  79.4462 3.34248 109.822     13.2382  117.579     13.2444  45.3179    352.276     25.7826     172.276     
1 1 1 22 21 8  o 15 24.5849 6.10635 10.1341     9.25655  10.0457     9.37916  2.5412     228.714     19.5041     48.7145     
1 1 1 22 21 9  o 2  27.1769 6.40964 11.8501     10.4973  14.4014     10.0406  8.48622    83.1556     7.85907     263.156     
1 1 1 22 21 10 o 19 106.922 3.22923 205.46      16.8637  205.479     17.6534  88.8647    181.175     19.886      181.175     
1 1 1 22 21 11 o 19 24.188  6.06578 12.884      9.31506  5.60615     9.55526  2.47374    137.401     1.87239     317.401     
1 1 1 22 21 12 o 8  128.353 3.01813 305.01      18.9742  286.247     19.7497  77.1115    238.953     36.7445     58.9534     
1 1 1 22 21 13 o 10 185.782 3.13909 619.885     29.9564  618.717     28.4774  149.004    292.09      20.8426     292.09      
1 1 1 22 21 14 o 10 110.146 2.9858  220.229     16.4158  215.371     16.4832  48.8376    285.628     65.771      105.628     
1 1 1 22 21 15 o 15 19.7705 5.59957 4.05104     8.50103  3.75053     8.3484   0.620562   84.4522     16.1967     84.4522     
1 1 1 22 21 16 o 11 116.004 2.84187 243.941     16.5035  238.843     16.4876  102.95     50.9817     35.0193     50.9817     
1 1 1 22 21 17 o 17 178.951 2.81921 570.823     25.2736  576.831     25.2912  161.127    233.809     56.4636     233.809     
1 1 1 22 21 18 o 7  123.294 3.0515  288.095     19.1828  258.954     18.4592  100.85     229.321     19.7708     229.321     
1 1 1 22 21 19 o 12 30.8041 6.43947 15.8672     10.6085  20.574      10.7597  13.1228    252.822     10.1805     72.8216     
1 1 1 22 21 20 o 6  71.6314 3.31462 101.95      12.1409  84.1424     11.4934  58.9749    304.625     15.2287     304.625     
1 1 1 22 21 21 o 1  58.068  3.73455 48.5943     10.4804  75.9725     10.5514  28.5498    332.929     26.1391     152.929     
1 1 1 22 21 22 o 13 26.2931 5.73129 12.7656     7.97086  13.2533     8.62934  3.50438    9.65094     24.946      189.651     
1 1 1 22 21 23 o 3  67.6675 3.23588 78.3391     10.5973  87.6623     11.2199  45.9609    272.787     5.31301     92.7869     
1 1 1 22 21 24 o 18 38.7287 4.79678 26.5029     8.58525  30.2806     9.36317  5.51082    345.409     42.8283     165.409     
1 1 1 22 21 25 o 9  43.9778 4.35259 31.6507     8.91504  40.7382     9.70734  37.2787    72.2485     19.5835     72.2485     
1 1 1 22 21 26 o 16 119.224 2.75505 255.313     15.6637  256.038     17.1787  99.3185    142.651     24.3584     142.651     
1 1 1 22 21 27 o 15 34.265  5.95412 13.8233     10.0087  32.9227     11.0673  20.8639    51.2666     0.0193519   231.262     
1 1 1 22 21 28 o 10 72.6096 3.06847 90.0891     11.1062  100.962     11.0921  52.6391    247.337     1.09328     247.337     
1 1 1 22 21 29 o 3  146.231 2.63205 382.53      19.2344  386.224     19.3107  138.302    224.052     63.2247     224.052     
1 1 1 22 21 30 o 11 25.9283 5.63763 16.206      8.20068  9.11873     8.24078  7.02773    38.0717     16.717      218.072     
1 1 1 22 21 31 o 4  128.157 2.67123 295.066     17.1188  296.097     17.1556  107.71     119.464     29.1124     119.464     
1 1 1 22 21 32 o 2  146.909 2.62669 397.774     19.3299  378.606     19.3208  119.264    122.905     24.75       122.905     
1 1 1 22 21 33 f 0  48.5899 4.03875 44.8285     9.69365  42.8802     9.5978   69.3584    135.066     0           0           
1 1 1 22 21 34 o 17 22.1101 5.64926 4.76418     8.05084  11.0683     8.33116  5.43878    255.886     11.6158     75.8855     
1 1 1 22 21 35 o 11 21.3921 5.45554 0.946231    8.08558  12.2021     7.98838  6.05793    34.856      6.69992     214.856     
1 1 1 22 21 36 o 11 44.4255 4.54259 38.3293     9.62356  36.3643     9.99273  36.6949    7.81279     14.3424     7.8128      
1 1 1 22 21 37 o 12 27.2435 5.89169 13.0308     9.16815  15.9155     8.51915  10.0529    11.4461     5.1751      11.4461     
1 1 1 22 21 38 o 11 25.2921 5.86267 13.5507     8.60144  10.864      8.60333  5.49435    353.318     21.1614     173.318     
1 1 1 22 21 39 f 0  82.1155 3.10052 119.285     12.4489  126.904     12.9785  40.4866    9.45308     0           0           
1 1 1 22 21 40 f 0  17.1916 5.22415 1.81558     8.08764  -0.699243   8.17471  13.9245    105.077     0           0           
1 1 1 22 21 41 o 2  51.6621 4.05398 48.8906     10.2335  51.6869     10.402   37.0518    305.066     2.51247     305.066     
1 1 1 22 21 42 o 19 58.0518 3.73282 61.3839     10.7401  64.5431     10.7351  47.904     282.411     15.2508     282.411     
1 1 1 22 21 43 o 5  60.6358 3.71726 62.6658     11.1142  75.1293     11.1738  46.7586    308.268     9.04879     308.268     
1 1 1 22 21 44 o 8  55.599  3.9571  54.1315     10.8723  62.8748     10.8108  53.6918    234.963     32.2555     234.963     
1 1 1 22 21 45 o 18 24.4871 5.79054 5.48404     8.90643  17.0711     8.82827  2.93094    289.147     25.2706     109.147     
1 1 1 22 21 46 o 11 50.4242 4.33622 45.9075     10.638   52.1478     10.7917  30.5951    33.749      8.02679     213.749     
1 1 1 22 21 47 o 18 17.4118 5.32562 2.59078     8.65294  -1.12394    8.49352  2.48819    255.102     3.28846     75.1022     
1 1 1 22 21 48 o 19 47.6644 4.60875 48.2396     10.6853  40.7377     10.6739  37.6903    287.116     12.0445     287.116     
1 1 1 22 21 49 o 3  48.2531 5.56391 47.7785     13.8183  47.18       12.0952  45.9915    143.576     34.1897     143.576     
1 1 1 22 21 50 o 6  35.0721 6.48108 20.154      11.7153  33.5915     11.8313  19.7933    133.633     4.5178      313.633     
1 1 1 22 21 51 o 6  56.9555 4.78645 61.6462     12.9685  66.1884     13.8251  39.9438    330.03      2.80187     330.03      
1 1 1 22 21 52 o 7  20.5482 6.09004 5.09277     10.6649  3.83464     10.4509  1.28135    330.557     21.155      150.557     
1 1 1 22 21 53 f 0  18.7227 5.73413 -0.461383   9.95349  3.23404     9.95944  16.3457    354.072     0           0           
1 1 1 22 21 54 o 8  99.0216 3.38783 187.312     16.7681  179.207     16.7489  89.6684    113.863     43.325      113.863     
1 1 1 22 21 55 o 8  22.5721 6.32052 13.1647     11.0473  2.73668     10.8442  10.3775    165.124     0.452985    165.125     
1 1 1 22 21 56 o 17 30.8722 6.98574 24.737      11.5558  18.6551     13.4018  15.5932    53.6633     7.06706     233.663     
1 1 1 22 21 57 o 5  18.5777 6.00455 -19.1099    13.3127  5.80605     13.2368  3.78081    3.92433     9.86526     183.924     
1 1 1 22 21 58 o 9  23.1564 6.90098 16.0825     14.5654  -1.12255    13.8203  9.03589    159.959     1.07281     339.959     
1 1 1 22 21 59 o 13 22.3384 6.92759 5.37361     14.8638  7.08678     14.8716  5.74203    340.636     0.802043    160.636     
1 1 1 22 21 60 o 17 25.1573 7.96201 23.355      21.2195  -8.74706    22.5701  6.41678    333.216     0.73543     333.216     
1 1 1 22 21 61 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 21 62 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 22 0  o 13 15.3977 7.0487  -0.216254   12.8223  -0.216254   12.8223  26.0142    180         64.7686     180         
1 1 1 22 22 1  o 15 31.3073 6.86285 22.1531     9.42864  22.1531     9.42864  20.0559    30          3.73333     30          
1 1 1 22 22 2  o 4  112.648 2.9501  227.149     16.6022  227.149     16.6022  109.593    60          49.0849     60          
1 1 1 22 22 3  o 17 9.81527 4.80584 -6.48167    8.1173   -6.48167    8.1173   12.257     90          29.5182     90          
1 1 1 22 22 4  o 13 22.0335 7.38704 13.0494     9.26275  13.0494     9.26275  19.4391    300         71.4363     300         
1 1 1 22 22 5  o 6  93.2326 3.75085 157.051     17.3942  157.051     17.3942  62.3097    150         16.0822     330         
1 1 1 22 22 6  o 19 65.8424 3.89206 79.2338     12.6284  79.2338     12.6284  63.7046    180         28.0831     180         
1 1 1 22 22 7  o 8  25.8217 8.3147  17.8716     11.6626  17.8716     11.6626  4.33316    210         27.2085     30          
1 1 1 22 22 8  o 13 32.8063 7.63042 25.0181     11.1318  25.0181     11.1318  14.1686    60          20.0261     240         
1 1 1 22 22 9  o 5  19.4544 7.45301 10.0087     10.1795  10.0087     10.1795  0.850406   270         5.78889     90          
1 1 1 22 22 10 o 12 12.223  5.69045 -1.36892    8.8809   -1.36892    8.8809   1.51089    120         4.38406     120         
1 1 1 22 22 11 f 0  99.8576 2.84656 178.647     14.1923  178.647     14.1923  79.8264    150         0           0           
1 1 1 22 22 12 o 10 12.8206 5.80241 0.763922    8.3745   0.763922    8.3745   7.65823    180         22.9762     180         
1 1 1 22 22 13 o 14 63.508  3.72726 73.7064     11.6679  73.7064     11.6679  71.4726    30          47.7096     30          
1 1 1 22 22 14 o 8  11.1142 5.25948 -2.64552    8.11837  -2.64552    8.11837  9.08999    240         24.0255     240         
1 1 1 22 22 15 o 19 24.9585 7.31454 15.9979     9.0994   15.9979     9.0994   8.28266    90          15.2432     270         
1 1 1 22 22 16 o 11 38.4437 5.82593 30.1085     9.85576  30.1085     9.85576  3.19705    300.001     2.3838      300.001     
1 1 1 22 22 17 o 19 98.0701 2.99101 172.696     14.6376  172.696     14.6376  87.1388    150         27.3513     150         
1 1 1 22 22 18 o 2  15.2787 6.64069 3.82282     9.84113  3.82282     9.84113  5.13967    180         22.4935     180         
1 1 1 22 22 19 o 5  12.8164 5.83948 0.406914    8.66412  0.406914    8.66412  3.21613    210         10.5357     210         
1 1 1 22 22 20 o 17 65.9102 3.83355 79.5561     12.4585  79.5561     12.4585  60.0049    60          21.568      60          
1 1 1 22 22 21 o 3  18.3729 7.13333 8.89696     9.45367  8.89696     9.45367  0.368643   270         18.5906     270         
1 1 1 22 22 22 o 7  59.3834 3.95568 65.0451     11.5177  65.0451     11.5177  43.2128    120         2.06288     300         
1 1 1 22 22 23 o 17 117.758 3.15729 249.188     18.5714  249.188     18.5714  109.497    150         43.7377     150         
1 1 1 22 22 24 o 16 89.5426 3.24119 144.681     14.4569  144.681     14.4569  43.0104    180         47.0699     8.65325e-06 
1 1 1 22 22 25 o 3  25.2565 7.05485 16.1068     8.58734  16.1068     8.58734  7.42625    30          20.4075     210         
1 1 1 22 22 26 o 1  11.0612 5.1918  -1.73866    7.63816  -1.73866    7.63816  0.116405   240.002     0.339082    240.002     
1 1 1 22 22 27 o 3  79.1728 3.72883 114.158     14.6419  114.158     14.6419  67.2945    90          17.4077     90          
1 1 1 22 22 28 o 17 64.9299 3.76651 77.318      12.0597  77.318      12.0597  63.2512    120         30.5489     120         
1 1 1 22 22 29 o 5  24.3399 7.20862 15.4245     8.81751  15.4245     8.81751  11.1404    330         8.05424     150         
1 1 1 22 22 30 o 8  17.6848 6.807   8.3628      8.53108  8.3628      8.53108  4.62821    360         31.9713     360         
1 1 1 22 22 31 o 1  21.4904 7.17118 12.627      8.72003  12.627      8.72003  3.21655    210         0.277938    30          
1 1 1 22 22 32 o 14 24.3113 7.22875 15.4752     8.85989  15.4752     8.85989  7.52476    240         19.2482     60          
1 1 1 22 22 33 o 18 27.0359 7.17505 18.1978     9.0773   18.1978     9.0773   15.1008    90          69.8138     90          
1 1 1 22 22 34 f 0  9.85079 4.79536 -5.24033    7.80093  -5.24033    7.80093  14.1091    300         0           0           
1 1 1 22 22 35 o 12 8.95212 4.45447 -8.33879    7.80585  -8.33879    7.80585  20.6497    150         51.6048     150         
1 1 1 22 22 36 o 11 14.1841 6.2047  3.28781     8.72322  3.28781     8.72322  0.190654   360         8.61978     180         
1 1 1 22 22 37 o 18 18.0937 6.91597 9.04758     8.74602  9.04758     8.74602  3.95553    210         1.80901     30          
1 1 1 22 22 38 o 3  56.1801 4.13213 59.2161     11.3195  59.2161     11.3195  52.6496    240         23.776      240         
1 1 1 22 22 39 o 11 22.9317 7.38685 14.5798     9.2052   14.5798     9.2052   13.9242    270         2.11831     270         
1 1 1 22 22 40 o 11 11.2282 5.32152 -2.36775    8.36796  -2.36775    8.36796  2.9811     120         12.9507     120         
1 1 1 22 22 41 o 4  98.4105 3.00004 175.468     14.7328  175.468     14.7328  79.2995    150         16.727      150         
1 1 1 22 22 42 o 3  23.328  7.41109 15.1546     9.25922  15.1546     9.25922  10.3481    180         11.3481     8.65585e-06 
1 1 1 22 22 43 o 6  25.6209 7.44542 17.5714     9.44756  17.5714     9.44756  15.9491    210         7.42851     210         
1 1 1 22 22 44 o 4  24.6761 7.42987 16.6068     9.33949  16.6068     9.33949  4.88149    60          25.2216     240         
1 1 1 22 22 45 o 16 29.7392 7.80727 22.7857     10.8053  22.7857     10.8053  18.4764    90          11.7201     90          
1 1 1 22 22 46 o 6  46.9765 5.35655 44.1229     11.6275  44.1229     11.6275  41.4842    120         16.0831     120         
1 1 1 22 22 47 o 17 51.6823 4.95147 52.2058     12.1608  52.2058     12.1608  42.7949    150         12.1649     150         
1 1 1 22 22 48 o 6  15.4414 6.75264 4.66231     10.3245  4.66231     10.3245  0.144898   180         12.0243     360         
1 1 1 22 22 49 o 5  19.3851 7.56647 10.9793     10.6989  10.9793     10.6989  2.65393    30.0001     0.430985    210         
1 1 1 22 22 50 o 12 75.9614 4.01062 107.527     15.0672  107.527     15.0672  63.8028    240         20.5479     240         
1 1 1 22 22 51 o 8  71.4923 4.65286 97.1483     16.3281  97.1483     16.3281  55.379     90          10.2797     90          
1 1 1 22 22 52 o 15 16.4391 7.14274 5.91994     11.3769  5.91994     11.3769  3.76857    120         8.04146     300         
1 1 1 22 22 53 o 14 78.4107 4.24236 115.713     16.4401  115.713     16.4401  81.5034    330         53.4369     330         
1 1 1 22 22 54 o 5  48.5227 6.31283 49.3714     13.8187  49.3714     13.8187  36.9256    360         6.24671     360         
1 1 1 22 22 55 o 6  42.8075 7.72508 42.3927     14.3254  42.3927     14.3254  41.08      210         23.0433     210         
1 1 1 22 22 56 o 1  15.2725 7.1751  0.487549    14.6446  0.487549    14.6446  5.97759    60          30.2459     60          
1 1 1 22 22 57 o 19 19.3278 8.33977 11.1903     15.2682  11.1903     15.2682  4.54773    90          8.25736     270         
1 1 1 22 22 58 o 15 17.7706 8.02257 7.32016     15.8869  7.32016     15.8869  1.63883    300         5.97457     120         
1 1 1 22 22 59 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 22 22 60 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 0  0  o 18 313.143 4.35707 1739.86     68.3153  1739.86     68.3153  201.154    360         55.77       180         
1 1 1 23 0  1  o 5  311.627 3.21894 1722.21     50.2458  1722.21     50.2458  264.824    60          73.76       60          
1 1 1 23 0  2  o 2  123.802 2.28815 272.156     14.1743  272.156     14.1743  72.1136    120         12.8042     120         
1 1 1 23 0  3  o 14 152.985 2.35696 415.335     18.0508  415.335     18.0508  68.94      360         84.6808     180         
1 1 1 23 0  4  o 14 246.231 2.93058 1075.41     36.1393  1075.41     36.1393  233.276    60          106.745     60          
1 1 1 23 0  5  o 18 368.627 3.45313 2409.7      63.766   2409.7      63.766   307.049    300         75.1794     300         
1 1 1 23 0  6  o 14 429.047 3.77799 3264.39     81.2035  3264.39     81.2035  326.836    360         26.6138     360         
1 1 1 23 0  7  o 9  197.704 2.46567 693.311     24.4122  693.311     24.4122  158.815    240         29.4513     240         
1 1 1 23 0  8  o 9  243.459 2.71874 1051.2      33.152   1051.2      33.152   58.7073    120         238.13      300         
1 1 1 23 0  9  o 14 382.499 3.6592  2594.71     70.113   2594.71     70.113   429.783    360         301.233     360         
1 1 1 23 0  10 o 7  63.3711 2.52555 71.8434     7.9619   71.8434     7.9619   8.25476    60          48.2631     60          
1 1 1 23 0  11 o 18 241.371 2.79201 1033.34     33.7521  1033.34     33.7521  148.549    300         54.8409     120         
1 1 1 23 0  12 o 3  212.186 2.94623 798.863     31.3016  798.863     31.3016  221.788    2.60919e-06 138.305     2.60919e-06 
1 1 1 23 0  13 o 17 484.178 5.2545  4160.37     127.429  4160.37     127.429  296.274    60          112.489     240         
1 1 1 23 0  14 o 8  403.498 4.46887 2888.78     90.3149  2888.78     90.3149  353.014    300         118.911     300         
1 1 1 23 0  15 o 5  138.429 2.56554 340.301     17.7702  340.301     17.7702  61.7395    180         76.1878     8.65193e-06 
1 1 1 23 0  16 o 2  361.078 4.06056 2313.18     73.4345  2313.18     73.4345  125.358    60          273.806     240         
1 1 1 23 0  17 o 10 200.207 2.85262 711.275     28.5947  711.275     28.5947  205.6      120         161.565     120         
1 1 1 23 0  18 o 8  365.034 4.23449 2364.49     77.416   2364.49     77.416   218.523    180         92.2265     360         
1 1 1 23 0  19 o 16 338.514 3.82501 2033.1      64.8514  2033.1      64.8514  247.897    60          5.47454     59.9999     
1 1 1 23 0  20 o 11 465.982 4.37242 3852.41     102.066  3852.41     102.066  298.731    300         76.7613     120         
1 1 1 23 0  21 o 14 436.792 4.18773 3384.81     91.6292  3384.81     91.6292  394.66     9.13272e-07 158.047     9.13272e-07 
1 1 1 23 0  22 o 12 403.481 3.90916 2888.03     79.0102  2888.03     79.0102  313.509    240         44.5796     240         
1 1 1 23 0  23 o 14 798.407 6.94103 11324.4     277.627  11324.4     277.627  718.43     300         285.768     300         
1 1 1 23 0  24 o 6  148.716 2.46625 392.619     18.3576  392.619     18.3576  58.3913    0           45.4903     0           
1 1 1 23 0  25 o 6  12.9513 5.20775 3.85002     5.25913  3.85002     5.25913  61.0295    240         125.037     240         
1 1 1 23 0  26 o 9  93.9092 2.43267 156.928     11.4137  156.928     11.4137  52.3419    300         8.21148     120         
1 1 1 23 0  27 o 7  446.658 4.38487 3540.36     98.1078  3540.36     98.1078  361.156    1.09424e-10 81.8987     1.09424e-10 
1 1 1 23 0  28 o 8  145.541 2.5885  376.154     18.8527  376.154     18.8527  69.8599    240         68.6284     60          
1 1 1 23 0  29 o 2  74.5059 2.85485 99.2632     10.5874  99.2632     10.5874  30.7152    120         22.394      300         
1 1 1 23 0  30 o 11 170.706 2.97811 517.519     25.442   517.519     25.442   141.18     180         38.8004     180         
1 1 1 23 0  31 o 17 235.457 2.97926 983.754     35.1291  983.754     35.1291  130.674    240         74.0901     60          
1 1 1 23 0  32 o 19 161.069 2.63027 460.597     21.2056  460.597     21.2056  105.631    300         17.7904     120         
1 1 1 23 0  33 o 19 108.06  2.92825 207.916     15.8045  207.916     15.8045  79.4693    3.41153e-05 47.1053     3.41153e-05 
1 1 1 23 0  34 o 15 8.94855 4.22898 -1.85663    5.21773  -1.85663    5.21773  118.218    240         239.991     240         
1 1 1 23 0  35 o 2  227.799 2.85458 920.809     32.5646  920.809     32.5646  183.577    120         44.9852     120         
1 1 1 23 0  36 o 5  55.8315 2.76895 56.07       7.65825  56.07       7.65825  2.62879    180         13.3955     360         
1 1 1 23 0  37 o 8  219.725 2.7122  856.653     29.8444  856.653     29.8444  195.153    240         80.7904     240         
1 1 1 23 0  38 o 7  80.6455 2.55225 115.98      10.2677  115.98      10.2677  40.66      300         0.130532    120         
1 1 1 23 0  39 o 1  121.385 2.36941 261.771     14.3885  261.771     14.3885  36.9898    180         96.2537     360         
1 1 1 23 0  40 o 10 365.848 3.51318 2375.11     64.3845  2375.11     64.3845  233.454    60          45.164      240         
1 1 1 23 0  41 o 15 26.764  5.57395 15.6087     6.4974   15.6087     6.4974   83.9133    120         194.43      120         
1 1 1 23 0  42 o 17 42.1298 3.82306 33.0053     7.70756  33.0053     7.70756  0.911151   180         5.00291     180         
1 1 1 23 0  43 o 10 53.6711 3.27695 52.2207     8.65654  52.2207     8.65654  2.16023    240         4.48885     60          
1 1 1 23 0  44 o 11 293.691 3.37977 1531.26     49.714   1531.26     49.714   208.705    120         10.1343     120         
1 1 1 23 0  45 f 0  156.483 2.7718  435.054     21.7057  435.054     21.7057  144.478    180         0           0           
1 1 1 23 0  46 o 2  64.7985 2.87962 75.3475     9.26537  75.3475     9.26537  32.0296    60          7.2029      60          
1 1 1 23 0  47 o 1  8.82255 4.27675 -4.09797    6.05572  -4.09797    6.05572  42.2069    120         86.8549     120         
1 1 1 23 0  48 o 18 65.6458 3.11863 77.4914     10.1517  77.4914     10.1517  19.8198    4.04586e-07 49.1468     180         
1 1 1 23 0  49 o 3  116.274 2.68476 240.595     15.6063  240.595     15.6063  122.11     60          89.0471     60          
1 1 1 23 0  50 o 13 82.3477 2.95587 121.263     12.1261  121.263     12.1261  40.8122    300         30.8833     300         
1 1 1 23 0  51 o 9  79.8763 2.98781 114.192     11.8831  114.192     11.8831  49.7371    8.50812e-07 8.67519     180         
1 1 1 23 0  52 o 1  203.148 3.094   733.787     31.4658  733.787     31.4658  157.851    240         39.9023     240         
1 1 1 23 0  53 o 11 166.297 2.69599 491.645     22.4412  491.645     22.4412  119.952    300         14.7889     300         
1 1 1 23 0  54 o 19 38.988  4.98447 29.5813     8.79464  29.5813     8.79464  1.75       360         50.4184     360         
1 1 1 23 0  55 o 12 43.3042 4.16247 35.1818     8.56194  35.1818     8.56194  5.70274    59.9999     0.490527    240         
1 1 1 23 0  56 o 15 22.6489 6.52295 12.804      7.26912  12.804      7.26912  12.1464    120         36.6599     120         
1 1 1 23 0  57 o 18 142.446 2.49875 361         17.8127  361         17.8127  105.76     2.40951e-06 21.0235     2.40951e-06 
1 1 1 23 0  58 o 10 78.3435 2.80661 109.922     10.9542  109.922     10.9542  71.3069    240         39.1635     240         
1 1 1 23 0  59 o 4  160.211 2.63775 456.902     21.1521  456.902     21.1521  103.941    120         5.00304     300         
1 1 1 23 0  60 o 17 9.18811 4.43519 -3.81959    6.36275  -3.81959    6.36275  5.13014    8.65096e-06 11.5032     8.65096e-06 
1 1 1 23 0  61 o 1  141.39  2.60538 356.213     18.4325  356.213     18.4325  85.4293    60          15.7762     240         
1 1 1 23 0  62 o 2  17.446  6.47358 8.03913     7.47024  8.03913     7.47024  14.0507    300         45.8638     300         
1 1 1 23 0  63 o 1  104.834 2.69055 196.402     14.093   196.402     14.093   76.9146    180         16.3938     180         
1 1 1 23 0  64 o 12 12.7709 5.65788 1.78442     7.49066  1.78442     7.49066  10.038     60          27.1248     60          
1 1 1 23 0  65 o 6  17.5294 6.54298 8.16292     7.66644  8.16292     7.66644  1.19205    120         8.47613     120         
1 1 1 23 0  66 o 16 177.912 2.98165 565.706     26.5504  565.706     26.5504  123.753    180         16.7478     180         
1 1 1 23 0  67 o 14 182.294 2.93768 593.884     26.8058  593.884     26.8058  135.396    240         35.2184     240         
1 1 1 23 0  68 o 16 25.8751 7.38308 17.0201     9.33815  17.0201     9.33815  9.58884    120         4.42925     300         
1 1 1 23 0  69 o 5  23.0099 7.34002 14.135      9.08371  14.135      9.08371  3.22861    7.44964e-05 0.78117     180         
1 1 1 23 0  70 o 8  50.6468 4.70065 48.6872     11.3611  48.6872     11.3611  50.1666    60          37.6771     60          
1 1 1 23 0  71 o 11 96.2432 3.02679 166.792     14.5328  166.792     14.5328  48.1462    120         26.197      300         
1 1 1 23 0  72 f 0  63.0994 3.62966 73.079      11.2972  73.079      11.2972  22.4428    180         0           0           
1 1 1 23 0  73 o 16 16.3537 6.49241 6.94546     8.03748  6.94546     8.03748  0.939278   60          7.76384     240         
1 1 1 23 0  74 o 3  33.8493 6.30877 24.984      9.24587  24.984      9.24587  25.2793    120         15.245      120         
1 1 1 23 0  75 o 12 57.7091 4.66199 63.1676     13.0278  63.1676     13.0278  36.4986    360         0.726326    360         
1 1 1 23 0  76 o 1  21.6721 7.74113 13.4688     10.4216  13.4688     10.4216  5.71709    60          4.44994     240         
1 1 1 23 0  77 o 10 73.8738 3.9798  100.898     14.5321  100.898     14.5321  41.3694    120         9.00178     300         
1 1 1 23 0  78 o 5  25.4662 8.14359 18.1711     11.1827  18.1711     11.1827  10.6488    4.38788e-08 5.28714     180         
1 1 1 23 0  79 o 9  88.6055 3.73951 143.845     16.4681  143.845     16.4681  76.0145    60          42.9385     60          
1 1 1 23 0  80 o 11 16.9968 7.3062  6.26264     11.6219  6.26264     11.6219  0.327789   300         0.604069    120         
1 1 1 23 0  81 o 4  51.7093 7.57866 57.203      17.3287  57.203      17.3287  35.8434    180         8.58645     180         
1 1 1 23 0  82 f 0  19.5968 8.26945 10.258      14.3416  10.258      14.3416  5.99358    240         0           0           
1 1 1 23 0  83 o 11 24.7117 9.71116 20.1497     17.7611  20.1497     17.7611  8.5089     300         2.00708     120         
1 1 1 23 0  84 o 4  27.2071 10.4298 25.9276     19.9477  25.9276     19.9477  1.95634    4.32793e-05 0.390106    4.32793e-05 
1 1 1 23 0  85 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 1  0  o 10 242.148 2.66052 1039.88     32.2678  1039.88     32.2678  112.217    180         130.114     8.65755e-06 
1 1 1 23 1  1  o 13 508.669 4.38984 4586.73     111.898  4593.03     111.909  370.3      272.366     2.94563     272.366     
1 1 1 23 1  2  o 17 555.279 4.68448 5466.9      130.353  5474.09     130.36   403.442    278.432     0.397854    278.431     
1 1 1 23 1  3  o 8  422.986 3.80435 3192.2      79.123   3153.7      82.1148  300.643    137.686     9.5181      317.686     
1 1 1 23 1  4  o 13 359.845 3.45798 2315.05     66.035   2277.02     58.5141  260.537    289.29      4.58403     289.29      
1 1 1 23 1  5  o 14 201.778 2.70308 714.984     27.8437  728.467     26.8014  142.852    290.931     10.6207     290.931     
1 1 1 23 1  6  o 4  327.665 3.24525 1936.45     52.2567  1870.98     54.2564  185.186    126.055     99.8344     306.055     
1 1 1 23 1  7  o 15 244.756 2.75787 1064.19     33.1714  1059.69     34.468   100.229    7.61804     146.932     187.618     
1 1 1 23 1  8  o 1  514.272 4.54684 4666.71     112.588  4718.26     121.648  340.638    226.303     64.0436     46.303      
1 1 1 23 1  9  o 10 336.103 3.51816 1993.2      57.938   2013.23     60.5613  328.483    240.113     183.854     240.113     
1 1 1 23 1  10 f 0  489.719 4.98431 4280.81     122.309  4232.34     122.336  347.346    198.227     0           0           
1 1 1 23 1  11 o 9  379.939 4.18295 2572.25     79.6342  2549.46     79.6541  342.428    158.862     143.229     158.862     
1 1 1 23 1  12 o 13 350.843 3.93493 2181.3      69.1666  2185.48     69.2031  194.93     211.438     113.596     31.4376     
1 1 1 23 1  13 o 7  278.024 3.71571 1401.7      48.7088  1340.59     54.5199  221.881    12.1518     53.7211     12.1519     
1 1 1 23 1  14 o 11 552.523 5.66396 5459.95     160.918  5384.86     152.685  399.665    66.7159     0.984739    66.7163     
1 1 1 23 1  15 o 8  197.488 2.98802 690.745     28.8395  692.292     30.2888  123.715    251.334     22.5028     71.3338     
1 1 1 23 1  16 o 14 425.696 4.30949 3193.56     91.9625  3237.85     91.906   261.545    170.909     88.76       350.909     
1 1 1 23 1  17 o 4  116.077 2.58017 241.005     14.66    237.199     15.3078  35.945     44.3797     71.8399     224.38      
1 1 1 23 1  18 o 7  101.655 2.47324 185.217     11.8258  181.605     13.2777  30.8812    340.469     51.1588     160.469     
1 1 1 23 1  19 o 13 30.5215 4.19328 22.9755     5.88964  11.7974     6.35484  63.2277    343.5       141.605     343.5       
1 1 1 23 1  20 f 0  401.218 3.96162 2870.64     76.263   2841.83     82.8742  296.434    16.233      0           0           
1 1 1 23 1  21 o 13 390.51  3.88871 2708.76     72.8719  2702.73     79.1939  248.093    264.199     61.7751     84.1986     
1 1 1 23 1  22 o 8  255.193 2.93758 1157.14     35.988   1152.46     39.0779  222.059    155.665     90.8902     155.665     
1 1 1 23 1  23 o 12 213.081 2.6014  823.705     27.2519  786.494     28.2618  215.065    125.802     155.862     125.802     
1 1 1 23 1  24 o 15 128.433 2.47765 293.592     15.6173  291.722     16.2384  87.7158    32.4542     16.4031     32.4542     
1 1 1 23 1  25 o 14 162.748 2.61924 463.795     21.4116  475.496     21.3095  137.587    318.139     62.7716     318.139     
1 1 1 23 1  26 o 10 94.7198 2.59422 159.73      11.7505  158.903     12.8054  50.0007    296.413     9.17379     116.413     
1 1 1 23 1  27 o 16 380.679 3.91486 2561.02     71.2364  2583.08     78.0082  343.032    162.862     146.635     162.862     
1 1 1 23 1  28 o 2  261.894 3.23189 1210.67     39.2933  1222.78     45.3529  165.104    248.734     38.4174     68.7344     
1 1 1 23 1  29 o 13 177.671 2.87885 558.317     24.3911  561.4       26.8232  108.739    201.267     26.6129     21.2668     
1 1 1 23 1  30 o 15 520.593 4.79991 4807.87     119.914  4823.02     130.334  474.086    10.151      209.764     10.151      
1 1 1 23 1  31 o 5  220.288 2.82441 865.06      30.4767  856.307     31.8607  126.694    139.835     53.1547     319.835     
1 1 1 23 1  32 o 7  468.973 4.48716 3862        103.123  3952.57     107.785  367.271    97.5938     71.6206     97.5938     
1 1 1 23 1  33 o 10 215.082 2.89395 809.655     30.4323  831.56      31.9511  126.048    276.651     45.6126     96.6515     
1 1 1 23 1  34 o 6  90.6161 2.41648 143.549     10.6782  148.095     11.2293  47.9782    49.5808     0.297432    49.5806     
1 1 1 23 1  35 o 11 245.685 2.80762 1078.27     33.8216  1063.15     35.2876  196.79     134.558     55.1733     134.558     
1 1 1 23 1  36 o 11 114.145 2.52581 227.792     14.1089  234.824     14.7524  79.2522    245.737     22.4763     245.737     
1 1 1 23 1  37 o 17 70.5698 2.75278 83.4463     9.31515  93.9239     10.0848  16.5635    203.48      4.25914     23.4801     
1 1 1 23 1  38 f 0  51.5512 3.14756 48.5382     7.86184  46.4916     8.2254   45.8263    170.654     0           0           
1 1 1 23 1  39 o 17 119.987 2.46387 257.106     14.7787  253.996     14.8199  39.3857    275.295     79.2918     95.2947     
1 1 1 23 1  40 o 1  453.369 4.26698 3619.35     96.9271  3687.08     96.9605  332.165    274.003     33.0923     274.003     
1 1 1 23 1  41 o 3  136.358 2.52278 341.642     17.1421  318.639     17.2856  75.415     356.495     28.8953     176.495     
1 1 1 23 1  42 o 13 73.4335 2.76144 90.1944     9.99993  101.892     10.2354  29.0407    92.684      18.6877     272.684     
1 1 1 23 1  43 o 8  249.544 3.2436  1109.36     40.5536  1102.17     40.5728  200.836    153.789     61.2693     153.789     
1 1 1 23 1  44 o 16 219.234 3.06464 856.114     32.7352  850.747     34.574   126.35     278.543     46.7076     98.5429     
1 1 1 23 1  45 o 2  109.981 3.09156 212.469     16.111   217.867     17.8735  45.1461    52.6723     54.3951     232.672     
1 1 1 23 1  46 o 19 135.655 2.9217  333.79      19.1734  320.494     20.4514  105.602    30.7512     33.2903     30.7512     
1 1 1 23 1  47 o 18 87.7248 3.07887 150.765     12.0619  124.037     14.468   66.1113    317.434     33.3583     317.434     
1 1 1 23 1  48 f 0  92.6436 2.95772 158.048     12.3231  147.686     14.8478  30.7923    216.218     0           0           
1 1 1 23 1  49 o 7  173.455 2.73108 536.335     22.6194  532.724     24.8023  137.491    175.492     43.5318     175.492     
1 1 1 23 1  50 o 5  161.858 2.68227 470.584     20.6696  460.492     22.7682  134.038    182.019     53.7734     182.019     
1 1 1 23 1  51 o 6  32.5983 5.14928 25.4655     8.05764  14.336      8.52149  29.4236    25.0557     94.0424     25.0556     
1 1 1 23 1  52 o 3  166.594 2.87613 499.619     23.1705  488.255     24.7828  125.722    34.5384     30.0805     34.5384     
1 1 1 23 1  53 o 2  137.41  2.83135 331.194     17.3378  341.475     21.4516  113.023    116.583     46.7553     116.583     
1 1 1 23 1  54 o 17 78.3321 2.94271 120.774     10.5942  98.9674     12.1224  33.9863    209.066     30.851      29.0656     
1 1 1 23 1  55 o 1  69.5543 3.07796 91.6561     9.85456  81.6839     11.3212  27.9378    79.5194     30.0842     259.519     
1 1 1 23 1  56 o 1  114.748 2.65088 233.144     14.8659  236.35      15.5767  79.1955    94.94       10.2805     94.94       
1 1 1 23 1  57 o 12 31.0334 5.14394 18.1957     7.66249  18.0008     8.05842  0.730916   122.02      28.0064     122.02      
1 1 1 23 1  58 f 0  17.7095 5.05248 2.77541     6.70789  2.50449     7.1192   9.97321    77.157      0           0           
1 1 1 23 1  59 o 10 98.8204 2.95409 178.01      13.7676  171.547     15.3457  70.6696    253.178     13.2787     253.178     
1 1 1 23 1  60 o 17 155.419 2.70614 442.365     20.6556  420.634     21.4418  109.044    142.447     13.995      142.447     
1 1 1 23 1  61 o 1  43.8237 4.22719 39.2835     8.42925  31.5753     9.38876  19.2079    221.892     13.7676     41.892      
1 1 1 23 1  62 o 6  69.7485 3.21282 91.0855     11.1059  84.3541     11.2134  28.3814    346.393     32.2874     166.393     
1 1 1 23 1  63 o 12 66.3559 3.41824 87.8126     10.3568  71.9266     11.8939  37.7685    267.942     7.99162     87.9421     
1 1 1 23 1  64 o 13 131.75  2.54862 309.311     16.371   312.177     17.2442  105.218    282.307     40.4728     282.307     
1 1 1 23 1  65 o 16 100.862 2.95361 194.63      15.6749  171.773     14.1319  68.4389    303.586     7.82663     303.586     
1 1 1 23 1  66 o 13 42.8709 4.14178 31.2439     8.54077  36.9498     8.75221  17.8246    81.9991     15.6947     261.999     
1 1 1 23 1  67 o 2  76.0094 3.01178 110.824     12.5869  97.9559     10.2542  41.6759    37.5828     12.5619     217.583     
1 1 1 23 1  68 o 18 77.3086 3.65862 104.956     14.9865  113.01      13.0199  53.6478    352.919     10.4174     352.919     
1 1 1 23 1  69 o 6  33.8946 6.06946 19.2086     11.5656  25.78       9.36564  17.4169    293.264     2.44591     113.264     
1 1 1 23 1  70 o 12 34.7976 5.39861 21.1453     8.75698  26.2161     9.57619  15.8886    331.935     8.34335     151.935     
1 1 1 23 1  71 o 15 53.7256 4.1013  44.4328     10.3327  64.0374     11.2265  26.3551    285.481     13.3991     105.481     
1 1 1 23 1  72 o 19 19.9172 5.6347  -0.53409    7.60392  9.40862     9.82907  4.02896    341.494     29.2323     341.494     
1 1 1 23 1  73 o 4  37.3289 5.65275 30.4718     9.22294  25.1142     11.2671  25.7381    339.759     11.8829     339.759     
1 1 1 23 1  74 o 19 55.0028 4.84288 64.6584     12.1121  51.9394     13.5492  30.8354    336.333     4.91159     156.333     
1 1 1 23 1  75 o 17 29.3085 6.64209 16.0007     10.6521  19.258      11.451   14.157     199.01      2.83505     199.01      
1 1 1 23 1  76 f 0  27.6588 6.69179 4.71105     10.7935  24.9283     13.0563  17.9438    235.485     0           0           
1 1 1 23 1  77 o 7  31.804  6.98375 13.9098     11.0326  29.6893     14.0635  12.348     276.251     9.04409     96.2514     
1 1 1 23 1  78 o 7  72.2842 4.87345 113.288     16.2749  88.7539     17.9847  41.753     165.646     3.95966     345.646     
1 1 1 23 1  79 o 18 38.3786 7.3681  28.9168     13.214   35.6628     15.8687  24.6976    270.825     7.95472     270.825     
1 1 1 23 1  80 f 0  34.7125 7.37671 11.6021     13.9302  41.9214     16.2074  16.3471    68.4897     0           0           
1 1 1 23 1  81 o 19 28.1529 7.73765 15.2967     16.5438  16.2238     14.8386  8.73889    277.066     11.9809     97.0656     
1 1 1 23 1  82 o 15 25.7582 7.30995 21.9693     16.133   -0.180387   14.095   8.50535    179.519     5.70485     359.519     
1 1 1 23 1  83 o 10 41.2655 9.10925 53.3955     20.0259  38.1566     23.5214  19.6994    48.5859     5.22051     228.586     
1 1 1 23 1  84 o 5  23.5036 7.00888 15.8081     14.5071  -3.72645    15.4702  3.27864    335.933     11.6958     155.933     
1 1 1 23 1  85 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 2  0  o 1  387.894 3.8905  2668.91     75.593   2668.91     75.593   230.314    180         107.827     8.65053e-06 
1 1 1 23 2  1  o 19 99.3293 2.42767 174.579     12.3365  175.608     11.788   34.7787    301.595     19.8414     121.595     
1 1 1 23 2  2  o 10 274.961 3.18311 1330.64     42.8984  1350.41     44.8159  188.041    198.606     14.1327     18.6059     
1 1 1 23 2  3  o 16 169.19  2.58267 503.822     21.883   511.041     21.9125  117.628    4.11672     12.9846     4.11672     
1 1 1 23 2  4  o 6  157.99  2.50924 448.929     20.2952  436.031     19.4388  75.6855    135.32      60.7091     315.32      
1 1 1 23 2  5  o 11 243.732 3.11337 1053.01     38.0172  1053.55     38.0386  196.615    102.444     54.4641     102.444     
1 1 1 23 2  6  o 8  402.079 4.11643 2859.98     82.9405  2876        82.95    304.509    27.6141     29.5701     27.6141     
1 1 1 23 2  7  o 9  44.6683 3.6072  37.305      7.76226  34.4177     8.06683  32.3172    54.5126     86.3795     54.5126     
1 1 1 23 2  8  o 15 276.955 3.40848 1387.21     46.0052  1333.53     48.5133  152.971    48.7657     88.7544     228.766     
1 1 1 23 2  9  o 11 295.723 3.59605 1513.73     53.2798  1588.75     53.2832  172.075    145.04      78.1999     325.04      
1 1 1 23 2  10 o 10 258.428 3.25409 1190.03     42.1304  1178.54     42.1555  238.392    0.332137    120.845     0.332137    
1 1 1 23 2  11 o 3  536.452 5.5773  5101.97     145.934  5121.19     153.854  377.411    0.950691    22.4989     180.951     
1 1 1 23 2  12 o 12 179.335 2.84413 570.459     25.5298  569.953     25.5916  87.6928    160.558     70.3273     340.558     
1 1 1 23 2  13 o 15 400.033 4.06402 2876.76     75.8791  2801.99     86.5619  306.342    195.045     38.3741     195.046     
1 1 1 23 2  14 o 13 572.201 5.37339 5831.34     143.621  5799.49     163.821  377.338    267.386     73.927      87.3858     
1 1 1 23 2  15 o 9  246.656 2.99712 1085.79     37.8173  1071.82     36.2701  162.691    69.9595     20.3988     249.959     
1 1 1 23 2  16 o 17 104.924 2.45258 197.278     12.7966  193.483     12.9572  40.0343    223.293     4.5448      223.293     
1 1 1 23 2  17 o 19 325.317 3.61128 1878.07     60.2696  1876.59     57.4465  297.316    272.36      135.964     272.36      
1 1 1 23 2  18 o 18 118.373 2.49726 247.163     13.7899  250.103     15.7506  66.5273    31.1753     26.3351     31.1753     
1 1 1 23 2  19 o 4  211.158 2.69607 796.791     26.7038  784.337     30.2183  112.507    242.347     69.9733     62.347      
1 1 1 23 2  20 o 15 52.2504 3.031   48.0543     7.48062  49.4303     8.24318  48.5593    36.9948     150.006     36.9948     
1 1 1 23 2  21 o 1  276.158 3.0901  1345.86     40.8989  1359.18     44.5698  190.241    40.3368     10.2925     220.337     
1 1 1 23 2  22 o 8  427.718 4.29367 3269.45     87.7211  3225.54     96.0943  306.193    286.531     0.662579    106.531     
1 1 1 23 2  23 o 6  270.576 3.26697 1296.11     41.0227  1301.12     47.3596  170.315    213.35      42.9455     33.3502     
1 1 1 23 2  24 o 14 330.395 3.6885  1938.96     56.5339  1934.99     65.2858  221.212    121.478     28.5668     301.478     
1 1 1 23 2  25 o 7  188.611 2.79585 630.875     24.482   630.838     28.237   127.819    96.9074     5.88718     276.907     
1 1 1 23 2  26 o 5  310.398 3.53199 1703.4      50.889   1715.72     58.7389  213.343    178.687     13.863      358.687     
1 1 1 23 2  27 o 19 187.236 2.61655 617.207     22.9138  626.12      26.1071  130.627    32.4803     3.01262     32.4805     
1 1 1 23 2  28 o 10 127.551 2.50526 273.954     14.9625  303.839     17.0421  7.12402    28.6582     189.686     28.6582     
1 1 1 23 2  29 o 16 261.598 3.08206 1182.41     35.7912  1245.96     44.7342  227.89     125.578     91.1557     125.578     
1 1 1 23 2  30 o 17 380.336 3.79967 2533.43     69.3573  2602.56     75.4314  280.763    175.75      23.0869     175.75      
1 1 1 23 2  31 o 18 179.743 2.64296 564.425     21.7689  581.577     25.7345  146.208    328.313     50.2821     328.313     
1 1 1 23 2  32 o 4  348.899 3.79058 2188.37     64.693   2134.1      67.7791  289.5      279.056     88.6173     279.056     
1 1 1 23 2  33 o 19 202.213 2.77612 723.376     26.752   727.217     29.4547  160.256    50.0691     44.5329     50.0691     
1 1 1 23 2  34 o 6  108.436 2.48387 206.547     12.8795  210.953     14.0655  26.922     266.735     88.3241     86.7351     
1 1 1 23 2  35 o 9  192.608 2.76747 649.613     25.5311  666.577     27.8699  111.034    35.3215     42.2907     215.322     
1 1 1 23 2  36 o 15 443.208 4.1845  3456.1      89.0165  3523.88     96.773   333.455    66.9917     44.6557     66.9917     
1 1 1 23 2  37 o 9  202.066 2.79258 694.963     26.9537  754.338     29.6145  94.0167    276.837     90.3993     96.8367     
1 1 1 23 2  38 o 19 329.022 3.40507 1893.78     53.7937  1949.95     58.4581  233.462    330.754     8.88725     330.754     
1 1 1 23 2  39 o 9  173.762 2.64493 519.315     21.9106  552.172     24.151   134.777    343.35      37.2984     343.35      
1 1 1 23 2  40 o 1  253.241 3.16889 1145.7      38.2929  1131.09     42.0271  164.001    110.71      21.1482     290.71      
1 1 1 23 2  41 o 19 109.653 2.62885 204.932     13.6868  222.396     15.1678  69.1524    225.181     0.471745    225.18      
1 1 1 23 2  42 o 9  142.753 2.65832 369.752     17.6076  353.858     20.2459  69.1931    31.9651     53.2734     211.965     
1 1 1 23 2  43 o 15 255.996 3.11271 1158.45     38.0418  1169.13     41.7536  182.019    270.687     12.408      270.687     
1 1 1 23 2  44 o 16 262.837 3.21479 1243.57     38.1977  1210.99     46.0163  168.223    153.713     24.9399     333.713     
1 1 1 23 2  45 o 15 163.335 2.67221 464.751     20.837   482.572     22.8934  89.0656    356.729     43.1683     176.729     
1 1 1 23 2  46 o 5  150.073 2.74163 399.001     20.0603  401.474     21.1326  118.583    212.26      37.6819     212.26      
1 1 1 23 2  47 o 10 197.101 2.83847 687.011     26.7227  693.425     29.3033  155.199    43.4156     44.137      43.4156     
1 1 1 23 2  48 o 1  256.026 3.44594 1166.48     40.4965  1166.57     47.6365  181.988    223.45      15.39       223.45      
1 1 1 23 2  49 o 2  22.3148 5.23426 13.1468     6.84745  -0.107605   8.6388   8.70667    167.64      23.6419     167.64      
1 1 1 23 2  50 o 14 70.3685 3.11061 83.3806     10.1636  93.6864     11.6733  43.5012    214.988     5.56565     214.988     
1 1 1 23 2  51 o 11 79.0711 2.87529 111.323     10.5953  111.734     12.0677  43.8363    74.7003     11.1755     254.7       
1 1 1 23 2  52 o 19 68.6527 3.15835 83.7448     10.3539  84.9021     11.2466  23.3797    315.731     39.1074     135.731     
1 1 1 23 2  53 o 17 35.3388 4.64803 20.2677     7.49594  26.1486     8.37217  17.7591    261.456     74.5846     261.456     
1 1 1 23 2  54 o 12 41.3497 4.08193 33.9224     7.91624  28.606      8.42308  3.42705    41.8487     36.419      221.849     
1 1 1 23 2  55 o 7  15.2119 4.66253 -1.7808     6.18086  0.126696    6.94756  2.84688    305.415     6.66547     305.415     
1 1 1 23 2  56 o 5  121.751 2.52342 248.897     14.7136  279.957     16.056   94.5461    226.44      30.776      226.44      
1 1 1 23 2  57 o 2  20.8627 5.29076 6.21455     6.68676  7.35645     7.36792  3.86855    32.1409     16.4639     32.1409     
1 1 1 23 2  58 o 12 67.4751 3.12943 88.8084     10.1894  74.9926     10.7377  51.1149    37.9288     18.1558     37.9288     
1 1 1 23 2  59 o 9  82.3604 2.79415 113.89      10.947   129.246     12.06    58.3488    241.672     10.9995     241.672     
1 1 1 23 2  60 o 11 92.2565 2.79126 160.727     11.9785  144.357     13.5974  66.7912    290.092     14.5743     290.092     
1 1 1 23 2  61 f 0  98.6758 2.65392 165.97      12.5593  182.857     13.6475  71.2713    121.2       0           0           
1 1 1 23 2  62 o 16 134.216 2.66787 325.292     18.1017  319.872     17.7518  95.2754    109.879     15.6758     109.879     
1 1 1 23 2  63 o 17 104.642 2.88176 185.415     15.1058  208.284     15.0148  72.6462    104.344     10.2987     104.344     
1 1 1 23 2  64 o 14 45.432  3.95868 32.251      8.54829  44.1871     8.95418  20.7048    96.198      13.6256     276.198     
1 1 1 23 2  65 o 3  67.0635 3.5705  87.7065     11.7331  76.0527     12.0133  56.3054    56.1976     30.7398     56.1976     
1 1 1 23 2  66 o 18 40.6486 4.59472 29.8148     9.83841  32.1857     8.07483  13.9058    299.969     20.9723     119.969     
1 1 1 23 2  67 o 16 27.2551 5.4757  3.16039     11.1011  20.8669     7.26984  9.19797    148.896     8.41811     328.896     
1 1 1 23 2  68 o 3  72.7984 3.45665 97.9939     14.3662  95.0548     10.4073  50.4187    182.567     9.57513     182.567     
1 1 1 23 2  69 o 7  20.1839 5.79781 9.22268     10.7836  -1.46892    7.89467  3.42994    151.139     3.53361     331.139     
1 1 1 23 2  70 o 15 54.9081 4.23304 55.9624     12.0975  56.6446     10.7539  46.0002    148.045     26.7026     148.045     
1 1 1 23 2  71 o 17 30.3985 5.90614 20.6763     9.73549  16.4109     8.84686  17.4384    325.947     6.5423      325.947     
1 1 1 23 2  72 f 0  59.5024 3.77336 57.9599     11.0612  74.0291     11.0443  25.8622    48.4008     0           0           
1 1 1 23 2  73 o 14 29.1424 6.47724 11.3593     10.1295  23.1928     11.4815  11.0649    107.685     9.37436     287.685     
1 1 1 23 2  74 o 11 18.5801 5.67949 -3.34404    9.17537  4.28838     10.3987  1.89432    308.365     7.98291     128.365     
1 1 1 23 2  75 o 15 15.2577 5.02018 -10.4349    8.8305   -3.30856    9.82069  0.363986   1.69743     3.54154     1.69743     
1 1 1 23 2  76 o 6  24.4012 6.56625 5.03971     11.147   14.6552     11.5977  5.16855    309.903     0.621798    129.904     
1 1 1 23 2  77 o 18 17.445  5.55793 -9.32235    10.245   1.52208     10.6783  0.47034    127.076     1.82733     307.076     
1 1 1 23 2  78 o 9  23.7898 6.91157 0.734811    11.3686  14.1109     15.2609  5.63187    281.424     12.4832     101.424     
1 1 1 23 2  79 o 17 23.8014 6.54964 -3.33932    12.8332  16.593      11.9107  6.75614    111.321     9.82717     291.321     
1 1 1 23 2  80 f 0  43.5012 7.39934 55.0456     17.5715  30.8029     14.7697  18.0143    341.15      0           0           
1 1 1 23 2  81 o 13 23.82   7.10435 9.74683     14.9449  5.06704     14.1109  6.60133    35.3222     0.577725    215.322     
1 1 1 23 2  82 o 5  24.8243 7.14577 10.9669     14.8187  10.9551     13.1476  7.17588    213.949     4.84702     33.9493     
1 1 1 23 2  83 f 0  37.9044 7.13649 19.1739     14.5647  49.6119     15.2203  15.6649    212.689     0           0           
1 1 1 23 2  84 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 3  0  o 10 507.634 5.01111 4573.06     127.425  4573.06     127.425  419.515    7.33053e-06 94.38       7.33053e-06 
1 1 1 23 3  1  o 3  206.153 2.97747 743.219     29.165   763.914     32.3145  160.17     229.635     39.1523     229.635     
1 1 1 23 3  2  o 19 138.339 2.82799 341.981     18.4975  337.194     20.5998  93.1598    53.6803     25.5312     53.6803     
1 1 1 23 3  3  o 2  104.999 2.69456 200.117     14.8516  191.353     13.4498  42.674     316.279     24.5066     136.279     
1 1 1 23 3  4  o 9  374.648 4.33313 2503.01     81.3646  2478.45     81.3446  384.924    94.9122     237.526     94.9122     
1 1 1 23 3  5  o 16 50.2059 3.51432 41.9264     9.39107  48.486      7.79856  56.6883    310.184     157.373     310.184     
1 1 1 23 3  6  o 6  272.626 3.4418  1331        48.2906  1305.43     45.7429  192.399    85.2855     1.88008     265.286     
1 1 1 23 3  7  o 16 163.115 2.56854 477.026     21.005   466.349     20.9855  92.9247    67.5796     32.6631     247.58      
1 1 1 23 3  8  o 11 522.246 4.90633 4878        131.19   4806.69     125.601  334.616    350.868     89.7119     170.868     
1 1 1 23 3  9  o 16 244.373 2.91707 1062.81     35.7212  1054.93     35.7267  155.333    66.8632     33.9177     246.863     
1 1 1 23 3  10 o 13 399.414 3.7512  2838.71     75.0788  2821.41     75.0909  277.701    113.694     20.7052     293.694     
1 1 1 23 3  11 o 10 489.816 4.4625  4246.8      107.309  4269.97     111.737  285.036    201.142     140.338     21.1416     
1 1 1 23 3  12 o 19 331.191 3.48529 1936.16     57.833   1955        57.8594  300.326    169.498     130.971     169.498     
1 1 1 23 3  13 o 9  171.56  2.5229  511.768     21.2283  531.915     22.1552  102.977    184.973     26.0592     4.97332     
1 1 1 23 3  14 o 18 188.881 2.67276 637.751     25.786   627.327     24.8101  78.9896    304.164     105.363     124.164     
1 1 1 23 3  15 o 13 239.402 2.89932 1031.04     34.7798  1001.62     34.7833  209.757    55.8173     88.391      55.8173     
1 1 1 23 3  16 o 15 264.482 3.00516 1265.02     40.6291  1216.15     39.0373  113.965    60.4543     149.584     240.454     
1 1 1 23 3  17 o 12 458.901 4.52654 3719.95     104.115  3757.52     104.081  357.521    118.908     53.5713     118.908     
1 1 1 23 3  18 o 13 246.045 3.30518 1094.98     40.7066  1052.8      40.7879  166.581    118.55      14.4386     298.55      
1 1 1 23 3  19 o 2  173.655 2.86548 545.636     22.9267  524.323     26.6963  165.239    331.169     116.952     331.169     
1 1 1 23 3  20 o 2  40.5661 4.27211 44.779      7.2901   17.8237     8.12119  54.9694    223.243     148.271     223.243     
1 1 1 23 3  21 o 16 114.406 2.66254 235.395     14.8327  229.298     15.6331  65.2289    288.6       16.3896     108.6       
1 1 1 23 3  22 f 0  329.313 3.72115 1951.27     58.227   1897.78     64.3473  202.97     87.7625     0           0           
1 1 1 23 3  23 o 3  118.194 2.65718 245.652     15.4207  250.298     16.0163  35.3191    328.857     89.1436     148.857     
1 1 1 23 3  24 o 3  374.838 3.82794 2492.96     71.8514  2494.55     71.962   282.88     275.577     29.9022     275.577     
1 1 1 23 3  25 o 14 134.574 2.59365 318.996     16.8946  323.766     18.045   99.2092    240.996     22.8805     240.996     
1 1 1 23 3  26 o 17 577.542 5.27345 5964.13     146.047  5896.6      158.862  392.465    51.6856     43.4889     231.686     
1 1 1 23 3  27 o 18 139.144 2.41871 343.361     16.0162  343.459     17.6595  92.2696    279.484     0.440422    99.4837     
1 1 1 23 3  28 o 18 99.5443 2.40051 175.891     11.8938  175.924     12.0211  62.1074    4.23948     13.7098     4.23948     
1 1 1 23 3  29 o 5  183.021 2.48641 596.058     22.3567  591.935     23.2418  135.935    317.554     21.5562     317.554     
1 1 1 23 3  30 o 2  194.647 2.60832 677.354     24.931   666.525     25.9357  150.495    342.288     34.135      342.288     
1 1 1 23 3  31 o 12 212.199 2.74278 794.603     29.1273  802.759     29.2069  123.78     155.51      47.7929     335.51      
1 1 1 23 3  32 o 4  179.36  2.535   573.058     21.8691  568.006     23.6589  139.353    63.3529     35.8598     63.3529     
1 1 1 23 3  33 o 1  70.9054 2.75424 86.8612     9.44325  92.0758     10.0572  19.2589    183.093     5.63509     3.09286     
1 1 1 23 3  34 o 9  92.3261 2.6407  154.555     11.3968  148.359     12.9054  34.8762    346.508     43.7473     166.508     
1 1 1 23 3  35 o 10 222.411 2.91182 861.482     30.3041  893.939     34.5371  182.392    147.203     59.6597     147.203     
1 1 1 23 3  36 f 0  41.4957 3.88328 32.3557     7.38921  29.8962     8.27879  27.2562    38.0441     0           0           
1 1 1 23 3  37 o 4  181.812 2.77748 572.436     22.835   600.652     27.6527  129.698    34.149      12.6638     34.149      
1 1 1 23 3  38 o 7  309.896 3.22293 1704.55     46.965   1704.94     52.9602  221.182    180.615     10.8789     180.615     
1 1 1 23 3  39 o 16 164.036 2.49249 478.028     19.2411  476.618     21.6626  107.638    17.9677     5.89259     197.968     
1 1 1 23 3  40 o 3  269.701 3.01926 1232.62     38.3433  1351.16     43.2849  176.574    217.244     20.4042     37.2436     
1 1 1 23 3  41 o 9  367.247 3.5783  2290.8      61.8783  2504.63     69.8492  304.14     111.832     98.3084     111.832     
1 1 1 23 3  42 o 2  99.5329 2.65643 170.747     12.755   181.493     13.7008  51.7085    44.3334     24.9998     224.333     
1 1 1 23 3  43 o 14 181.325 2.62826 570.557     21.8767  596.799     25.8058  126.716    86.3359     6.46877     86.3359     
1 1 1 23 3  44 f 0  149.895 2.57836 388.194     17.7315  409.938     20.9297  119.207    353.291     0           0           
1 1 1 23 3  45 o 4  142.112 2.52821 355.235     17.2133  362.15      18.7611  69.9873    184.531     51.9626     4.53122     
1 1 1 23 3  46 o 14 174.983 2.72844 551.317     22.7484  536.569     25.0151  131.914    41.9829     27.5063     41.9829     
1 1 1 23 3  47 o 2  152.03  2.55122 406.467     19.4273  414.62      19.4463  128.449    35.029      54.9691     35.029      
1 1 1 23 3  48 o 12 189.032 2.70824 646.609     26.2447  623.627     25.0679  96.16      45.5391     64.5154     225.539     
1 1 1 23 3  49 o 1  274.204 3.31037 1284.62     46.4153  1394.36     44.3996  193.4      290.883     13.1939     290.883     
1 1 1 23 3  50 o 10 95.4009 2.75646 163.405     13.3989  160.907     12.901   71.4548    40.6241     22.2105     40.6241     
1 1 1 23 3  51 o 13 65.8625 3.16777 74.2424     10.5925  81.1301     10.1513  40.7712    359.935     23.9202     359.935     
1 1 1 23 3  52 o 11 159.239 2.63956 455.88      20.5054  446.659     21.5952  115.265    338.21      18.303      338.21      
1 1 1 23 3  53 o 12 187.112 2.95455 608.544     27.9692  639.81      27.41    145.538    336.741     41.227      336.741     
1 1 1 23 3  54 o 10 88.2949 2.86543 136.662     12.2673  141.886     13.0225  51.8481    181.557     8.94385     1.55678     
1 1 1 23 3  55 o 6  69.7525 3.12859 80.0482     10.5103  94.7112     11.2395  39.9018    157.07      31.3927     157.07      
1 1 1 23 3  56 o 6  25.5581 5.19037 6.88233     7.09113  17.08       7.52827  1.51376    203.855     21.6195     203.855     
1 1 1 23 3  57 o 12 69.4463 3.0145  83.7409     10.3513  89.3184     10.5264  51.9515    283.412     16.3321     283.412     
1 1 1 23 3  58 o 7  44.8145 4.15244 40.1639     9.21017  33.6076     8.94867  8.35076    283.764     39.1064     103.764     
1 1 1 23 3  59 o 12 46.1219 4.032   35.5206     8.76351  42.5398     9.46829  27.4361    97.394      0.558519    97.394      
1 1 1 23 3  60 o 12 59.9674 3.91123 76.7192     12.054   55.1143     11.0686  43.912     48.4198     14.1471     48.4198     
1 1 1 23 3  61 o 14 80.0023 3.03922 124.512     12.4562  106.209     11.8082  51.6955    239.219     0.675748    239.22      
1 1 1 23 3  62 o 17 84.2961 3.04798 132.183     13.2328  123.806     12.437   71.9225    41.2782     37.0855     41.2782     
1 1 1 23 3  63 o 1  13.33   4.35525 -8.2        6.82106  -2.9746     6.95882  7.67115    273.585     22.3137     273.585     
1 1 1 23 3  64 o 14 41.2212 4.76049 21.9105     9.28242  43.5705     9.00253  17.0128    228.403     15.3318     48.4031     
1 1 1 23 3  65 o 11 82.8069 3.37575 140.905     14.9044  108.669     12.9987  67.8835    255.466     31.3474     255.466     
1 1 1 23 3  66 o 6  88.0368 2.97791 138.495     14.1268  141.219     11.9499  52.757     205.875     6.95571     25.875      
1 1 1 23 3  67 o 3  29.2536 6.12987 22.1041     12.0579  12.0485     7.27757  10.3052    124.604     4.35097     124.604     
1 1 1 23 3  68 o 4  27.1377 6.28342 18.818      12.355   10.0295     7.37283  5.60347    18.5486     19.1449     198.549     
1 1 1 23 3  69 o 12 75.7201 3.40462 95.6617     13.8402  114.271     11.3972  43.5267    60.2127     8.57116     240.213     
1 1 1 23 3  70 o 15 63.3794 4.49977 51.0295     13.6605  104.208     12.0989  55.8396    50.4869     34.9098     50.4869     
1 1 1 23 3  71 o 19 18.451  5.45364 5.87698     8.63424  -3.01523    8.82546  1.28807    192.715     20.3857     192.715     
1 1 1 23 3  72 o 4  56.0232 5.23319 47.1764     14.5724  76.1154     12.5024  35.6433    258.409     3.00059     258.409     
1 1 1 23 3  73 o 2  44.2653 5.90359 53.5839     14.0598  27.4421     11.2494  25.8288    205.252     0.487148    25.2517     
1 1 1 23 3  74 o 14 19.2046 5.9434  2.60917     10.1149  -3.48996    11.9881  0.705073   329.721     1.10542     149.721     
1 1 1 23 3  75 o 12 35.5458 6.85349 28.7059     12.5193  25.2393     12.608   16.5929    55.9903     5.88598     235.99      
1 1 1 23 3  76 o 4  28.5874 6.83889 23.1461     12.1646  9.16373     12.2539  6.84172    143.033     17.2394     323.033     
1 1 1 23 3  77 o 3  27.7957 6.78706 25.5593     13.2026  3.25073     11.8833  12.8198    36.8363     1.12877     216.836     
1 1 1 23 3  78 o 12 38.5704 7.07238 23.4078     15.2225  41.0085     13.4241  24.9205    61.872      7.53813     61.872      
1 1 1 23 3  79 o 3  29.7239 7.2209  14.0438     14.3337  22.8677     12.4585  13.2372    241.612     4.62652     61.6117     
1 1 1 23 3  80 o 4  21.3168 6.47372 0.10164     13.3842  6.32537     11.8193  5.22687    341.199     3.65382     161.199     
1 1 1 23 3  81 o 14 19.9245 6.21409 -4.77884    12.0124  5.95869     12.6143  2.5817     311.211     5.09909     131.211     
1 1 1 23 3  82 o 8  24.0094 6.95267 8.68101     13.0682  11.4373     13.5897  2.96555    286.864     0.752744    106.864     
1 1 1 23 3  83 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 4  0  o 11 137.823 2.70537 337.443     18.6531  337.443     18.6531  48.0441    180         105.661     360         
1 1 1 23 4  1  o 15 383.319 4.24424 2636.91     79.3598  2578.36     83.5908  255.419    354.371     43.8927     174.371     
1 1 1 23 4  2  o 10 279.584 3.32593 1385.12     47.7169  1387.56     45.4534  209.284    243.562     21.0822     243.562     
1 1 1 23 4  3  o 10 158.647 2.62442 446.91      20.8942  445.524     20.8365  127.12     245.025     70.6795     245.025     
1 1 1 23 4  4  o 11 499.112 4.66315 4400.69     116.636  4444.28     116.637  359.397    258.243     7.21871     78.2428     
1 1 1 23 4  5  o 11 258.6   2.99238 1193.35     38.7869  1178.35     38.7716  158.893    238.613     50.208      58.6127     
1 1 1 23 4  6  o 12 110.78  2.36573 212.146     12.863   223.425     13.376   9.64911    95.0906     166.075     95.0906     
1 1 1 23 4  7  o 5  101.867 2.3674  187.987     11.7945  180.357     12.3229  32.9702    162.965     52.7021     342.965     
1 1 1 23 4  8  o 18 211.685 2.70655 787.569     28.1362  801.453     29.2852  173.337    268.284     56.1458     268.284     
1 1 1 23 4  9  o 6  132.427 2.29957 316.197     15.2577  305.599     15.2611  84.5251    296.725     5.88799     296.725     
1 1 1 23 4  10 o 18 301.933 3.11017 1632.55     48.855   1600.96     45.2275  271.415    284.108     114.442     284.108     
1 1 1 23 4  11 o 9  458.43  4.14746 3692.2      97.0002  3767.42     93.4902  378.837    340.716     94.0333     340.716     
1 1 1 23 4  12 o 19 153.13  2.40215 419.072     19.1392  412.344     17.7119  66.0891    278.876     77.4811     98.8755     
1 1 1 23 4  13 o 13 173.981 2.52161 543.366     21.491   529.98      22.4552  121.508    59.1467     5.82274     59.1467     
1 1 1 23 4  14 o 11 186.159 2.7124  623.665     25.279   605.35      25.3251  87.2896    111.244     86.606      291.244     
1 1 1 23 4  15 o 9  431.726 4.67111 3325.33     98.3848  3294.23     103.644  278.84     294.53      67.2972     114.53      
1 1 1 23 4  16 o 2  231.821 3.07235 956.976     35.7336  949.269     35.6524  186.797    11.4193     47.5686     11.4193     
1 1 1 23 4  17 o 14 393.346 4.11275 2738.15     83.0023  2754.45     79.0806  329.252    326.002     92.034      326.002     
1 1 1 23 4  18 o 9  71.9875 3.07535 86.8279     11.6941  97.8345     10.2146  20.1092    189.773     29.4391     9.7732      
1 1 1 23 4  19 o 8  144.557 2.58701 401.977     18.853   340.609     18.5384  91.7554    34.5179     13.6045     214.518     
1 1 1 23 4  20 o 10 308.951 3.39272 1715.08     54.9097  1671.95     50.092   268.121    26.1273     95.3448     26.1273     
1 1 1 23 4  21 o 19 388.498 3.8632  2657.28     78.2471  2700.62     71.9943  310.808    222.094     63.4797     222.094     
1 1 1 23 4  22 o 2  243.597 2.80494 1043.72     34.8709  1061.08     33.5883  191.047    316.976     37.9759     316.976     
1 1 1 23 4  23 o 8  269.427 2.99047 1307.59     41.1534  1267.73     39.6036  205.409    60.423      28.5651     60.423      
1 1 1 23 4  24 f 0  78.0895 2.6329  112.372     10.6668  104.469     9.88433  63.2289    223.799     0           0           
1 1 1 23 4  25 o 2  240.971 2.82122 1051.1      34.7061  1008.93     33.4358  197.632    262.005     57.1584     262.005     
1 1 1 23 4  26 o 10 372.169 3.8187  2463.47     71.1603  2454.4      71.2836  244.427    246.238     42.8248     66.2379     
1 1 1 23 4  27 o 7  75.3174 2.58152 101.954     9.42769  99.7262     9.98636  1.85731    88.0609     88.2812     268.061     
1 1 1 23 4  28 o 4  214.962 2.67361 835.44      28.1247  803.823     29.4308  146.756    172.31      6.60109     352.31      
1 1 1 23 4  29 o 13 241.384 2.89302 1053.54     34.2087  1013.87     35.7281  232.828    245.253     132.756     245.253     
1 1 1 23 4  30 o 6  148.156 2.52006 390.193     18.9385  388.366     18.481   79.0768    206.625     43.1032     26.6252     
1 1 1 23 4  31 o 13 95.4273 2.64283 161.486     12.8185  162.046     12.4058  30.5357    284.305     60.1691     104.305     
1 1 1 23 4  32 o 14 80.6213 2.70716 112.766     10.0707  118.377     11.7141  16.7115    193.239     64.213      13.239      
1 1 1 23 4  33 o 3  216.332 2.82192 824.773     29.7634  835.756     31.4108  168.301    82.1686     38.0961     82.1686     
1 1 1 23 4  34 o 1  248.737 2.91548 1086.77     35.594   1108.78     37.0872  139.321    24.9831     69.2826     204.983     
1 1 1 23 4  35 o 6  246.749 2.98597 1094.99     35.1636  1065.92     38.5541  155.064    201.225     33.9045     21.225      
1 1 1 23 4  36 o 6  38.3052 4.13113 20.7393     7.26286  33.3415     7.91886  35.7613    235.243     106.264     235.243     
1 1 1 23 4  37 o 16 336.893 3.64171 1937.5      58.6211  2096        64.3658  221.088    200.913     29.8065     20.9126     
1 1 1 23 4  38 o 2  56.5089 3.29229 54.151      9.09746  60.0943     9.37651  9.42743    116.789     11.4711     296.789     
1 1 1 23 4  39 o 3  127.781 2.55441 300.099     15.649   279.952     16.9461  52.2246    280.927     67.5976     100.927     
1 1 1 23 4  40 o 3  327.691 3.44389 1870.35     55.3232  1945.88     57.793   257.325    29.8067     58.4841     29.8067     
1 1 1 23 4  41 o 1  352.438 3.68913 2161.49     62.1605  2255.82     68.1229  289.018    320.633     87.7035     320.633     
1 1 1 23 4  42 o 8  125.984 2.6121  266.067     16.074   298.371     16.869   73.4146    190.265     22.2459     10.2645     
1 1 1 23 4  43 o 9  91.6418 2.76975 144.254     12.9428  154.667     12.4015  73.395     65.1985     42.221      65.1985     
1 1 1 23 4  44 o 9  65.6565 3.10387 74.1817     10.0305  79.7945     10.2746  9.90057    229.882     62.5962     49.8816     
1 1 1 23 4  45 o 9  30.2354 5.21997 15.6803     7.85704  18.3371     7.84314  9.32681    125.356     36.999      125.356     
1 1 1 23 4  46 o 4  191.61  2.79522 616.951     25.6665  689.073     28.0321  114.022    261.911     33.5262     81.9109     
1 1 1 23 4  47 o 5  64.8179 3.20789 76.4515     10.1833  73.8267     10.5137  24.8248    252.353     29.4662     72.3531     
1 1 1 23 4  48 o 19 158.807 2.65158 431.446     21.6814  465.85      20.4124  109.365    221.627     4.68125     221.627     
1 1 1 23 4  49 o 12 205.242 3.06907 713.158     33.0983  787.92      29.7132  128.045    133.736     22.8724     313.736     
1 1 1 23 4  50 o 3  137.977 2.68437 341.432     19.4289  336.559     17.6261  80.7081    276.48      23.3526     96.48       
1 1 1 23 4  51 o 12 123.226 2.70021 279.355     17.4603  261.93      15.8487  60.5724    187.068     43.0056     7.06784     
1 1 1 23 4  52 o 7  168.47  2.658   500.134     22.8806  510.67      21.9803  120.839    134.022     16.2005     134.022     
1 1 1 23 4  53 f 0  192.446 2.77024 658.182     27.8866  661.849     25.485   93.2973    217.604     0           0           
1 1 1 23 4  54 o 3  82.8848 3.002   131.653     12.4014  114.512     12.406   57.8616    303.001     10.5193     303.001     
1 1 1 23 4  55 o 15 72.0324 3.0935  92.7273     11.2627  93.3722     10.9626  39.9644    166.024     12.4017     346.024     
1 1 1 23 4  56 o 15 85.9556 2.9905  132.738     12.7085  131.971     12.9737  38.2838    160.414     36.5945     340.414     
1 1 1 23 4  57 o 3  85.4625 2.98438 126.263     12.4444  135.737     13.042   68.1639    68.2497     26.0442     68.2497     
1 1 1 23 4  58 o 12 53.2554 3.95616 58.4431     10.171   45.3745     10.4283  35.6688    307.164     6.51659     307.164     
1 1 1 23 4  59 f 0  81.162  2.88747 122.09      11.6742  114.482     11.7275  44.2204    302.703     0           0           
1 1 1 23 4  60 o 4  77.5944 2.95151 111.04      11.2235  105.563     11.6257  65.3537    194.824     32.5308     194.824     
1 1 1 23 4  61 o 4  29.5071 5.68354 20.3037     8.44308  12.8593     9.16165  5.41204    36.6833     21.534      216.683     
1 1 1 23 4  62 f 0  53.7451 4.04962 52.1552     11.0944  53.9478     10.3479  27.9523    144.973     0           0           
1 1 1 23 4  63 o 14 15.8992 4.85513 0.435364    7.34416  -1.11659    6.79008  5.60693    356.703     21.8178     356.703     
1 1 1 23 4  64 o 15 41.7438 4.45884 36.6946     9.28996  28.6835     8.73655  16.0396    357.764     18.5741     177.764     
1 1 1 23 4  65 o 6  69.8763 3.30204 82.5408     11.8776  94.8886     10.9784  45.8009    349.688     3.20583     349.688     
1 1 1 23 4  66 o 14 34.9957 4.86291 22.3539     8.07641  24.468      8.37394  12.28      10.2809     16.8797     190.281     
1 1 1 23 4  67 o 2  34.3217 5.66229 29.2038     9.85745  17.4025     9.49608  19.7445    341.192     1.08413     341.192     
1 1 1 23 4  68 o 10 52.6301 4.22402 59.413      12.2028  44.6053     9.73166  37.2949    84.4759     10.1255     84.4759     
1 1 1 23 4  69 o 13 55.8408 3.81463 58.5748     11.1009  57.1054     9.95861  36.9086    236.005     4.72715     236.005     
1 1 1 23 4  70 o 16 29.596  5.44048 24.3504     9.02059  11.0167     7.79385  15.6855    250.449     0.141714    250.448     
1 1 1 23 4  71 o 5  54.3184 4.18812 54.9777     10.5759  56.3218     11.8239  33.9719    212.661     1.35007     212.661     
1 1 1 23 4  72 o 12 23.2824 6.56816 9.84592     13.4144  6.17422     9.59595  4.61398    354.12      14.1543     174.12      
1 1 1 23 4  73 o 1  20.0267 6.12041 3.40609     12.8494  0.290167    9.47444  2.26002    336.744     2.48949     156.744     
1 1 1 23 4  74 o 11 24.4477 7.12301 13.681      16.8361  3.58521     11.1139  4.28261    99.4411     0.156046    279.441     
1 1 1 23 4  75 o 19 27.3937 7.49176 10.2877     17.894   15.4491     12.2559  3.78664    252.649     22.0885     72.6494     
1 1 1 23 4  76 o 1  18.8416 5.78141 6.2523      10.8642  -8.03939    10.2585  2.28563    96.9799     2.87493     276.98      
1 1 1 23 4  77 o 7  30.0609 6.70777 7.10881     12.5818  28.8715     12.3468  14.157     331.502     3.80569     151.502     
1 1 1 23 4  78 o 1  22.4859 6.49198 8.90642     11.6038  4.47143     11.6656  6.26397    284.133     0.0356242   284.133     
1 1 1 23 4  79 o 2  20.6358 6.08486 -8.85783    11.7031  11.6162     11.2715  1.85814    331.914     0.289499    151.914     
1 1 1 23 4  80 o 6  29.3175 7.07107 25.3768     12.9499  12.5363     12.8256  12.2256    31.648      4.8181      31.648      
1 1 1 23 4  81 o 19 38.0306 7.06715 34.31       13.678   32.8092     13.6119  23.0219    108.167     12.7117     108.167     
1 1 1 23 4  82 o 2  31.4377 7.92821 25.4099     15.2047  24.0079     16.3901  12.5833    152.646     2.68947     152.646     
1 1 1 23 4  83 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 5  0  o 11 14.8769 5.70823 5.53106     5.98039  5.53106     5.98039  28.6702    180         59.1257     180         
1 1 1 23 5  1  o 13 236.514 3.03849 993.768     36.9115  990.27      35.0973  160.254    194.08      15.4143     14.0798     
1 1 1 23 5  2  o 5  372.423 3.92438 2476.8      69.8373  2445.57     76.4543  324.208    109.924     110.552     109.924     
1 1 1 23 5  3  o 15 120.862 2.40441 248.937     14.0179  269.607     15.0853  31.0977    19.1898     99.2455     199.19      
1 1 1 23 5  4  o 16 481.107 4.38283 4123.35     103.534  4094.3      107.75   378.701    159.699     56.6654     159.699     
1 1 1 23 5  5  o 1  50.353  2.90308 41.2916     7.28503  49.4104     7.17853  35.5035    353.805     115.318     353.805     
1 1 1 23 5  6  o 8  316.38  3.26378 1761.79     50.7166  1789.05     52.7718  188.97     38.1862     79.4804     218.186     
1 1 1 23 5  7  o 11 282.136 3.0971  1413.28     44.6613  1410.17     42.9028  239.213    113.947     75.9089     113.947     
1 1 1 23 5  8  f 0  262.212 3.07344 1240.57     38.6224  1198.36     42.0117  209.01     44.4445     0           0           
1 1 1 23 5  9  f 0  168.915 2.47346 502.014     20.5033  509.699     21.3692  110.271    223.77      0           0           
1 1 1 23 5  10 o 6  268.358 3.10585 1284.75     42.6619  1269.77     40.8663  212.247    132.451     41.2862     132.451     
1 1 1 23 5  11 o 12 108.309 2.57769 212.63      13.6832  203.869     14.2372  57.0693    76.8353     21.324      256.835     
1 1 1 23 5  12 o 11 178.87  2.85404 569.781     25.6342  564.966     25.5325  103.879    301.283     43.1244     121.283     
1 1 1 23 5  13 o 12 177.936 2.79562 567.626     23.671   555.306     26.0985  57.184     22.6305     138.145     202.631     
1 1 1 23 5  14 o 6  331.86  3.8554  1941.11     60.8579  1967.94     67.2602  317.877    237.125     159.664     237.125     
1 1 1 23 5  15 o 17 582.525 5.82059 6059.68     161.181  6011        178.155  462.565    162.636     77.6228     162.636     
1 1 1 23 5  16 o 2  286.914 3.54782 1453.81     46.8271  1467.52     54.9117  257.774    181.286     105.603     181.286     
1 1 1 23 5  17 o 1  230.679 2.98233 933.643     34.488   954.032     34.4618  222        147.015     121.077     147.015     
1 1 1 23 5  18 o 18 320.593 3.39541 1852.76     55.7077  1794.63     53.3973  234.567    158.663     7.98247     158.663     
1 1 1 23 5  19 o 6  65.684  2.72544 81.0451     8.74931  72.6209     9.07141  0.0821266  215.661     75.104      215.664     
1 1 1 23 5  20 o 3  220.854 2.68504 861.802     28.5501  868.211     30.8492  100.419    18.4448     113.962     198.445     
1 1 1 23 5  21 o 16 342.845 3.35444 2095.29     57.6223  2075.97     57.6444  264.372    77.952      36.7784     77.952      
1 1 1 23 5  22 o 9  236.064 2.76131 998.214     33.283   978.53      32.0485  178.459    126.938     23.2525     126.938     
1 1 1 23 5  23 o 9  417.128 3.91029 3124.52     83.3614  3054.13     80.1169  314.611    179.78      29.6698     179.78      
1 1 1 23 5  24 o 14 288.44  3.10436 1477.63     45.7326  1474.46     43.9988  208.254    253.774     5.88272     253.774     
1 1 1 23 5  25 o 10 108.311 2.36885 211.393     13.367   205.067     12.3098  34.6587    285.457     74.3887     105.457     
1 1 1 23 5  26 o 7  92.8146 2.48665 154.997     11.5123  150.992     11.5759  30.9716    21.5455     55.4647     201.545     
1 1 1 23 5  27 o 5  145.322 2.52095 383.301     18.2515  366.093     18.4396  55.4327    22.5807     89.2301     202.581     
1 1 1 23 5  28 o 18 262.801 2.99251 1235.5      39.3298  1215.22     39.4898  217.155    37.5336     64.9046     37.5336     
1 1 1 23 5  29 o 17 345.114 3.59817 2133.6      63.5223  2095.51     60.9316  238.838    100.31      12.8432     280.31      
1 1 1 23 5  30 o 12 100.526 2.66354 184.894     13.8517  174.19      12.9403  56.4366    348.094     10.2005     168.094     
1 1 1 23 5  31 o 5  94.5821 2.55791 168.404     11.9831  149.674     12.176   56.0121    281.26      4.60532     281.26      
1 1 1 23 5  32 o 17 42.692  3.93623 33.0245     7.91616  32.8153     8.51003  11.9419    349.525     50.3786     349.525     
1 1 1 23 5  33 o 8  175.517 2.84407 558.744     25.5319  534.561     24.5036  140.566    209.586     43.1059     209.586     
1 1 1 23 5  34 o 17 279.742 3.09942 1383.69     43.3597  1394.16     43.5419  179.245    316.444     34.4724     136.444     
1 1 1 23 5  35 o 2  249.124 2.81951 1104.72     35.8085  1097.82     34.5855  165.088    56.4908     17.8309     236.491     
1 1 1 23 5  36 o 5  27.0426 5.16183 12.4373     7.23453  14.4681     7.10657  18.309     99.4146     46.134      99.4146     
1 1 1 23 5  37 o 3  101.476 2.63578 176.003     13.3298  190.066     13.4208  50.9927    0.867863    29.2471     180.868     
1 1 1 23 5  38 o 3  123.626 2.49693 263.757     15.5841  279.16      15.3045  87.2625    293.41      11.7292     293.41      
1 1 1 23 5  39 o 12 136.345 2.55699 337.448     17.4887  322.918     17.4183  86.1275    221.125     11.8569     41.1247     
1 1 1 23 5  40 o 7  237.26  2.85049 982.31      33.916   1016.94     33.8604  153.708    273.068     22.3633     93.0682     
1 1 1 23 5  41 f 0  251.536 2.93625 1092.79     36.9842  1155.3      37.021   174.41     115.595     0           0           
1 1 1 23 5  42 o 7  99.2434 2.66115 179.965     13.2564  170.412     13.161   74.3355    10.2218     22.471      10.2218     
1 1 1 23 5  43 o 13 123.079 2.59165 256.586     15.7439  282.258     16.1815  65.7747    188.598     34.2471     8.59787     
1 1 1 23 5  44 o 16 220.681 2.76484 869.214     30.5238  861.546     30.6293  169.663    109.326     36.1554     109.326     
1 1 1 23 5  45 o 10 37.9049 4.48553 20.8943     7.91696  32.3931     8.38338  1.3004     186.114     26.2855     6.11445     
1 1 1 23 5  46 o 2  70.0963 3.09483 91.5329     10.301   84.091      11.2523  36.3566    161.642     13.3986     341.642     
1 1 1 23 5  47 o 2  126.395 2.604   273.676     16.5043  295.047     16.4282  75.8624    36.0677     17.8667     216.068     
1 1 1 23 5  48 o 2  48.1175 3.76044 42.1288     8.52258  41.5391     9.28317  19.3755    83.9288     3.79924     263.929     
1 1 1 23 5  49 o 11 52.2212 3.53132 51.4197     8.9315   46.8724     9.28547  18.048     100.808     23.955      280.808     
1 1 1 23 5  50 o 18 142.989 2.56188 350.431     18.4704  377.787     18.1967  114.244    169.151     38.0684     169.151     
1 1 1 23 5  51 o 6  23.183  5.25522 15.4661     7.7288   1.30597     7.63319  8.68802    165.173     27.9564     165.173     
1 1 1 23 5  52 o 19 118.284 2.66705 254.12      16.0012  244.958     15.5784  81.3505    2.25282     6.46809     2.25281     
1 1 1 23 5  53 o 1  168.036 2.60574 495.105     21.5627  511.255     22.3244  121.415    19.2231     17.2421     19.2231     
1 1 1 23 5  54 o 14 118.415 2.69775 246.475     15.9174  254.26      16.058   97.8813    112.938     39.2918     112.938     
1 1 1 23 5  55 o 11 103.957 2.69275 201.587     14.0494  184.827     13.9442  78.2286    349.772     19.1259     349.772     
1 1 1 23 5  56 o 6  64.5263 3.26985 86.4782     10.3647  64.3427     10.4384  44.1558    343.254     6.31062     343.254     
1 1 1 23 5  57 o 3  57.5565 3.41614 63.5102     9.57935  56.4307     9.89184  35.0445    156.214     2.40801     336.214     
1 1 1 23 5  58 o 10 65.1008 3.35765 76.1888     10.8361  76.9886     10.9218  50.4963    356.415     19.3566     356.415     
1 1 1 23 5  59 o 17 62.5623 3.66408 76.746      11.1511  65.7231     11.5213  42.4186    350.239     5.82075     350.239     
1 1 1 23 5  60 o 1  76.0943 3.42346 110.507     12.4488  99.2669     13.4167  45.072     35.2128     8.23115     215.213     
1 1 1 23 5  61 o 10 40.3599 5.52728 41.7562     9.50335  21.4204     11.6186  11.716     175.305     25.8444     355.305     
1 1 1 23 5  62 o 7  97.7078 2.99285 187.255     15.5287  157.396     13.7292  64.3242    22.7881     1.69944     22.7881     
1 1 1 23 5  63 o 7  22.8098 5.59217 5.60747     8.24221  11.6859     7.76234  0.486839   236.356     21.4953     56.3563     
1 1 1 23 5  64 o 16 117.063 2.8873  250.16      15.7446  243.553     17.9675  83.321     203.815     14.7421     203.815     
1 1 1 23 5  65 f 0  19.2596 5.2433  8.55782     7.31697  -1.03803    7.89846  18.5566    263.519     0           0           
1 1 1 23 5  66 o 15 24.6251 5.34593 18.3056     7.88827  2.12577     8.53144  9.63999    222.465     2.10452     42.4649     
1 1 1 23 5  67 o 3  19.0099 5.3273  8.3069      8.23406  -1.33917    7.53702  5.64708    328.118     31.7407     328.118     
1 1 1 23 5  68 o 17 37.478  5.53019 36.8622     11.5095  19.7922     8.7732   19.1207    185.804     6.32647     5.80446     
1 1 1 23 5  69 o 14 18.5182 5.35944 6.83739     8.56126  -1.39972    7.68395  0.230653   160.522     18.247      160.522     
1 1 1 23 5  70 o 13 40.3459 5.2286  40.7355     10.5292  24.2375     9.73005  30.6665    123.292     17.0944     123.292     
1 1 1 23 5  71 o 14 53.0128 5.43876 60.6716     15.8627  50.35       12.1658  43.4492    65.5611     24.3315     65.5611     
1 1 1 23 5  72 o 15 51.951  6.36369 44.1558     17.9509  66.494      11.9781  30.1794    201.637     2.49852     21.6374     
1 1 1 23 5  73 f 0  16.965  5.57693 -10.7916    14.2551  -3.43352    8.62483  17.1489    191.21      0           0           
1 1 1 23 5  74 o 7  24.8443 6.73723 4.63318     13.8039  14.3055     10.8356  8.15554    274.612     2.38503     94.6118     
1 1 1 23 5  75 o 1  16.3617 5.37758 -6.70685    11.2504  -6.8828     9.97303  3.37977    248.272     21.1031     248.272     
1 1 1 23 5  76 o 1  27.2488 7.18918 14.5061     14.7283  14.0231     11.7094  13.2549    139.912     2.25417     139.912     
1 1 1 23 5  77 o 8  36.0686 7.32444 25.042      16.2005  32.2522     12.48    23.5228    194.787     8.99781     194.787     
1 1 1 23 5  78 o 15 53.6817 5.77266 45.7599     14.6318  73.6039     14.6953  36.5857    23.6658     9.6501      23.6658     
1 1 1 23 5  79 o 18 29.4809 7.02895 24.2135     12.4901  14.1783     12.7342  14.4725    141.13      2.45104     141.13      
1 1 1 23 5  80 f 0  20.3909 6.02454 13.2097     11.3777  -13.2529    12.197   8.91915    5.52252     0           0           
1 1 1 23 5  81 o 19 28.1617 6.96835 25.9122     12.657   8.55319     13.4805  3.91021    161.804     1.09856     161.804     
1 1 1 23 5  82 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 6  0  o 10 227.954 2.77285 921.877     31.6552  921.877     31.6552  214.984    4.53661e-06 94.4768     4.53661e-06 
1 1 1 23 6  1  o 3  89.9702 2.60834 145.169     12.227   142.37      11.2314  14.0978    345.516     87.0265     165.516     
1 1 1 23 6  2  o 11 204.69  2.91215 764.733     29.0626  721.622     30.5989  113.767    242.936     64.6178     62.9358     
1 1 1 23 6  3  o 14 279.767 3.33142 1369.63     45.5493  1407.38     47.862   185.277    61.0714     33.823      241.071     
1 1 1 23 6  4  o 1  154.665 2.67056 434.617     20.161   414.11      21.1727  60.6967    1.61476     95.9714     181.615     
1 1 1 23 6  5  o 7  162.746 2.8166  468.386     23.5519  471.288     22.3523  103.831    290.527     18.8782     110.527     
1 1 1 23 6  6  o 17 213.877 3.22338 819.541     35.6042  803.319     33.48    96.1165    297.363     115.063     117.363     
1 1 1 23 6  7  o 11 242.923 3.46247 1068.88     40.9448  1025.25     43.2644  200.426    317.709     53.9031     317.709     
1 1 1 23 6  8  o 2  301.612 4.02164 1629.29     56.9132  1600.22     64.3604  214.212    14.8976     8.29045     194.898     
1 1 1 23 6  9  o 7  145.766 2.77518 379.058     20.4479  375.084     20.06    75.4793    275.509     52.1606     95.5094     
1 1 1 23 6  10 o 4  145.866 2.91719 364.723     21.4395  390.808     21.1355  88.3039    115.391     25.4208     295.391     
1 1 1 23 6  11 o 6  276.631 3.58002 1355.86     53.4568  1359.93     45.4677  257.664    198.854     119.31      198.854     
1 1 1 23 6  12 o 16 167.32  2.65337 502.094     21.2836  490.826     23.1511  100.149    250.616     34.9052     70.6163     
1 1 1 23 6  13 o 13 142.477 2.358   367.985     16.7989  351.922     16.866   114.5      211.61      38.7948     211.61      
1 1 1 23 6  14 o 3  295.995 3.15537 1578.89     47.734   1529.74     45.8788  242.964    30.8886     60.0084     30.8886     
1 1 1 23 6  15 o 16 213.1   2.81414 808.935     30.0164  801.866     30.0891  149.784    247.845     3.26776     67.8448     
1 1 1 23 6  16 o 10 81.8404 2.5325  112.566     10.0525  125.603     10.6719  22.5393    72.9749     55.4776     252.975     
1 1 1 23 6  17 f 0  230.101 3.06556 937.05      34.5102  941.416     36.1738  178.661    87.8782     0           0           
1 1 1 23 6  18 o 8  63.7204 2.75128 74.156      8.6638   70.4265     8.81425  12.0174    42.6674     13.2488     222.667     
1 1 1 23 6  19 o 17 258.667 2.94565 1198.92     38.1426  1174.88     38.2219  229.952    100.391     92.9072     100.391     
1 1 1 23 6  20 o 10 45.6949 3.4282  36.9718     7.52375  37.9708     7.93649  7.84148    318.606     40.7233     318.606     
1 1 1 23 6  21 o 15 200.14  2.63195 714.85      25.2465  705.952     27.4869  186.948    312.196     98.5275     312.196     
1 1 1 23 6  22 f 0  81.8037 2.54456 125.052     10.4046  112.912     10.3872  35.4616    139.536     0           0           
1 1 1 23 6  23 o 11 39.3281 3.70216 31.8116     6.85737  24.329      7.1945   21.168     75.4511     67.8778     75.4511     
1 1 1 23 6  24 o 5  532.351 4.75878 4994.3      124.366  5082.07     129.531  434.639    86.5655     102.145     86.5655     
1 1 1 23 6  25 o 3  108.481 2.36006 212.269     12.7041  205.522     12.9191  69.4474    104.059     3.59879     104.059     
1 1 1 23 6  26 o 17 272.144 2.88102 1333.35     39.2341  1294.63     39.3421  224.165    278.626     63.346      278.626     
1 1 1 23 6  27 o 2  61.5204 2.77279 69.66       8.21329  65.2006     8.75892  10.649     334.735     17.7711     154.735     
1 1 1 23 6  28 o 7  143.452 2.40413 362.999     16.8756  366.901     17.6853  102.22     175.281     12.5763     175.281     
1 1 1 23 6  29 o 16 211.128 2.71039 800.094     29.6795  781.428     27.6602  128.471    277.109     39.1781     97.1091     
1 1 1 23 6  30 o 5  380.081 3.51348 2561.98     65.6141  2567.81     68.2091  260.16     141.546     21.0253     321.545     
1 1 1 23 6  31 o 18 296.08  3.18874 1579.42     46.2713  1532.71     48.2962  193.151    60.3021     32.8389     240.302     
1 1 1 23 6  32 o 5  180.946 2.72661 597.953     23.9845  564.084     25.3881  156.494    268.759     67.0807     268.759     
1 1 1 23 6  33 o 7  220.159 2.61836 854.427     28.2276  865.409     29.542   117.915    157.988     72.8084     337.988     
1 1 1 23 6  34 o 5  277.118 2.92416 1357.9      39.7494  1368.08     41.4571  259.117    194.326     131.404     194.326     
1 1 1 23 6  35 o 12 102.584 2.53297 192.28      12.5544  181.671     13.4025  24.3105    275.104     88.5971     95.1045     
1 1 1 23 6  36 o 16 120.643 2.4019  253.262     14.0755  263.65      14.9391  83.7671    140.604     8.23579     140.604     
1 1 1 23 6  37 o 5  58.8158 3.23046 66.611      8.69829  57.2084     9.99286  13.6501    359.344     38.4626     179.344     
1 1 1 23 6  38 o 2  163.038 2.58098 473.029     20.4245  470.583     21.7276  110.926    89.2264     2.40151     269.226     
1 1 1 23 6  39 o 19 126.92  2.46368 287.742     15.1445  284.512     16.1439  89.7182    36.3039     8.6658      36.3038     
1 1 1 23 6  40 o 15 164.526 2.47417 464.5       20.2273  496.834     20.5649  99.8037    121.24      26.9993     301.24      
1 1 1 23 6  41 o 13 44.2066 3.98407 30.723      7.85091  40.3414     9.42193  8.10097    43.3465     15.3374     223.347     
1 1 1 23 6  42 o 18 145.388 2.42023 365.244     17.1158  385.556     18.1549  105.154    84.862      12.9602     84.862      
1 1 1 23 6  43 f 0  84.5726 2.74607 127.535     11.4062  127.223     11.8049  51.1047    70.7292     0           0           
1 1 1 23 6  44 o 15 214.247 2.6219  802.851     27.0533  828.759     29.2351  191.95     321.486     90.2425     321.486     
1 1 1 23 6  45 o 18 223.452 2.67302 860.342     28.7253  915.548     31.1446  171.19     3.13939     35.0863     3.13938     
1 1 1 23 6  46 o 11 134.41  2.52854 314.044     16.5712  328.857     17.4644  120.311    132.022     62.2454     132.022     
1 1 1 23 6  47 o 15 227.275 2.89798 859.342     32.1605  982.082     33.8337  167.209    263.196     22.8437     263.196     
1 1 1 23 6  48 o 11 34.7168 4.86012 19.3472     8.08717  25.6419     8.21653  3.82889    178.846     41.2365     178.846     
1 1 1 23 6  49 o 19 138.576 2.52331 338.977     17.161   345.016     17.8548  110.646    21.4779     36.2747     21.4779     
1 1 1 23 6  50 o 7  110.335 2.56282 203.415     13.8605  231.007     14.4295  61.8622    24.5951     22.7928     204.595     
1 1 1 23 6  51 o 1  33.9299 4.91807 27.2978     7.72227  16.1025     8.41719  1.88463    230.098     27.9352     50.0984     
1 1 1 23 6  52 o 8  48.0615 3.9403  44.607      9.37533  39.4936     9.23042  11.9918    164.748     35.0997     344.748     
1 1 1 23 6  53 o 19 38.8317 4.66204 22.237      8.65947  34.2884     8.61535  13.8824    264.529     17.0524     84.5295     
1 1 1 23 6  54 o 6  49.7717 3.92384 50.1751     9.72661  40.319      9.43911  36.9563    297.099     24.28       297.099     
1 1 1 23 6  55 o 19 55.7376 3.67436 53.8902     9.98641  58.8628     10.2993  32.4967    352.018     5.48438     172.018     
1 1 1 23 6  56 o 16 23.8266 5.63146 10.471      7.93511  9.48336     7.87133  2.71761    142.898     11.7448     322.898     
1 1 1 23 6  57 o 15 48.5664 4.22104 41.7415     10.5921  45.0551     9.39991  19.267     314.815     22.6293     134.815     
1 1 1 23 6  58 o 18 69.5226 3.512   85.5786     12.2607  89.6397     12.0376  46.3025    147.16      3.12473     147.16      
1 1 1 23 6  59 o 14 39.7053 4.72225 29.517      8.58883  29.6689     9.51659  5.81298    143.69      37.7401     323.69      
1 1 1 23 6  60 o 15 89.4185 2.99895 153.981     13.0379  134.444     13.6605  58.2976    215.34      0.0753824   35.3388     
1 1 1 23 6  61 o 11 73.913  3.06178 93.0161     11.2635  104.461     11.2898  49.7291    170.863     4.36753     170.863     
1 1 1 23 6  62 o 19 102.852 3.08224 176.258     15.9776  206.148     15.614   65.5483    190.208     3.10611     10.2076     
1 1 1 23 6  63 o 2  92.0448 2.96794 144.902     13.5897  161.119     13.6938  55.1845    33.2906     9.14854     213.291     
1 1 1 23 6  64 o 14 91.0361 3.0481  151.639     14.0844  148.193     13.6488  68.6792    30.7187     19.9392     30.7187     
1 1 1 23 6  65 o 7  31.9748 5.37245 22.7214     8.38644  17.2739     8.65194  1.50766    55.5521     36.0052     235.552     
1 1 1 23 6  66 o 4  32.313  5.48319 21.952      8.82896  19.2086     8.71824  12.6111    307.958     12.811      127.958     
1 1 1 23 6  67 o 11 22.2209 5.74364 8.22796     8.27076  8.39379     8.39493  3.47967    218.363     16.4024     38.3627     
1 1 1 23 6  68 o 15 54.0914 4.66921 62.7991     14.0362  49.1968     10.7903  38.4685    76.6222     10.1118     76.6222     
1 1 1 23 6  69 o 6  28.0947 6.77834 17.4854     15.0611  13.8769     8.19976  9.13057    117.494     12.9971     297.494     
1 1 1 23 6  70 o 3  38.5918 6.91678 31.39       16.5189  31.4391     10.5987  24.8681    165.622     6.04173     165.622     
1 1 1 23 6  71 o 13 30.099  7.14391 22.958      15.4259  15.4226     10.0264  13.1437    349.074     5.71752     169.074     
1 1 1 23 6  72 o 4  61.1051 4.87097 77.2412     16.7729  67.6854     12.352   49.8575    47.9751     26.3879     47.9751     
1 1 1 23 6  73 o 10 25.0031 6.39228 19.5997     11.9149  2.88318     9.81868  4.71863    77.2737     16.4334     257.274     
1 1 1 23 6  74 o 18 22.9109 6.45459 1.58198     11.4303  12.3299     11.5295  5.38917    198.128     0.0446641   18.1282     
1 1 1 23 6  75 o 17 52.9223 5.4969  57.1937     14.6483  54.5288     13.6373  29.0759    327.914     6.15064     147.914     
1 1 1 23 6  76 o 12 19.6371 5.95459 -6.2952     10.7372  7.69526     11.1485  4.46054    273.343     5.42951     93.3433     
1 1 1 23 6  77 o 7  25.1021 7.11708 9.9105      14.6399  11.4344     12.7095  4.86687    163.316     17.1099     343.316     
1 1 1 23 6  78 o 12 33.8257 7.31688 29.0246     13.5299  23.8991     13.7198  18.326     218.63      0.994052    218.63      
1 1 1 23 6  79 f 0  20.4932 6.46176 10.706      15.4074  -10.4226    11.9384  5.60742    165.047     0           0           
1 1 1 23 6  80 o 6  19.1347 6.14779 -2.40978    10.9944  0.661977    14.4624  0.514469   301.378     2.34539     121.378     
1 1 1 23 6  81 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 7  0  o 19 196.464 2.97499 685.184     29.2603  685.184     29.2603  56.7032    180         176.099     360         
1 1 1 23 7  1  o 9  124.118 2.69721 268.621     17.8908  278.312     15.4881  101.918    218.634     48.4381     218.634     
1 1 1 23 7  2  o 15 240.702 3.0875  1013.58     38.145   1041.95     36.2871  154.412    215.422     38.8648     35.4222     
1 1 1 23 7  3  o 12 156.5   2.67383 437.12      20.4781  431.541     21.4448  88.2469    185.237     43.7304     5.23693     
1 1 1 23 7  4  o 2  65.2168 2.94003 74.6481     9.42735  76.8463     9.69079  15.0442    94.4        29.8451     274.4       
1 1 1 23 7  5  f 0  242.99  3.12219 1028.62     38.8764  1066.32     37.1008  123.662    137.128     0           0           
1 1 1 23 7  6  f 0  325.972 3.79202 1891.04     61.9212  1880.94     61.9697  217.426    124.974     0           0           
1 1 1 23 7  7  o 15 235.109 3.07697 1006.9      34.4831  954.497     37.8371  125.055    191.126     89.5969     11.1262     
1 1 1 23 7  8  o 12 79.5242 2.62218 109.374     10.0653  115.445     10.7788  8.67559    263.848     121.743     263.848     
1 1 1 23 7  9  o 9  366.492 3.83067 2400.84     65.5456  2367.59     74.792   220.288    300.915     93.9946     120.915     
1 1 1 23 7  10 o 11 211.582 2.86793 817.08      29.6891  771.254     31.0556  187.367    280.646     76.0683     280.646     
1 1 1 23 7  11 o 19 474.475 4.59593 3997.44     106.883  4001.68     111.631  400.205    81.0467     108.183     81.0467     
1 1 1 23 7  12 o 17 219.389 2.9867  845.811     29.6968  861.783     35.7513  202.6      192.911     96.018      192.911     
1 1 1 23 7  13 o 8  43.4535 3.31096 34.3033     7.02275  33.48       7.16603  7.96075    276.041     36.1899     276.041     
1 1 1 23 7  14 o 17 126.202 2.44134 278.89      14.8475  286.392     15.9957  89.6612    85.6989     12.8472     85.6989     
1 1 1 23 7  15 o 7  352.486 3.59368 2179.39     63.4653  2231.31     63.4896  307.417    23.9018     105.329     23.9018     
1 1 1 23 7  16 o 9  133.303 2.51039 309.697     15.6391  321.039     17.8347  74.2933    232.353     33.5651     52.3534     
1 1 1 23 7  17 o 7  400.095 3.86009 2833.62     75.8427  2850.69     78.9279  295.237    258.118     10.3381     258.118     
1 1 1 23 7  18 f 0  183.313 2.53472 597.378     24.112   594.493     22.4323  117.455    327.058     0           0           
1 1 1 23 7  19 o 7  329.957 3.18415 1922.38     52.6226  1941.29     52.6799  250.825    242.954     26.2162     242.954     
1 1 1 23 7  20 o 9  189.832 2.58006 638.431     25.0072  639.808     24.0726  126.704    256.398     13.6763     76.398      
1 1 1 23 7  21 o 15 163.431 2.40956 472.791     19.386   474.521     20.0787  74.2011    38.5212     80.8941     218.521     
1 1 1 23 7  22 f 0  256.179 2.76682 1162.11     35.4799  1166.19     35.5619  178.803    321.466     0           0           
1 1 1 23 7  23 o 6  267.383 2.82663 1262.04     37.1201  1274.6      38.6235  168.445    274.627     45.2979     94.6265     
1 1 1 23 7  24 o 10 281.147 2.97957 1408.35     41.1365  1396.61     42.8003  265.915    225.872     133.94      225.872     
1 1 1 23 7  25 o 9  384.475 3.52297 2618.43     67.8477  2630.32     67.9107  299.187    312.056     46.6002     312.056     
1 1 1 23 7  26 o 5  174.133 2.39625 545.876     20.4398  529.707     21.3548  88.7387    127.895     66.1835     307.895     
1 1 1 23 7  27 o 15 370.985 3.46088 2438.47     63.0815  2448.42     65.5853  322.183    258.414     114.495     258.414     
1 1 1 23 7  28 o 9  286.637 3.06053 1457.36     43.8572  1458.81     44.0689  256.96     314.88      108.664     314.88      
1 1 1 23 7  29 o 16 148.413 2.51977 392.61      18.1742  388.811     19.2855  73.3725    54.5818     57.9751     234.582     
1 1 1 23 7  30 o 3  38.3011 3.97861 23.1806     7.13033  30.3007     7.64251  17.9325    136.459     62.0054     136.459     
1 1 1 23 7  31 o 2  229.241 2.95108 962.859     32.2234  902.986     35.3799  209.655    195.725     100.424     195.725     
1 1 1 23 7  32 o 18 249.367 2.80396 1089.54     34.8906  1117.67     35.1894  195.663    78.9164     40.7626     78.9164     
1 1 1 23 7  33 o 13 164.199 2.50585 473.385     19.5928  483.361     21.6166  133.908    32.5225     43.7538     32.5225     
1 1 1 23 7  34 f 0  173.952 2.54924 536.769     21.1658  537.147     23.2324  86.1283    99.8897     0           0           
1 1 1 23 7  35 o 10 69.9852 2.93383 82.1695     9.5718   92.5299     10.9237  32.7688    336.414     15.6166     156.414     
1 1 1 23 7  36 o 4  237.207 2.81657 994.956     32.582   1003.17     34.3645  176.472    16.4148     20.2674     16.4147     
1 1 1 23 7  37 o 9  74.7948 2.8876  96.8642     10.0822  102.476     11.4698  47.7922    253.345     8.55368     253.345     
1 1 1 23 7  38 o 16 139.149 2.51469 333.427     16.1229  354.471     18.8925  90.6884    292.416     9.14553     112.416     
1 1 1 23 7  39 o 1  72.9768 2.98268 91.5289     10.3335  98.4541     11.3917  39.4359    54.682      10.9952     234.682     
1 1 1 23 7  40 o 18 123.162 2.61081 273.117     14.7021  266.258     17.3429  95.3937    236.225     25.879      236.225     
1 1 1 23 7  41 o 10 139.395 2.52768 356.433     16.591   334.312     18.5698  78.5634    276.188     33.8595     96.188      
1 1 1 23 7  42 o 9  159.169 2.54174 448.547     19.2136  451.731     21.2889  130.181    213.955     43.237      213.955     
1 1 1 23 7  43 o 12 120.6   2.43721 253.327     14.2179  263.986     15.2106  102.121    224.396     44.4273     224.396     
1 1 1 23 7  44 o 12 226.994 2.65596 905.122     29.3962  927.508     31.0246  198.792    217.418     84.7331     217.418     
1 1 1 23 7  45 o 3  121.238 2.45344 256.046     14.3435  267.076     15.4366  93.2266    142.06      24.1623     142.06      
1 1 1 23 7  46 o 16 72.5617 2.93949 93.9995     10.5215  94.1868     10.7659  55.3363    316.627     28.6155     316.627     
1 1 1 23 7  47 o 9  126.943 2.64063 272.677     15.6996  301.943     17.8689  84.9549    108.211     0.967512    288.211     
1 1 1 23 7  48 o 1  92.1607 2.69124 139.76      12.1057  163.809     12.6795  36.8863    202.497     48.5985     22.4973     
1 1 1 23 7  49 o 3  110.46  2.53477 214.094     13.487   220.927     14.5327  82.6978    124.633     19.3857     124.633     
1 1 1 23 7  50 o 8  40.6951 4.22582 30.6532     7.94364  30.1175     8.74732  8.52619    291.491     28.9361     111.491     
1 1 1 23 7  51 o 12 83.5175 2.86111 122.117     11.6519  127.498     12.228   43.3213    142.306     23.9566     322.306     
1 1 1 23 7  52 o 17 28.8173 5.4849  16.0456     7.74423  15.2497     8.46458  8.02499    268.093     6.10044     88.0926     
1 1 1 23 7  53 o 1  81.5508 2.98852 117.651     12.2927  120.926     12.0444  57.4794    190.898     7.53466     190.898     
1 1 1 23 7  54 o 19 45.7633 4.45934 33.9361     9.82887  43.6324     9.95055  21.9028    251.049     12.8786     71.0486     
1 1 1 23 7  55 o 15 25.2535 5.81371 16.7922     8.9186   4.82547     9.00511  1.90965    299.228     30.7439     299.228     
1 1 1 23 7  56 o 6  142.584 2.60092 355.425     17.7138  372.382     19.4171  106.448    341.105     22.1593     341.105     
1 1 1 23 7  57 o 6  24.8978 5.64174 6.47556     7.68422  15.9905     8.75473  5.35577    332.81      6.76279     152.81      
1 1 1 23 7  58 o 7  35.2038 5.11826 20.4307     7.86515  27.046      9.6272   19.2041    344.463     1.01495     344.463     
1 1 1 23 7  59 o 14 19.9602 5.28794 7.45015     7.1683   3.84418     7.26036  2.60758    225.635     22.9994     225.636     
1 1 1 23 7  60 f 0  21.4663 5.38888 6.56091     7.20127  8.68222     7.38023  28.8052    327.114     0           0           
1 1 1 23 7  61 o 17 40.4061 4.36083 32.5243     8.49958  28.5967     8.5675   25.9324    8.34417     5.10494     8.34417     
1 1 1 23 7  62 o 7  70.5743 3.36244 83.8758     11.728   97.468      11.8728  29.6804    23.2968     32.2136     203.297     
1 1 1 23 7  63 o 2  75.852  3.60132 115.51      15.1103  95.2111     12.1363  52.4423    247.373     7.11657     247.373     
1 1 1 23 7  64 o 17 44.1567 5.00232 28.6871     10.9254  46.6847     9.71455  24.0243    312.506     6.6741      132.506     
1 1 1 23 7  65 o 18 64.7971 3.72014 77.7626     12.1202  77.0523     11.8317  41.0497    303.466     0.628023    123.466     
1 1 1 23 7  66 o 13 19.1633 5.67885 -1.99205    8.71085  6.18943     9.94025  1.30376    244.306     0.793643    64.3061     
1 1 1 23 7  67 o 5  41.0228 5.42048 26.3044     11.1022  40.5816     10.0856  24.2467    153.203     1.08841     333.203     
1 1 1 23 7  68 o 8  30.0182 6.9875  27.1672     15.1311  11.4102     9.41674  9.75085    228.241     14.977      48.2411     
1 1 1 23 7  69 o 3  21.8511 6.16271 3.50631     12.3748  8.22944     8.51189  6.23458    313.795     3.65652     133.795     
1 1 1 23 7  70 o 15 58.7809 4.86071 63.0348     14.9815  70.6736     12.7251  36.6225    351.51      0.378275    351.51      
1 1 1 23 7  71 o 1  23.5989 6.38041 9.35558     11.0198  9.50059     10.0371  4.62459    81.0965     0.282392    261.096     
1 1 1 23 7  72 o 13 31.2718 6.63634 17.0616     11.9354  24.0593     10.914   16.3488    271.524     1.38629     271.524     
1 1 1 23 7  73 o 9  17.9202 5.60957 -10.4308    11.1788  3.7803      9.86879  1.78847    144.233     8.16878     324.233     
1 1 1 23 7  74 o 4  33.4156 6.9072  15.1927     13.1374  32.4507     12.7518  16.546     166.136     4.781       346.136     
1 1 1 23 7  75 o 5  27.3398 6.92839 18.1915     12.3955  12.0559     11.8726  7.69185    117.741     4.10003     117.741     
1 1 1 23 7  76 o 13 28.0351 7.11015 13.5942     12.9267  19.3367     12.6829  11.8842    337.614     5.7044      157.614     
1 1 1 23 7  77 o 1  25.5946 6.76829 2.50216     12.4364  21.1439     12.7164  9.53999    348.552     5.10265     168.552     
1 1 1 23 7  78 f 0  27.5775 7.11018 11.1554     13.3469  21.8932     12.9241  2.53391    335.695     0           0           
1 1 1 23 7  79 o 6  27.7871 7.13926 7.99409     13.3612  26.0599     13.841   10.1611    81.87       1.48743     261.87      
1 1 1 23 7  80 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 8  0  o 11 241.046 3.45913 1031.55     41.7467  1031.55     41.7467  165.151    180         25.3643     360         
1 1 1 23 8  1  o 18 30.0258 4.84763 22.0168     7.41005  11.6535     7.06672  46.6728    131.924     114.989     131.924     
1 1 1 23 8  2  o 18 172.208 2.76531 543.26      22.6746  508.96      24.9104  87.7028    319.551     70.0262     139.551     
1 1 1 23 8  3  o 18 236.147 2.96223 994.613     33.4009  983.804     36.6184  132.747    173.428     76.3941     353.428     
1 1 1 23 8  4  o 12 48.589  3.24194 45.4407     7.61574  39.198      7.91858  57.4548    83.6861     173.476     83.6861     
1 1 1 23 8  5  o 1  320.132 3.26936 1815.85     52.4402  1821        52.4614  315.094    311.95      167.317     311.95      
1 1 1 23 8  6  o 13 284.69  3.0161  1424.39     43.7955  1451.23     42.2343  149.618    301.772     115.32      121.772     
1 1 1 23 8  7  o 3  144.015 2.34907 370.604     17.2606  364.915     16.6452  133.079    315.649     83.4958     315.649     
1 1 1 23 8  8  f 0  410.296 3.87063 3014.41     82.5833  2963.38     76.5212  201.693    46.067      0           0           
1 1 1 23 8  9  o 18 292.515 3.21787 1514.11     49.0314  1522.34     45.2231  200.126    172.114     24.368      352.114     
1 1 1 23 8  10 o 16 232.1   2.89833 946.452     32.8788  964.786     34.5382  145.249    353.341     43.8468     173.341     
1 1 1 23 8  11 o 18 172.853 2.63943 513.679     23.2159  546.374     22.4659  107.728    259.773     28.6911     79.7731     
1 1 1 23 8  12 o 5  295.601 3.45014 1591.61     48.5572  1510.55     53.394   212.115    86.4774     3.93272     266.477     
1 1 1 23 8  13 o 11 169.699 2.56685 504.765     21.6819  516.717     21.9769  147.362    23.3807     61.6521     23.3807     
1 1 1 23 8  14 o 8  232.038 2.96982 951.322     35.2217  959.074     33.8266  180.108    213.903     28.6001     213.903     
1 1 1 23 8  15 o 15 211.604 2.81109 800.277     29.1165  788.29      30.4757  152.687    42.1362     4.14299     42.1361     
1 1 1 23 8  16 o 4  154.304 2.55762 417.913     19.2779  426.665     20.2735  138.253    308.765     71.143      308.765     
1 1 1 23 8  17 o 10 242.501 3.01888 1019.55     35.9226  1067.5      37.4574  156.804    111.098     34.4254     291.098     
1 1 1 23 8  18 o 4  262.409 3.17977 1209.06     41.793   1234.89     41.8344  179.116    230.117     18.8479     50.1167     
1 1 1 23 8  19 o 1  185.043 2.66681 602.353     24.7174  612.383     24.7416  132.069    23.8783     4.16032     23.8782     
1 1 1 23 8  20 o 1  212.805 2.80483 789.478     29.9032  817.417     29.9147  180.668    291.042     61.8456     291.042     
1 1 1 23 8  21 o 15 181.646 2.61469 581.421     22.7706  589.109     24.8018  118.7      220.379     17.8141     40.379      
1 1 1 23 8  22 o 5  363.299 3.60351 2329.01     61.5899  2358.11     69.4344  296.433    69.705      69.5841     69.705      
1 1 1 23 8  23 o 12 369.818 3.57317 2451.35     66.1702  2405.55     66.2684  276.441    94.6197     20.0162     94.6196     
1 1 1 23 8  24 o 2  54.2617 3.09026 55.0384     8.24905  50.1977     8.39249  1.84684    20.4559     54.1406     20.456      
1 1 1 23 8  25 o 10 148.197 2.44201 383.17      17.7182  395.949     18.5547  85.6361    129.776     33.4257     309.776     
1 1 1 23 8  26 o 5  212.035 2.67549 796.413     27.8486  798.798     29.0004  158.307    359.185     17.9061     359.185     
1 1 1 23 8  27 o 12 131.744 2.4025  303.2       15.6815  312.949     16.0162  66.1324    57.2833     48.1051     237.283     
1 1 1 23 8  28 o 8  84.2508 2.75039 124.246     11.3821  128.204     11.781   45.6719    8.60789     5.9247      188.608     
1 1 1 23 8  29 o 18 64.9144 2.88535 78.7863     9.05704  71.4668     9.56895  17.1181    354.601     35.6227     174.601     
1 1 1 23 8  30 o 1  176.861 2.53282 562.933     21.4298  547.076     23.3933  138.049    35.6674     30.9206     35.6674     
1 1 1 23 8  31 o 7  198.671 2.65151 699.524     25.6616  701.394     27.1182  110.528    111.325     58.9527     291.325     
1 1 1 23 8  32 o 1  181.897 2.45568 596.362     22.3047  577.895     22.4585  105.36     239.088     44.5008     59.0879     
1 1 1 23 8  33 o 14 98.3032 2.50115 172.133     12.2421  171.3       12.3603  74.5559    73.9074     25.0766     73.9074     
1 1 1 23 8  34 o 9  258.674 2.73889 1199.42     35.4366  1176.63     35.5695  184.02     275.739     2.19812     275.739     
1 1 1 23 8  35 o 11 38.6036 4.09601 27.0384     7.6478   27.1903     7.71183  7.26961    326.867     51.2558     326.867     
1 1 1 23 8  36 o 12 162.353 2.47258 472.842     19.5518  463.05      20.6545  139.738    270.575     56.0924     270.575     
1 1 1 23 8  37 o 6  27.0018 5.31943 17.2395     7.15792  8.89557     8.35177  31.0718    17.9249     86.86       17.9249     
1 1 1 23 8  38 o 3  102.972 2.56014 179.426     12.9531  197.915     13.4231  62.8027    282.696     12.2683     102.696     
1 1 1 23 8  39 o 14 58.9001 3.22159 54.8152     8.86673  69.8138     10.0014  22.515     316.884     24.9175     136.884     
1 1 1 23 8  40 o 6  67.7758 3.08697 86.0839     9.71327  78.1307     11.0138  30.3391    343.393     24.4171     163.393     
1 1 1 23 8  41 o 1  59.4281 3.36518 58.6645     8.94182  68.1205     10.9409  16.8052    145.186     40.4476     325.186     
1 1 1 23 8  42 f 0  53.2261 3.53527 44.9879     8.61491  57.2937     10.0382  53.4303    39.8877     0           0           
1 1 1 23 8  43 o 15 43.0384 4.18775 36.3041     7.9729   31.2722     9.37172  12.4042    271.529     4.97748     91.5291     
1 1 1 23 8  44 o 18 77.8415 2.92809 118.967     10.4909  97.9824     11.9828  50.9688    132.814     2.76898     132.814     
1 1 1 23 8  45 o 3  31.3647 5.20614 19.5406     7.33463  17.2365     8.78446  2.53783    178.7       28.5826     178.7       
1 1 1 23 8  46 o 3  235.409 2.90738 964.19      32.5259  1011.93     36.0512  184.79     53.4005     45.0337     53.4005     
1 1 1 23 8  47 o 15 68.1139 3.22189 83.0356     9.81524  83.4121     11.9445  43.2112    241.618     3.0995      241.618     
1 1 1 23 8  48 o 4  105.648 2.7891  193.017     14.2921  205.689     15.1933  82.9434    215.396     25.98       215.396     
1 1 1 23 8  49 o 12 176.415 2.68504 532.133     22.5663  578.273     24.9183  143.298    258.512     46.0058     258.512     
1 1 1 23 8  50 o 7  79.1633 3.14759 111.268     11.496   113.611     13.3238  38.5961    97.8902     28.376      277.89      
1 1 1 23 8  51 o 12 95.8921 2.97149 160.643     13.2485  168.864     15.2138  79.8295    343.671     31.9932     343.671     
1 1 1 23 8  52 o 19 72.58   3.22628 88.3416     10.5272  101.498     12.8256  31.4339    95.0892     33.6692     275.089     
1 1 1 23 8  53 o 4  76.8084 3.31167 118.537     10.9644  94.7359     13.767   58.9543    345.465     17.3538     345.465     
1 1 1 23 8  54 o 4  32.1543 5.51253 15.8581     7.69416  24.1211     9.96887  3.76835    277.352     30.6537     97.352      
1 1 1 23 8  55 o 8  46.117  4.30345 40.164      9.40008  38.4532     9.97371  23.5011    224.042     10.5291     44.0424     
1 1 1 23 8  56 o 13 80.8341 3.13413 115.714     11.6367  120.051     13.609   53.7936    71.749      1.16629     71.7488     
1 1 1 23 8  57 o 7  62.6967 3.51521 69.5243     10.885   73.4334     11.0204  43.7958    6.72999     7.13768     6.72999     
1 1 1 23 8  58 o 15 46.6763 3.90248 38.0639     8.79813  42.2067     9.09866  29.7871    194.971     2.24507     194.971     
1 1 1 23 8  59 o 11 60.0477 3.35863 61.935      9.68883  69.2495     10.3631  44.0854    336.256     12.0153     336.256     
1 1 1 23 8  60 o 10 82.8077 2.99418 117.947     12.399   129.858     12.343   48.1064    178.549     12.2767     358.549     
1 1 1 23 8  61 f 0  60.9366 3.60147 76.5521     10.9803  59.7662     10.704   49.7127    171.832     0           0           
1 1 1 23 8  62 o 16 41.0996 5.10109 25.803      10.4255  39.4407     9.43766  18.3957    286.115     14.2432     106.115     
1 1 1 23 8  63 f 0  41.2442 4.95118 36.6517     10.5433  28.7854     9.20867  25.9961    68.7791     0           0           
1 1 1 23 8  64 o 8  51.8551 4.47597 53.208      12.644   48.2703     10.0649  35.3404    136.264     5.59225     136.264     
1 1 1 23 8  65 f 0  15.759  4.97683 -2.80345    7.93475  -1.67867    8.10541  13.3292    263.949     0           0           
1 1 1 23 8  66 o 11 23.3642 5.56762 2.70738     8.5175   15.7791     8.30442  8.26383    129.93      6.52895     309.93      
1 1 1 23 8  67 o 6  62.3635 3.69814 65.9146     11.6146  79.1506     11.1391  34.8555    265.221     9.56214     85.2209     
1 1 1 23 8  68 o 11 36.6347 5.84897 40.7661     11.9105  15.9266     9.74919  11.9926    139.065     20.441      319.065     
1 1 1 23 8  69 o 11 24.2331 6.24323 2.33625     11.165   16.26       10.0602  3.02654    139.178     0.667444    139.178     
1 1 1 23 8  70 o 11 18.5523 5.70972 3.25468     10.5521  -2.29438    9.37281  0.891488   40.6357     17.8992     40.6358     
1 1 1 23 8  71 o 8  18.433  5.73113 -2.48679    10.8307  1.54058     9.77629  0.918396   308.31      2.09516     128.309     
1 1 1 23 8  72 o 11 18.4714 5.68467 -8.66827    11.1303  5.20317     9.7437   2.42209    354.241     3.9532      174.241     
1 1 1 23 8  73 o 18 37.0417 6.90359 29.4449     13.0608  29.8513     12.9283  16.8827    272.753     9.9332      92.7533     
1 1 1 23 8  74 o 6  47.6608 6.44581 57.0517     14.1127  39.1674     15.2964  21.5318    89.094      14.9472     269.094     
1 1 1 23 8  75 o 4  29.8965 7.228   20.6465     12.89    18.7071     13.1767  8.25064    181.477     17.4936     1.47649     
1 1 1 23 8  76 o 6  48.7452 6.48315 56.2153     14.8564  46.8119     15.5586  30.3702    336.502     3.05072     336.502     
1 1 1 23 8  77 o 16 29.2477 7.23026 13.1817     13.2142  26.0297     13.6581  11.8495    91.2245     5.70961     271.225     
1 1 1 23 8  78 o 14 15.0966 5.14707 -17.8332    11.8388  -8.94369    11.5665  0.950412   250.501     5.30549     250.501     
1 1 1 23 8  79 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 9  0  o 13 43.7238 3.65844 35.3017     7.72146  35.3017     7.72146  55.3977    180         167.274     180         
1 1 1 23 9  1  o 12 247.456 2.85326 1080.75     35.3715  1091.74     35.3948  122.105    125.854     115.736     305.854     
1 1 1 23 9  2  o 17 168.936 2.56132 510.923     22.1117  501.385     21.2551  104.325    187.474     30.8282     7.47364     
1 1 1 23 9  3  o 12 156.579 2.51248 439.437     19.6516  430.169     19.775   124.59     36.6648     33.0022     36.6648     
1 1 1 23 9  4  o 9  151.417 2.54137 421.996     19.6282  391.505     18.9397  94.4525    92.4616     23.0421     272.462     
1 1 1 23 9  5  o 13 371.664 3.82492 2460.62     72.7499  2444.86     69.7099  313.545    106.296     84.1782     106.296     
1 1 1 23 9  6  o 18 139.18  2.46515 349.838     16.7599  337.502     17.5835  71.6345    218.689     51.0048     38.6888     
1 1 1 23 9  7  o 10 220.228 2.70374 864.831     29.1661  855.72      30.4914  140.125    305.32      37.1247     125.32      
1 1 1 23 9  8  o 4  265.772 3.02367 1283.63     39.3959  1223.19     41.0726  141.995    146.649     102.547     326.649     
1 1 1 23 9  9  o 15 63.3136 2.80548 74.2506     8.61201  68.5808     9.06506  3.99912    280.417     61.256      100.417     
1 1 1 23 9  10 o 18 33.3871 4.25216 22.8419     6.81929  18.0929     6.84934  14.638     343.413     40.9707     343.413     
1 1 1 23 9  11 o 7  303.729 3.25687 1668.09     48.5252  1606.55     50.5491  268.677    175.782     97.8437     175.782     
1 1 1 23 9  12 o 8  185.526 2.69047 638.226     23.7684  583.455     26.0667  154.674    18.6425     49.0049     18.6425     
1 1 1 23 9  13 o 18 137.802 2.35349 340.063     16.458   333.447     16.0478  108.807    79.8422     33.0522     79.8422     
1 1 1 23 9  14 o 9  62.2545 2.74369 71.454      8.56348  66.6213     8.46604  7.5393     264.821     88.005      264.821     
1 1 1 23 9  15 o 1  217.481 2.7803  832.779     31.4154  845.386     29.127   175.123    234.164     40.6613     234.164     
1 1 1 23 9  16 o 7  94.2728 2.52579 168.719     11.9368  147.354     11.8496  56.1987    163.929     0.258889    163.929     
1 1 1 23 9  17 o 6  353.742 3.56983 2212.2      64.4448  2231.35     62.0903  304.456    241.578     96.6057     241.578     
1 1 1 23 9  18 o 3  93.6951 2.69905 150.943     13.1626  161.118     12.0587  13.5545    184.725     98.139      4.72498     
1 1 1 23 9  19 o 9  344.299 3.67993 2095.56     63.4165  2114.74     63.5721  263.528    81.2643     28.7481     81.2643     
1 1 1 23 9  20 o 4  199.943 2.66037 699.429     27.1133  718.987     26.1752  114.503    354.74      55.889      174.74      
1 1 1 23 9  21 o 3  42.6567 4.11013 29.9566     8.82581  36.04       8.12658  29.9701    264         101.808     264         
1 1 1 23 9  22 o 7  94.5787 2.64256 161.246     12.3295  156.639     12.662   39.5065    63.8513     43.8046     243.851     
1 1 1 23 9  23 o 12 48.1039 3.47479 40.4787     8.2538   42.5662     8.25968  0.577131   225.569     14.2765     45.5688     
1 1 1 23 9  24 o 2  307.717 3.43887 1645.34     51.8891  1718.01     54.1787  212.238    95.8446     18.1013     275.845     
1 1 1 23 9  25 o 5  128.312 2.57417 291.976     16.4745  292.67      16.5971  62.0778    43.2765     52.3584     223.277     
1 1 1 23 9  26 o 3  389.318 3.96146 2706.94     73.9442  2681.32     80.4626  269.82     270.122     21.286      90.1219     
1 1 1 23 9  27 o 18 53.7795 3.39113 48.1252     9.09763  55.5634     8.93479  5.50336    307.147     40.4134     127.147     
1 1 1 23 9  28 o 3  139.917 2.63938 350.175     17.5341  345.147     19.3853  103.637    245.664     15.9164     245.664     
1 1 1 23 9  29 o 13 159.9   2.56089 460.621     19.8967  446.893     21.1056  113.812    199.972     4.89957     199.972     
1 1 1 23 9  30 o 19 174.347 2.67553 540.591     23.321   538.521     23.432   116.963    133.782     11.019      313.782     
1 1 1 23 9  31 o 13 176.692 2.68677 548.03      24.0024  560.469     23.5698  129.275    169.194     10.5587     169.194     
1 1 1 23 9  32 o 12 176.435 2.58688 541.776     22.6946  563.536     23.0502  127.252    181.754     6.71801     181.754     
1 1 1 23 9  33 o 10 108.949 2.44487 223.316     12.9166  198.849     13.6584  76.0472    350.12      5.40723     350.12      
1 1 1 23 9  34 o 16 131.408 2.40396 310         15.4094  303.326     16.2166  93.4358    354.023     6.18057     354.023     
1 1 1 23 9  35 o 2  180.267 2.55476 575.368     22.9328  578.859     23.226   130.265    320.809     8.07821     320.809     
1 1 1 23 9  36 o 6  147.866 2.51949 401.033     18.4332  376.066     18.8596  49.8265    89.3671     107.368     269.367     
1 1 1 23 9  37 o 2  178.831 2.68026 570.437     23.8691  566.153     24.1693  145.636    157.26      42.3864     157.26      
1 1 1 23 9  38 o 2  148.781 2.43369 396.08      17.6072  390.384     18.6603  123.449    78.1347     42.4209     78.1347     
1 1 1 23 9  39 o 19 64.8693 3.18849 81.4093     9.64017  69.3824     10.775   36.0086    86.2562     6.66223     266.256     
1 1 1 23 9  40 o 9  131.646 2.52588 304.864     15.7471  311.772     17.5205  79.9918    307.267     21.265      127.267     
1 1 1 23 9  41 o 10 147.467 2.53343 389.748     17.6993  383.915     19.6599  78.3006    293.333     47.7384     113.333     
1 1 1 23 9  42 o 15 126.549 2.62046 295.307     15.6695  275.234     17.407   71.2613    168.723     31.1666     348.723     
1 1 1 23 9  43 o 10 86.8271 2.76991 128.649     11.3443  140.545     12.7027  66.0789    99.6791     20.2404     99.6791     
1 1 1 23 9  44 o 19 24.7073 5.53221 5.86374     7.70649  15.4121     8.26168  7.95113    195.764     29.2708     195.764     
1 1 1 23 9  45 o 17 46.6447 4.01727 32.7437     8.73457  47.0772     9.5211   2.46841    105.61      51.7225     285.61      
1 1 1 23 9  46 o 4  129.413 2.74614 286.552     16.862   311.381     18.7229  103.223    262.098     31.3409     262.098     
1 1 1 23 9  47 o 2  127.821 2.81294 286.205     16.5517  297.386     19.3767  93.944     3.55334     14.1459     3.55334     
1 1 1 23 9  48 o 15 151.507 2.86085 391.027     21.2437  429.71      22.1574  129.287    33.9402     51.7532     33.9402     
1 1 1 23 9  49 o 6  65.4844 3.307   81.7356     9.9887   72.7893     11.4007  45.7193    184.721     5.87207     184.721     
1 1 1 23 9  50 o 8  93.2286 2.86538 152.72      12.9903  158.69      13.7205  89.2654    306.924     55.5788     306.924     
1 1 1 23 9  51 f 0  29.4963 5.30556 18.4197     7.53473  14.5703     8.27862  41.0093    56.3839     0           0           
1 1 1 23 9  52 o 11 86.5875 2.73911 129.033     11.3441  139.887     12.3718  50.2133    245.49      15.6875     65.4897     
1 1 1 23 9  53 o 10 29.9965 5.427   14.3992     7.96829  20.1479     8.50522  11.7912    77.6107     0.973331    257.611     
1 1 1 23 9  54 o 9  62.5439 3.30057 72.5331     9.84777  69.1401     10.6484  40.7865    9.06771     0.30448     9.06781     
1 1 1 23 9  55 o 16 91.3716 2.92247 159.79      12.3427  140.963     14.1268  61.1108    217.279     0.53155     217.279     
1 1 1 23 9  56 o 2  55.4572 4.09225 46.4365     11.2271  67.6623     10.6585  42.2596    143.805     14.9766     143.805     
1 1 1 23 9  57 o 19 20.6406 5.63365 8.83668     8.43186  1.24054     8.60002  1.18793    60.6206     21.4025     60.6206     
1 1 1 23 9  58 o 2  25.4828 5.79454 5.39363     8.98938  17.465      8.86652  5.40527    109.412     15.4987     289.412     
1 1 1 23 9  59 o 14 62.8279 4.28033 67.2055     13.4169  79.0051     13.0834  38.2679    320.377     4.77643     140.377     
1 1 1 23 9  60 o 10 38.9965 5.2901  29.229      10.3536  29.3406     9.56153  7.1025     314.476     35.0378     134.476     
1 1 1 23 9  61 o 4  41.573  5.12386 39.9578     10.6316  26.9844     9.85554  23.4284    148.14      4.61085     328.14      
1 1 1 23 9  62 o 17 46.63   4.50988 35.1745     10.0858  47.3535     10.2442  33.6152    106.063     9.43115     106.063     
1 1 1 23 9  63 o 14 53.8576 4.53056 68.8952     10.9245  42.1458     11.9581  35.0505    162.309     1.63716     162.309     
1 1 1 23 9  64 o 7  22.0238 5.68115 4.86234     8.12596  11.2077     8.47945  6.59507    312.859     0.113236    132.859     
1 1 1 23 9  65 f 0  23.1006 5.81822 14.4979     8.86759  2.76703     9.24934  18.094     197.585     0           0           
1 1 1 23 9  66 f 0  22.8957 5.82907 4.68263     8.56687  13.4443     9.05394  5.84668    140.82      0           0           
1 1 1 23 9  67 o 14 25.7951 5.97654 10.4184     8.92725  15.8526     9.09449  8.45911    69.8789     10.9339     249.879     
1 1 1 23 9  68 o 6  37.2575 5.78962 24.5205     11.469   32.1769     9.60659  23.6393    18.8358     4.88182     18.8358     
1 1 1 23 9  69 o 6  19.5044 5.89184 1.02805     10.59    3.29135     9.86137  1.5929     160.655     2.37126     340.655     
1 1 1 23 9  70 o 6  52.7882 5.04158 52.5493     13.1053  56.9216     12.8467  40.3993    313.113     17.202      313.113     
1 1 1 23 9  71 o 5  38.165  6.35812 28.4937     12.0805  32.7305     11.8697  24.9691    58.4245     6.39677     58.4245     
1 1 1 23 9  72 o 7  42.4508 6.23866 34.9724     13.424   40.1684     12.2298  26.0741    129.563     1.41618     129.563     
1 1 1 23 9  73 o 7  23.4185 6.37448 -6.09889    12.05    18.2628     11.9475  9.12667    138.781     0.209196    138.781     
1 1 1 23 9  74 o 17 25.975  7.2252  4.78949     12.837   20.0158     15.3225  9.0787     242.394     3.60391     242.394     
1 1 1 23 9  75 o 18 40.2508 7.47797 43.3462     14.1528  32.4367     17.1663  21.3564    79.389      3.95808     259.389     
1 1 1 23 9  76 o 19 49.833  6.82547 49.6566     15.1229  62.6675     17.7777  33.0041    184.211     7.7427      184.211     
1 1 1 23 9  77 o 9  40.5711 7.56454 50.2938     15.1977  30.8597     17.4579  21.8151    304.697     1.5739      124.697     
1 1 1 23 9  78 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 10 0  o 1  55.9504 2.89188 56.3853     8.00689  56.3853     8.00689  2.30644    180         5.11679     360         
1 1 1 23 10 1  o 10 349.539 3.33102 2163.07     58.3461  2174.04     58.3514  266.794    284.648     21.7502     284.648     
1 1 1 23 10 2  o 18 186.338 2.49183 607.301     23.2398  624.383     23.2961  137.647    77.8916     10.004      77.8916     
1 1 1 23 10 3  o 12 218.173 2.57812 846.955     28.1978  841.569     28.178   117.641    214.064     80.8413     34.0639     
1 1 1 23 10 4  o 8  210.035 2.66746 779.588     28.5948  785.452     27.5451  117.447    262.642     68.6898     82.6418     
1 1 1 23 10 5  o 5  97.136  2.43745 169.24      12.0643  165.86      11.628   6.22322    131.309     120.516     311.309     
1 1 1 23 10 6  o 19 252.465 2.93369 1134.19     37.1216  1127.6      37.1126  186.209    277.307     6.50855     277.307     
1 1 1 23 10 7  o 15 264.081 2.95285 1235.55     39.0524  1239.21     39.1047  205.878    234.47      28.9108     234.47      
1 1 1 23 10 8  o 16 104.81  2.46512 199.496     12.9049  190.637     12.9487  49.1168    18.756      41.5138     198.756     
1 1 1 23 10 9  o 8  371.979 3.79531 2524.62     70.7042  2391.13     70.7551  252.675    48.7992     39.3945     228.799     
1 1 1 23 10 10 o 19 260.373 2.9569  1223.26     39.3284  1182.75     37.8396  230.59     80.8439     85.9551     80.8439     
1 1 1 23 10 11 o 17 133.719 2.60471 336.195     16.9062  299.165     17.8557  86.6959    336.74      10.0818     156.74      
1 1 1 23 10 12 o 14 215.283 2.74831 824.446     28.3099  819.997     30.9265  184.854    218.628     63.0681     218.628     
1 1 1 23 10 13 o 6  269.44  2.90333 1285.7      39.1283  1290.56     39.2774  181.789    16.7967     27.1604     196.797     
1 1 1 23 10 14 o 19 181.092 2.48395 595.542     22.4356  567.946     22.6347  120.501    291.147     16.2367     111.147     
1 1 1 23 10 15 o 12 84.3241 2.52281 128.137     10.5306  124.573     10.7375  9.98145    80.2505     91.1128     260.251     
1 1 1 23 10 16 o 17 214.48  2.71121 817.664     29.5729  814.561     28.705   156.312    26.6158     5.63546     26.6158     
1 1 1 23 10 17 o 15 176.293 2.54189 565.02      22.3182  537.738     22.5783  144.087    13.3328     41.2476     13.3328     
1 1 1 23 10 18 o 17 31.6918 4.76446 21.9451     7.31755  15.3071     7.37663  16.3557    62.342      45.581      62.342      
1 1 1 23 10 19 o 5  97.9574 2.68728 174.185     12.8625  166.855     13.4472  54.1395    24.6007     18.1239     204.601     
1 1 1 23 10 20 o 5  76.9991 2.7584  103.898     10.5806  107.053     10.6369  38.2248    265.59      5.04202     85.5903     
1 1 1 23 10 21 o 11 122.812 2.4621  277.851     15.2824  257.873     14.9872  67.8431    242.06      32.472      62.06       
1 1 1 23 10 22 f 0  294.38  3.18899 1572.53     45.9944  1505.05     48.014   151.832    299.156     0           0           
1 1 1 23 10 23 o 17 137.007 2.436   336.136     16.4357  330.094     16.9898  87.4934    249.053     14.3939     69.0529     
1 1 1 23 10 24 o 13 20.914  5.22564 9.87871     7.02627  2.58975     7.19997  5.24791    347.843     12.1037     347.843     
1 1 1 23 10 25 o 8  235.204 2.7684  984.79      33.1796  979.062     32.0765  152.069    175.123     32.9156     355.123     
1 1 1 23 10 26 o 16 237.16  2.81264 1021.99     34.6164  975.245     32.24    158.343    80.8134     22.9494     260.813     
1 1 1 23 10 27 o 15 292.197 3.21517 1506.12     48.9146  1527.5      45.1415  217.316    293.34      14.8831     293.34      
1 1 1 23 10 28 o 15 84.3087 2.84355 134.366     11.7044  118.871     12.184   34.2396    191.637     43.651      11.6366     
1 1 1 23 10 29 o 17 47.065  3.75911 33.4312     8.71198  46.9604     8.40489  9.9303     168.833     76.4682     168.833     
1 1 1 23 10 30 o 12 132.691 2.49173 313.918     16.4326  311.615     16.6746  98.639     224.601     13.6549     224.601     
1 1 1 23 10 31 o 6  181.745 2.66715 587.263     24.1202  585.948     24.463   130.41     111.96      4.04353     111.961     
1 1 1 23 10 32 o 18 179.313 2.65903 571.636     23.2939  570.575     24.479   119.11     48.5669     15.0476     228.567     
1 1 1 23 10 33 o 15 248.541 2.84001 1080.03     35.2496  1115.68     35.494   189.742    123.665     26.3139     123.665     
1 1 1 23 10 34 o 9  171.01  2.57775 518.035     21.9458  521.004     22.2367  152.833    139.556     67.4572     139.556     
1 1 1 23 10 35 o 4  108.157 2.60156 205.408     13.3645  210.804     14.7768  74.7979    50.6423     2.82424     50.6424     
1 1 1 23 10 36 o 18 95.3082 2.65829 166.516     12.4456  156.978     12.8728  75.9415    166.337     27.2713     166.337     
1 1 1 23 10 37 o 15 26.0346 5.36169 16.1901     7.2905   7.91829     8.14395  23.9129    318.473     71.7606     318.473     
1 1 1 23 10 38 o 10 170.92  2.56173 509.862     21.6866  529.064     22.1994  142.674    152.615     47.4288     152.615     
1 1 1 23 10 39 o 9  76.3306 2.91987 101.519     11.2273  106.587     11.0163  44.1148    355.579     11.5191     175.579     
1 1 1 23 10 40 o 14 156.095 2.48914 428.117     19.1919  438.681     19.7516  132.717    104.876     49.878      104.876     
1 1 1 23 10 41 o 1  121.928 2.61373 260.414     15.9261  269.361     15.976   89.5617    301.295     12.6724     301.295     
1 1 1 23 10 42 o 11 36.3234 5.28147 21.3284     8.28857  28.2914     10.3378  3.56226    248.239     25.9651     68.2391     
1 1 1 23 10 43 o 4  105.317 2.83606 190.278     14.3033  205.949     15.5842  83.8837    171.284     27.3546     171.284     
1 1 1 23 10 44 o 18 98.4455 2.91849 164.353     13.6357  182.314     15.1068  55.2918    172.685     22.5341     352.685     
1 1 1 23 10 45 o 7  33.3485 5.46489 19.7942     8.16358  22.234      9.75173  5.76734    337.007     18.625      157.007     
1 1 1 23 10 46 o 19 93.6871 2.91758 146.896     12.6268  167.573     14.7151  68.2291    19.5582     10.2828     19.5582     
1 1 1 23 10 47 o 9  24.5749 5.58617 9.96422     7.33757  11.7344     8.27642  2.42027    19.85       14.1396     199.85      
1 1 1 23 10 48 o 5  113.329 2.72343 231.963     14.24    227.405     16.5355  74.4086    207.811     6.206       27.8111     
1 1 1 23 10 49 o 2  38.7013 4.64982 23.554      8.18234  32.642      9.19402  18.876     209.845     8.36454     29.8454     
1 1 1 23 10 50 o 12 118.882 2.68032 237.766     15.1987  268.672     16.7092  86.255     193.131     10.6416     193.131     
1 1 1 23 10 51 o 14 59.2988 3.47007 55.4784     9.58542  72.6155     10.841   30.512     68.1273     17.0198     248.127     
1 1 1 23 10 52 o 8  72.5168 3.45683 98.9751     11.2542  91.5862     13.4959  42.9256    44.2179     10.6754     224.218     
1 1 1 23 10 53 o 6  97.0665 3.06647 160.41      13.7479  179.385     16.0137  66.4454    99.9308     2.3973      99.9307     
1 1 1 23 10 54 f 0  34.2649 5.68177 26.8689     8.93044  18.4741     10.4332  35.328     305.611     0           0           
1 1 1 23 10 55 o 9  53.7478 4.01718 60.9694     10.2809  45.8522     10.7331  34.76      51.1373     0.714547    51.1375     
1 1 1 23 10 56 o 6  49.2089 4.58998 46.3868     10.9288  44.031      11.1414  30.5982    318.934     0.968603    138.934     
1 1 1 23 10 57 o 5  52.0298 4.33997 42.2732     11.1328  58.9254     10.6391  34.7696    129.316     3.5822      129.316     
1 1 1 23 10 58 o 4  56.3749 3.80221 52.084      10.6326  65.0805     10.4397  46.121     64.3385     21.2288     64.3385     
1 1 1 23 10 59 o 17 70.8741 3.31998 98.7712     12.3656  84.4429     11.0963  55.1316    52.6056     17.9285     52.6056     
1 1 1 23 10 60 o 11 28.6787 5.66192 23.2616     9.37712  9.15644     8.31002  11.0953    311.301     11.0946     131.301     
1 1 1 23 10 61 o 5  40.7022 4.66916 38.6843     9.06205  25.1993     9.05174  24.9349    293.606     0.540769    113.606     
1 1 1 23 10 62 o 11 21.8486 5.83849 3.04575     9.91342  10.354      8.27712  5.35639    248.351     0.0314053   248.351     
1 1 1 23 10 63 o 13 51.2146 4.13854 47.9696     10.18    50.8406     10.6847  39.2982    300.403     14.2911     300.403     
1 1 1 23 10 64 o 13 36.0833 5.50212 30.0772     9.98794  22.3306     9.36741  18.8741    106.819     5.9194      286.819     
1 1 1 23 10 65 o 6  72.9971 3.55692 97.2071     13.8946  100.555     11.8201  49.1732    32.9557     4.22914     32.9558     
1 1 1 23 10 66 o 15 37.1644 5.48323 27.2687     9.61228  28.3879     10.1513  14.2989    147.288     16.8374     327.288     
1 1 1 23 10 67 o 16 23.7555 6.15651 5.65299     10.7835  13.4676     9.14772  8.07538    280.475     3.4468      100.475     
1 1 1 23 10 68 o 7  45.521  5.687   50.083      12.6946  34.4523     12.1626  19.0931    201.526     17.9965     21.5258     
1 1 1 23 10 69 o 10 36.6862 7.18623 34.1698     12.2463  24.1581     16.1215  15.1729    69.8024     13.1811     249.802     
1 1 1 23 10 70 o 9  58.9431 5.47557 67.9613     14.1015  70.4457     17.2636  36.9843    261.862     0.266763    261.862     
1 1 1 23 10 71 o 10 32.2095 7.01692 9.82983     11.9485  35.6879     14.753   16.5733    291.975     3.45878     111.975     
1 1 1 23 10 72 o 2  26.5753 7.14079 10.5774     11.775   17.3859     14.483   11.8904    357.395     3.45343     177.395     
1 1 1 23 10 73 f 0  23.2223 6.82256 7.46275     14.3299  7.67508     11.8679  17.7431    196.886     0           0           
1 1 1 23 10 74 o 3  27.9521 6.96204 6.3022      13.1807  26.0565     13.0889  11.1711    317.392     6.89035     137.392     
1 1 1 23 10 75 o 12 16.1474 5.39671 -12.1448    11.6939  -5.35883    11.4495  0.0491137  212.875     4.11171     212.875     
1 1 1 23 10 76 f 0  47.7393 6.56106 52.7234     15.1962  50.085      15.0655  19.774     356.995     0           0           
1 1 1 23 10 77 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 11 0  o 6  49.9166 3.17404 45.2459     7.78512  45.2459     7.78512  29.1677    360         123.717     360         
1 1 1 23 11 1  f 0  368.5   3.47919 2393.85     64.2489  2428.21     64.2494  303.491    108.565     0           0           
1 1 1 23 11 2  o 9  104.636 2.38463 192.879     12.2253  195.892     12.7489  43.5894    296.508     54.4322     116.508     
1 1 1 23 11 3  o 12 115.082 2.47447 228.368     15.0659  241.971     13.3287  62.0062    4.75617     32.6583     184.756     
1 1 1 23 11 4  o 18 143.064 2.41726 364.438     16.9913  361.579     17.6606  81.7525    80.6317     37.6924     260.632     
1 1 1 23 11 5  o 5  98.6966 2.43677 171.203     12.0035  174.766     12.0641  63.8817    202.543     5.13282     202.543     
1 1 1 23 11 6  f 0  197.897 2.5493  703.181     25.7544  686.234     24.8106  126.417    48.0816     0           0           
1 1 1 23 11 7  o 2  53.893  2.98668 50.0641     7.93602  53.6813     8.06424  4.92371    273.516     24.1268     93.5163     
1 1 1 23 11 8  o 13 218.313 2.67661 852.178     29.8211  838.886     28.7434  167.317    308.385     20.0674     308.385     
1 1 1 23 11 9  o 3  326.85  3.20031 1882.4      53.3595  1910.22     51.4478  230.204    201.121     17.9764     21.1212     
1 1 1 23 11 10 o 10 147.46  2.43015 380.231     18.2569  391.165     17.6433  97.3565    49.1255     11.9581     229.125     
1 1 1 23 11 11 o 16 249.453 3.0998  1118.78     39.6081  1090.23     37.8921  164.044    208.435     34.3195     28.4349     
1 1 1 23 11 12 o 9  47.6004 3.53848 44.8656     8.08159  36.7041     8.42417  4.02275    21.7298     43.9817     21.7298     
1 1 1 23 11 13 o 3  124.09  2.5294  270.365     15.671   276.411     15.7544  97.6607    312.78      30.5623     312.78      
1 1 1 23 11 14 o 8  151.744 2.42861 406.853     18.4274  410.023     18.5093  127.729    175.397     46.3101     175.397     
1 1 1 23 11 15 o 11 125.621 2.42471 281.466     15.1176  278.789     15.38    91.4123    231.348     12.7681     231.348     
1 1 1 23 11 16 o 11 188.847 2.59579 637.684     24.4779  627.785     24.6521  147.438    201.417     26.2773     201.417     
1 1 1 23 11 17 o 19 58.4958 3.0746  57.2386     8.88443  65.0404     8.98947  9.12596    202.893     42.0911     22.8934     
1 1 1 23 11 18 o 10 91.0176 2.71082 154.319     12.0928  140.376     12.5344  46.7785    177.374     23.8981     357.374     
1 1 1 23 11 19 o 5  277.198 3.00867 1363.58     42.5433  1364.6      41.0325  222.19     289.641     43.424      289.641     
1 1 1 23 11 20 f 0  97.2758 2.61789 173.077     12.2316  163.31      13.1904  56.4314    96.778      0           0           
1 1 1 23 11 21 o 13 132.104 2.54549 311.409     17.2631  308.404     16.4021  35.5329    36.0578     116.114     216.058     
1 1 1 23 11 22 o 16 223.932 2.8513  883.341     33.0968  897.189     30.8395  165.012    177.256     8.23753     177.256     
1 1 1 23 11 23 o 10 107.14  2.77799 198.401     13.5308  209.803     16.1948  66.3513    354.366     12.926      174.366     
1 1 1 23 11 24 o 6  115.097 2.58516 236.61      14.2472  234.135     15.5031  76.7651    276.22      4.52195     96.2197     
1 1 1 23 11 25 o 7  93.4108 2.69047 151.301     11.9478  159.083     13.1831  28.3526    297.002     71.9821     117.002     
1 1 1 23 11 26 o 9  69.1729 3.11541 94.3778     10.171   76.8        11.1007  43.8236    263.588     14.5538     263.588     
1 1 1 23 11 27 o 16 83.1257 2.70738 115.916     11.1809  130.223     11.2919  43.4955    74.8899     23.4701     254.89      
1 1 1 23 11 28 o 4  100.985 2.78036 180.795     14.1482  182.053     13.9381  65.837     299.734     5.51104     119.734     
1 1 1 23 11 29 o 2  153.399 2.6906  420.982     21.1579  415.284     20.187   140.443    326.517     67.4616     326.517     
1 1 1 23 11 30 o 9  110.436 2.56655 205.502     14.3015  228.515     14.0214  96.9935    338.03      46.9216     338.03      
1 1 1 23 11 31 o 3  88.3447 2.66019 143.609     11.9483  134.312     11.5528  39.2202    304.602     41.5889     124.602     
1 1 1 23 11 32 o 16 153.708 2.47822 419.824     19.3709  419.553     18.8043  97.0119    240.68      22.6399     60.6797     
1 1 1 23 11 33 o 7  130.624 2.52361 302.26      17.1125  304.55      15.8672  105.086    347.456     29.6603     347.456     
1 1 1 23 11 34 o 8  46.5088 3.72795 31.271      8.24732  47.7434     8.53187  5.41684    325.597     0.53577     325.597     
1 1 1 23 11 35 o 11 111.712 2.4938  224.088     13.6579  220.007     14.2175  92.4075    289.692     33.3954     289.692     
1 1 1 23 11 36 o 12 177.013 2.74289 558.091     23.6189  556.904     25.0227  113.742    14.6458     22.1209     194.646     
1 1 1 23 11 37 o 15 67.5995 3.19695 81.3728     10.3213  82.2647     11.2     39.9616    279.533     6.08232     99.5328     
1 1 1 23 11 38 o 17 70.6241 3.11202 89.6025     10.7497  88.9287     11.1633  54.8637    60.4887     27.6453     60.4887     
1 1 1 23 11 39 o 10 179.767 2.72588 578.243     24.1003  572.884     25.0008  138.341    214.11      25.1175     214.11      
1 1 1 23 11 40 o 8  58.6401 3.40458 66.1813     9.80487  57.6786     9.97454  36.8281    201.442     17.4773     201.442     
1 1 1 23 11 41 o 10 97.6648 2.80269 168.652     13.5613  172.019     13.8169  78.2436    118.579     26.7634     118.579     
1 1 1 23 11 42 o 1  137.516 2.52877 341.177     17.4011  333         17.421   98.8273    304.491     7.7149      304.491     
1 1 1 23 11 43 o 5  21.4321 5.1172  1.27668     7.16382  12.3578     7.03568  8.90493    53.6618     31.8965     53.6618     
1 1 1 23 11 44 o 14 151.275 2.63267 410.889     19.7485  405.659     20.1465  98.566     34.3195     13.0128     214.32      
1 1 1 23 11 45 o 2  41.4811 4.17955 30.1962     7.9845   33.0692     8.90456  17.5807    167.663     16.3906     347.663     
1 1 1 23 11 46 o 13 19.6077 5.34286 6.86357     7.0005   1.71229     8.22108  10.6876    304.148     40.9566     304.148     
1 1 1 23 11 47 o 3  48.4336 3.97266 47.0428     8.85674  38.9013     9.83379  32.4577    200.467     4.36766     200.467     
1 1 1 23 11 48 o 10 81.1834 3.32508 119.423     11.8531  118.216     14.8807  47.5259    344.339     14.9904     164.339     
1 1 1 23 11 49 o 3  62.7163 3.65339 72.8865     10.4808  69.9918     12.1628  47.1187    152.75      12.3015     152.75      
1 1 1 23 11 50 o 4  22.7523 5.53815 14.338      7.99603  -0.628181   9.26552  3.0385     132.26      6.3595      312.26      
1 1 1 23 11 51 f 0  27.1628 6.06703 14.0781     8.28139  13.3572     10.2973  23.1628    45.651      0           0           
1 1 1 23 11 52 f 0  58.4005 3.98531 61.9713     11.3716  63.1341     11.6666  34.591     346.493     0           0           
1 1 1 23 11 53 o 15 68.6297 3.45732 88.1527     12.5899  83.0786     11.0187  43.9751    293.164     3.05655     113.164     
1 1 1 23 11 54 o 3  100.107 2.96814 163.463     15.059   198.73      14.4766  79.8499    167.432     25.3636     167.432     
1 1 1 23 11 55 o 17 58.724  3.66129 53.6206     10.6288  73.2787     10.4261  31.6773    296.821     13.6996     116.821     
1 1 1 23 11 56 o 12 21.0002 5.80368 4.53798     8.55257  6.80732     9.16133  3.05513    190.712     4.34884     10.7121     
1 1 1 23 11 57 o 11 74.7522 3.18999 90.4404     11.5057  113.095     12.2378  69.0237    321.088     40.8371     321.088     
1 1 1 23 11 58 o 5  96.816  2.85752 158.502     13.5026  180.729     14.1546  67.6737    248.637     6.24262     248.637     
1 1 1 23 11 59 o 8  34.5756 5.27348 19.0971     8.68155  27.9501     9.11707  10.0344    176.97      23.3308     356.97      
1 1 1 23 11 60 o 12 16.5591 5.01614 3.61694     7.60085  -4.37565    7.76204  0.423604   93.2112     15.0803     93.2112     
1 1 1 23 11 61 o 1  24.0059 5.88981 12.585      8.78609  8.61095     8.64053  8.75374    244.964     7.86621     64.9641     
1 1 1 23 11 62 o 19 54.1538 4.52044 52.6137     11.7046  59.2562     12.3542  33.3315    29.8968     2.98377     209.897     
1 1 1 23 11 63 o 1  39.1876 5.93141 29.3195     9.66245  33.3084     12.9178  20.0068    84.5655     8.46394     264.565     
1 1 1 23 11 64 o 14 43.4925 5.64694 48.6376     10.0426  28.1561     12.8149  29.3062    253.116     5.29284     253.116     
1 1 1 23 11 65 o 5  69.3952 4.03036 77.6629     13.9935  104.834     13.3704  50.4063    213.715     11.8219     213.715     
1 1 1 23 11 66 o 11 34.6306 6.6916  27.3073     12.2767  24.1269     11.6187  20.872     336.735     3.51941     336.735     
1 1 1 23 11 67 o 12 53.9861 4.84439 61.4567     13.2645  52.5373     12.3503  39.2348    217.135     11.775      217.135     
1 1 1 23 11 68 o 2  63.8955 4.57273 75.5533     15.1783  81.8733     13.5075  45.0237    19.5362     9.38789     19.5362     
1 1 1 23 11 69 o 4  22.9465 6.3529  3.4871      11.1884  12.1028     10.6347  5.70549    57.5554     1.35142     57.5554     
1 1 1 23 11 70 o 16 27.4882 6.7181  20.9216     11.6203  9.43069     11.7135  5.96724    139.63      19.9948     319.63      
1 1 1 23 11 71 o 3  34.0052 6.87033 19.9737     12.4986  31.3297     12.5716  23.0383    347.052     10.1296     347.052     
1 1 1 23 11 72 o 18 20.1361 6.20859 2.52027     11.9901  1.81735     11.5805  4.82907    273.532     2.67737     93.5322     
1 1 1 23 11 73 o 9  22.5325 6.76998 6.88663     12.4699  6.22674     14.2394  5.13072    48.2112     10.9805     228.211     
1 1 1 23 11 74 o 18 23.9433 6.82671 2.07476     12.6792  17.6236     13.5374  6.75164    76.2319     7.01871     256.232     
1 1 1 23 11 75 o 5  16.4096 5.49859 -14.342     11.96    -3.99233    12.3641  0.244651   87.3655     3.25167     87.3655     
1 1 1 23 11 76 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 12 0  o 18 296.427 3.00856 1559.18     44.672   1559.18     44.672   200.333    3.57314e-06 39.3114     180         
1 1 1 23 12 1  f 0  130.284 2.43324 304.698     16.1547  297.916     15.591   53.021     310.645     0           0           
1 1 1 23 12 2  o 8  35.424  4.2704  19.6702     7.33992  26.4139     7.17623  18.8904    326.93      60.1754     326.93      
1 1 1 23 12 3  o 7  168.667 2.56228 512.026     21.6497  497.414     21.6626  87.4251    243.763     67.9786     63.7633     
1 1 1 23 12 4  o 6  195.819 2.51642 681.396     24.7029  679.077     24.6859  134.531    286.427     13.6809     106.427     
1 1 1 23 12 5  o 5  187.837 2.57793 624.95      23.8158  626.949     24.7109  166.205    28.3526     65.2592     28.3526     
1 1 1 23 12 6  o 10 153.316 2.42072 419.371     18.5714  414.544     18.626   75.1809    78.182      69.0293     258.182     
1 1 1 23 12 7  o 17 87.5209 2.55912 140.078     11.0455  132.23      11.337   28.7738    138.555     58.5498     318.555     
1 1 1 23 12 8  o 8  147.007 2.43845 390.919     17.9423  375.879     17.9807  98.5719    189.451     10.2122     9.45077     
1 1 1 23 12 9  o 14 258.333 2.78464 1191.79     36.0345  1176.79     36.0649  220.966    333.271     66.5465     333.271     
1 1 1 23 12 10 o 19 164.622 2.47967 486.488     20.8339  475.088     20.0799  75.702     171.102     85.4119     351.102     
1 1 1 23 12 11 o 17 60.1856 2.93585 61.4883     8.68934  67.7885     8.9048   2.40527    354.545     66.1244     174.545     
1 1 1 23 12 12 f 0  151.24  2.37957 418.672     18.3274  393.056     17.7436  133.744    255.446     0           0           
1 1 1 23 12 13 o 8  80.5122 2.79277 118.224     11.582   112.457     10.8871  39.6033    70.6324     19.4367     70.6324     
1 1 1 23 12 14 o 2  151.284 2.44542 407.819     18.8811  404.286     18.1949  123.986    7.48922     36.3154     7.48922     
1 1 1 23 12 15 f 0  98.7146 2.47941 181.306     12.4303  165.114     12.0564  80.9418    151.211     0           0           
1 1 1 23 12 16 f 0  206.692 2.78716 759.447     29.4439  757.233     28.286   133.076    170.475     0           0           
1 1 1 23 12 17 o 19 73.8602 2.87357 102.867     10.4895  91.587      10.6617  22.3017    23.3758     51.1013     203.376     
1 1 1 23 12 18 o 7  199.086 2.72724 709.788     27.2388  697.421     27.1796  191.526    19.9257     99.5756     19.9257     
1 1 1 23 12 19 o 2  302.373 3.10635 1656        47.0172  1592.48     47.1097  241.549    106.379     42.833      106.379     
1 1 1 23 12 20 o 12 136.995 2.48427 330.69      16.6612  335.926     17.4182  121.073    333.322     52.5021     333.322     
1 1 1 23 12 21 o 5  170.147 2.6013  515.899     21.1741  511.95      23.1358  91.871     182.78      61.0152     2.77975     
1 1 1 23 12 22 o 14 53.6879 3.53424 41.3213     9.21652  63.2562     9.20461  20.1009    260.177     1.62897     80.1768     
1 1 1 23 12 23 o 9  121.166 2.56802 270.207     15.0765  251.724     16.0121  79.6389    188.744     10.4773     8.74409     
1 1 1 23 12 24 o 16 93.7922 2.60876 164.536     12.3904  148.57      12.0756  37.2235    4.99207     55.411      184.992     
1 1 1 23 12 25 o 1  170.137 2.63705 499.583     23.5429  528.849     21.2904  126.923    49.5913     11.1397     49.5913     
1 1 1 23 12 26 o 10 49.324  3.70545 44.2269     8.81695  43.3793     9.21077  0.368246   63.3699     59.675      243.37      
1 1 1 23 12 27 f 0  61.6525 3.52538 70.8707     10.3084  65.3934     11.2134  35.9219    99.4552     0           0           
1 1 1 23 12 28 o 15 93.8935 2.74889 153.451     12.4147  160.478     13.3969  66.1889    175.364     6.08568     175.364     
1 1 1 23 12 29 o 19 83.5613 2.95855 126.071     11.6442  122.911     12.997   65.6519    154.076     25.203      154.076     
1 1 1 23 12 30 o 18 103.605 2.7078  198.353     13.4396  183.932     14.5491  60.5821    271.61      22.1141     91.6096     
1 1 1 23 12 31 o 1  118.893 2.59873 256.621     14.5746  246.445     16.2683  97.6021    302.786     31.4386     302.786     
1 1 1 23 12 32 o 5  143.441 2.64676 377.844     18.3609  354.351     19.5949  117.941    311.63      35.0393     311.63      
1 1 1 23 12 33 o 1  29.7863 5.41837 20.9092     8.52485  12.3639     7.98006  15.257     27.1278     60.2667     27.1278     
1 1 1 23 12 34 o 13 90.1935 2.9315  158.579     12.9971  132.344     13.316   83.1677    261.844     53.0374     261.844     
1 1 1 23 12 35 o 10 37.0885 5.09013 23.757      9.71088  27.4083     8.46276  4.52635    109.651     26.0706     289.651     
1 1 1 23 12 36 o 4  101.532 2.91417 180.032     15.1352  188.025     14.4287  96.6085    178.603     60.6832     178.603     
1 1 1 23 12 37 o 18 68.9155 3.20991 84.7344     11.3994  85.549      10.6299  48.6439    303.382     11.4157     303.382     
1 1 1 23 12 38 o 8  112.137 2.58896 227.418     14.2662  220.993     14.7784  99.0077    92.0611     46.3763     92.0611     
1 1 1 23 12 39 o 4  192.433 2.63041 664.905     26.0534  654.768     24.6703  165.62     24.9731     61.3591     24.9731     
1 1 1 23 12 40 f 0  51.6788 3.53577 58.2008     8.74505  39.2514     8.96875  56.9973    246.67      0           0           
1 1 1 23 12 41 o 5  49.1245 3.6896  43.5334     9.04296  43.9827     8.84292  29.675     348.523     2.97905     348.523     
1 1 1 23 12 42 o 7  111.139 2.63412 225.509     14.3362  215.702     14.9387  75.9967    94.0563     1.84319     274.056     
1 1 1 23 12 43 o 5  19.6121 5.28809 2.20537     7.36258  7.24819     7.33106  10.1675    172.102     39.4        172.102     
1 1 1 23 12 44 o 10 26.0804 5.47095 9.42685     7.90768  15.6468     7.71594  2.68284    25.8119     35.1295     25.8119     
1 1 1 23 12 45 o 13 62.4956 3.30653 69.6711     9.87731  71.3283     10.6756  43.5276    345.258     4.0914      345.258     
1 1 1 23 12 46 o 3  106.553 2.71456 205.4       14.4406  201.321     14.5007  48.348     249.195     50.7076     69.195      
1 1 1 23 12 47 o 16 28.3112 5.74425 17.8984     8.22655  12.2491     9.21493  4.94985    124.203     44.5121     124.203     
1 1 1 23 12 48 o 16 55.6307 4.07803 63.5689     11.0725  50.317      11.1729  35.1477    117.172     2.65828     297.172     
1 1 1 23 12 49 o 4  114.059 2.90773 231.907     17.4594  235.923     15.6574  76.3585    0.084848    3.7584      180.085     
1 1 1 23 12 50 o 12 86.6718 2.90566 135.841     12.3569  134.696     12.806   59.615     6.86763     1.77373     6.86763     
1 1 1 23 12 51 o 17 53.5711 3.91718 49.7493     10.8994  55.7622     9.6587   26.5336    186.986     17.533      6.98596     
1 1 1 23 12 52 o 1  31.2396 5.44802 17.1692     8.76678  20.6072     8.23591  16.0452    157.406     4.04248     157.406     
1 1 1 23 12 53 o 18 22.7929 5.78709 9.35859     8.52268  7.90718     8.31046  4.58906    105.37      10.4928     285.37      
1 1 1 23 12 54 o 12 41.0318 4.70144 33.4405     9.6818   30.2239     8.99663  29.4214    354.761     10.1029     354.761     
1 1 1 23 12 55 o 4  88.8186 3.03439 123.426     13.2082  163.459     13.5613  68.8176    166.426     18.7004     166.426     
1 1 1 23 12 56 o 2  83.2217 3.12958 123.076     12.4252  128.386     13.5783  53.7328    34.4992     3.97656     214.499     
1 1 1 23 12 57 o 10 33.0559 5.65375 27.22       8.69159  15.8076     10.2952  19.6726    164.152     12.746      164.152     
1 1 1 23 12 58 o 3  22.2675 5.62164 13.9025     8.14966  -1.41338    9.82615  1.08486    297.49      28.2464     297.49      
1 1 1 23 12 59 f 0  19.2409 5.61157 4.20274     8.0057   2.21027     9.59769  7.59556    300.712     0           0           
1 1 1 23 12 60 o 6  60.1638 3.88474 65.6356     10.6273  69.5806     12.4975  40.2474    141.867     1.95249     141.867     
1 1 1 23 12 61 o 11 42.1296 5.44172 41.5655     9.5587   29.2135     12.0373  24.5222    201.715     3.93666     21.7153     
1 1 1 23 12 62 o 2  36.2708 5.78678 19.7128     10.5302  34.4596     10.2905  27.0985    187.62      15.0263     187.62      
1 1 1 23 12 63 o 13 43.4201 5.01654 34.8094     10.3375  39.4625     10.7324  22.7706    312.63      9.08414     132.63      
1 1 1 23 12 64 o 3  32.258  6.18592 23.653      9.67104  19.8265     10.9918  16.8611    103.163     3.14591     283.163     
1 1 1 23 12 65 o 15 25.0884 6.514   14.0454     11.644   9.97207     9.83169  9.02051    110.085     0.138811    290.085     
1 1 1 23 12 66 o 9  52.0964 4.99696 48.0695     12.6513  58.9361     12.6173  31.5981    128.496     2.26595     308.496     
1 1 1 23 12 67 o 18 35.9639 6.4958  26.9767     12.1693  28.1281     11.3483  24.0505    120.947     7.43508     120.947     
1 1 1 23 12 68 o 9  38.6296 6.7562  32.6627     12.6494  31.6878     13.3747  23.7475    203.766     1.19442     203.766     
1 1 1 23 12 69 o 8  23.2611 6.47825 13.6574     11.2706  2.14021     11.8534  9.08563    346.396     1.03618     346.396     
1 1 1 23 12 70 o 2  28.4322 6.20329 0.0868454   12.0305  29.8881     11.529   9.6301     344.748     13.616      164.748     
1 1 1 23 12 71 o 15 25.8946 6.80861 10.6248     12.3158  16.6199     11.6088  11.1431    233.024     3.51164     53.024      
1 1 1 23 12 72 o 18 28.9746 6.91542 5.52335     13.5614  30.2434     13.2404  12.7879    345.748     4.84696     165.748     
1 1 1 23 12 73 o 11 31.0557 7.27151 29.68       13.3878  16.7292     13.976   15.834     227.251     2.58975     227.251     
1 1 1 23 12 74 o 13 17.9788 5.83222 2.75258     11.8691  -11.9234    12.8511  0.226961   271.815     2.81863     91.8145     
1 1 1 23 12 75 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 13 0  f 0  433.572 3.93658 3338.2      85.5027  3338.2      85.5027  273.992    180         0           0           
1 1 1 23 13 1  o 9  66.1793 2.90689 76.5999     9.64792  79.5061     9.53307  28.6261    201.267     7.84647     21.2668     
1 1 1 23 13 2  o 2  160.905 2.44812 465.144     20.0279  453.597     19.4542  88.534     59.9802     55.1075     239.98      
1 1 1 23 13 3  o 1  244.921 2.99722 1071.8      36.0118  1058.26     37.5371  194.349    102.035     30.7542     102.035     
1 1 1 23 13 4  o 16 223.79  2.70763 888.172     30.8977  889.521     29.8244  134.918    187.379     57.6012     7.37883     
1 1 1 23 13 5  o 6  46.2115 3.57052 38.1206     8.18554  38.674      8.0815   1.44858    4.55505     31.5565     184.555     
1 1 1 23 13 6  f 0  313.597 3.1224  1742.58     49.0491  1750.27     49.0918  265.927    282.106     0           0           
1 1 1 23 13 7  o 17 168.196 2.46388 503.118     20.7674  500.802     20.7685  45.5924    7.17948     153.77      187.179     
1 1 1 23 13 8  o 8  121.782 2.43107 264.353     14.8247  262.362     14.819   88.5567    37.7687     8.31588     37.7687     
1 1 1 23 13 9  o 8  202.719 2.61346 743.44      26.5513  715.385     26.5422  178.555    141.504     64.4338     141.504     
1 1 1 23 13 10 o 13 99.7264 2.5943  179.882     12.9327  173.64      12.9508  68.757     31.5209     51.5342     31.5209     
1 1 1 23 13 11 o 9  155.272 2.58338 435.818     19.6526  420.06      20.521   99.39      82.1549     24.2376     262.155     
1 1 1 23 13 12 o 5  119.934 2.64077 268.353     15.4048  243.099     16.2193  92.4065    114.67      18.9746     114.67      
1 1 1 23 13 13 o 10 71.7529 3.16251 92.455      10.8056  91.1829     11.7941  39.5317    279.67      7.85048     99.6704     
1 1 1 23 13 14 o 16 101.982 2.57565 191.333     12.7513  178.463     13.4845  80.3928    35.6009     24.6928     35.6009     
1 1 1 23 13 15 o 12 251.679 2.86256 1134.27     35.3491  1115.55     36.8304  187.432    50.1685     7.14183     50.1685     
1 1 1 23 13 16 o 2  208.06  2.62324 774.254     26.7666  762.812     27.9152  170.508    44.536      39.2987     44.536      
1 1 1 23 13 17 o 14 38.1068 4.39999 21.4688     7.76201  32.1249     8.35729  0.750287   131.516     4.0887      311.516     
1 1 1 23 13 18 o 3  78.9962 2.97474 115.942     11.7456  106.522     11.7074  19.2535    77.1561     70.1966     257.156     
1 1 1 23 13 19 o 8  137.841 2.57847 331.431     17.6704  343.831     17.9207  106.424    337.788     17.4072     337.788     
1 1 1 23 13 20 o 7  51.2979 3.65565 39.7291     9.16392  55.5527     9.13026  19.4928    306.227     8.25803     126.227     
1 1 1 23 13 21 o 15 41.2278 4.48018 28.993      8.32678  33.1122     9.60447  4.83814    23.3768     7.72531     203.377     
1 1 1 23 13 22 o 10 96.0825 2.85214 165.727     13.9905  162.981     13.413   58.0181    359.026     16.3832     179.026     
1 1 1 23 13 23 o 7  159.399 2.63828 457.893     21.0183  444.949     21.1266  112.729    241.875     2.83516     61.8746     
1 1 1 23 13 24 o 13 135.875 2.67165 323.682     17.4059  332.965     18.9293  94.9479    173.836     2.8377      353.836     
1 1 1 23 13 25 o 7  80.3359 3.04915 118.76      11.2038  111.549     13.1072  20.2165    251.702     70.4588     71.702      
1 1 1 23 13 26 o 14 47.338  4.03646 48.2687     8.94776  33.531      9.40904  15.7179    215.748     17.1374     35.7479     
1 1 1 23 13 27 o 9  88.4888 2.72296 146.746     11.6606  132.402     12.3592  43.6004    122.258     34.6982     302.258     
1 1 1 23 13 28 o 1  42.1336 4.20119 34.7283     8.32262  30.0306     8.83178  10.6238    210.233     17.4394     30.2327     
1 1 1 23 13 29 o 15 25.4519 5.74239 7.74806     8.29243  14.8336     8.57201  13.8813    347.591     46.5443     347.591     
1 1 1 23 13 30 o 2  94.3759 2.92862 155.177     13.8934  162.613     13.731   77.6866    64.1355     28.6358     64.1355     
1 1 1 23 13 31 o 13 115.721 2.87412 241.357     17.2098  236.125     16.0651  90.5912    130.009     20.2611     130.009     
1 1 1 23 13 32 o 19 50.0676 4.20597 43.1365     9.80863  47.9763     10.8932  4.53678    347.069     55.1947     167.069     
1 1 1 23 13 33 o 13 31.2621 5.74528 21.8431     8.61318  14.5733     9.85243  0.286642   261.767     18.4567     81.7672     
1 1 1 23 13 34 o 14 139.673 2.80034 348.655     18.5633  347.154     20.5434  105.228    126.824     14.1538     126.824     
1 1 1 23 13 35 o 9  88.769  3.06752 140.218     12.3915  141.705     14.7241  75.1631    133.657     33.5407     133.657     
1 1 1 23 13 36 o 12 161.762 2.84207 458.533     21.933   475.203     24.1061  135.149    94.0336     42.8721     94.0336     
1 1 1 23 13 37 o 7  109.497 2.76326 229.24      15.3212  199.433     14.9249  74.8567    139.241     1.93549     319.241     
1 1 1 23 13 38 o 13 48.2596 4.10761 40.1189     9.70902  44.8791     9.73121  23.8085    167.687     10.169      347.687     
1 1 1 23 13 39 o 10 82.835  2.95997 129.954     12.1487  116.034     12.3054  64.8136    143.483     17.7835     143.483     
1 1 1 23 13 40 o 11 47.0211 4.18802 45.1004     9.6047   36.0771     9.57954  15.1719    342.108     31.1618     162.108     
1 1 1 23 13 41 o 2  103.552 2.81999 192.978     14.3635  190.821     14.8426  64.593     236.54      15.3719     56.5396     
1 1 1 23 13 42 o 9  71.9972 3.16455 90.8661     11.0956  95.6876     11.6292  57.0433    274.255     16.8912     274.255     
1 1 1 23 13 43 o 3  98.3956 2.82266 189.627     14.1059  158.141     13.6248  76.9367    203.938     17.9468     203.938     
1 1 1 23 13 44 o 11 28.0713 5.48222 20.2244     8.50698  9.71526     7.92033  7.48594    132.906     14.8182     312.906     
1 1 1 23 13 45 o 17 49.8087 3.82264 49.1589     9.81955  41.7284     8.96013  24.2263    51.5403     17.3274     231.54      
1 1 1 23 13 46 o 1  92.2532 2.70785 152.61      12.6598  152.872     12.3208  69.1162    14.0384     11.7009     14.0384     
1 1 1 23 13 47 o 1  45.811  4.18504 31.3227     9.35245  47.0617     8.92236  24.6588    78.4901     9.94657     258.49      
1 1 1 23 13 48 o 19 62.5147 3.36562 67.5832     10.4749  74.4079     10.4313  42.9464    315.931     2.48619     315.931     
1 1 1 23 13 49 o 9  53.9003 3.58817 47.4968     9.19733  58.9704     9.9341   42.3625    184.096     15.3458     184.096     
1 1 1 23 13 50 o 13 53.8242 3.89878 56.8513     9.92449  49.7813     10.6846  36.0458    146.572     1.65307     146.572     
1 1 1 23 13 51 o 8  33.8973 5.48629 28.8217     8.56621  15.7782     10.0119  13.3759    353.879     14.6448     173.879     
1 1 1 23 13 52 o 6  77.0085 3.24377 105.949     11.4947  109.317     13.3774  49.2526    152.84      5.35793     332.84      
1 1 1 23 13 53 o 1  97.1023 3.12712 181.92      13.6019  159.97      16.3695  66.0744    8.80215     0.373154    8.80232     
1 1 1 23 13 54 o 11 23.833  6.11124 8.33789     8.07845  11.0798     10.7239  8.07351    228.687     1.11816     48.6865     
1 1 1 23 13 55 o 13 70.3534 3.70864 102.639     12.056   80.0727     13.4775  55.7679    332.082     17.9661     332.082     
1 1 1 23 13 56 o 13 68.2982 3.56657 86.2026     10.9888  85.3903     13.1255  46.6677    235.797     2.3524      235.797     
1 1 1 23 13 57 o 18 53.0714 4.46427 62.1366     10.3514  45.0078     12.1274  19.3474    131.176     31.579      311.176     
1 1 1 23 13 58 o 4  26.4721 5.95767 13.5891     8.54937  14.1155     9.24378  14.0913    165.624     1.20997     165.624     
1 1 1 23 13 59 o 12 31.4108 5.71638 16.3468     8.90787  23.844      9.35174  11.71      162.701     15.2608     342.701     
1 1 1 23 13 60 f 0  44.6566 4.58167 34.1522     9.8377   43.0687     9.95842  36.8251    348.678     0           0           
1 1 1 23 13 61 o 6  41.8618 5.17159 24.3884     10.3883  46.4269     9.94364  31.8727    5.37215     12.9339     5.37215     
1 1 1 23 13 62 o 3  20.3571 5.80963 2.22448     9.50403  7.62996     9.05764  3.56084    147.141     12.14       327.141     
1 1 1 23 13 63 o 14 30.3407 6.29624 20.1541     9.81548  18.5821     10.631   15.9345    87.0033     1.17474     267.003     
1 1 1 23 13 64 o 6  25.9613 6.14057 4.67738     11.1408  19.7789     9.5703   9.41933    324.139     8.08009     144.139     
1 1 1 23 13 65 o 2  42.5313 5.78318 41.0859     13.0395  33.279      10.7441  25.6796    208.707     0.969388    28.7069     
1 1 1 23 13 66 o 4  24.7472 6.75303 18.3964     13.3933  1.85958     11.3253  11.0605    335.754     0.765167    155.754     
1 1 1 23 13 67 o 15 24.3265 6.59392 15.1649     11.5038  4.62936     11.7603  9.19981    127.729     7.46713     307.729     
1 1 1 23 13 68 o 3  29.7528 7.03123 20.581      12.3737  18.2491     12.2825  17.1829    104.698     2.49513     104.698     
1 1 1 23 13 69 o 3  29.9922 6.61697 31.4838     12.5388  6.48344     12.2552  12.1221    48.9694     10.6756     228.969     
1 1 1 23 13 70 o 11 18.9278 5.86393 -10.3608    11.3515  7.85878     11.2824  0.502681   216.288     17.2205     36.2877     
1 1 1 23 13 71 o 16 16.8792 5.5665  -1.15613    12.0039  -11.5305    11.2622  0.161737   73.4217     9.94544     253.422     
1 1 1 23 13 72 o 13 25.9042 7.13316 16.5693     13.2304  13.0172     13.5198  9.00799    152.044     3.88416     332.044     
1 1 1 23 13 73 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 14 0  o 6  110.059 2.4527  215.437     13.4974  215.437     13.4974  98.7352    180         33.8751     180         
1 1 1 23 14 1  o 13 124.493 2.39858 276.811     14.9072  273.694     14.9928  51.2965    170.495     76.7279     350.496     
1 1 1 23 14 2  o 1  31.7284 4.86096 24.9666     7.62172  12.8005     7.55033  20.3146    15.409      68.5027     15.409      
1 1 1 23 14 3  o 12 302.199 3.07877 1633.48     46.6386  1611.41     46.6127  260.534    298.395     75.2281     298.395     
1 1 1 23 14 4  o 19 216.548 2.702   825.038     28.7798  840.157     29.8632  144.905    354.73      28.1932     174.73      
1 1 1 23 14 5  o 7  118.359 2.5257  247.187     14.8737  250.594     15.0543  77.569     145.298     12.6112     325.298     
1 1 1 23 14 6  o 15 331.107 3.40031 1981.1      56.3984  1917.1      56.4335  239.863    102.438     9.97175     282.438     
1 1 1 23 14 7  o 1  231.959 2.78178 978.387     31.665   932.845     32.9508  147.853    233.598     45.578      53.5976     
1 1 1 23 14 8  o 2  150.786 2.57296 404.511     18.5811  403.019     20.2474  101.126    346.699     15.8961     166.699     
1 1 1 23 14 9  o 14 70.7985 2.98664 103.627     10.1952  76.16       10.6279  46.6901    212.155     8.28821     212.155     
1 1 1 23 14 10 o 10 184.494 2.67341 617.611     24.6493  591.351     24.7743  154.451    298.361     40.858      298.361     
1 1 1 23 14 11 o 9  209.758 2.73295 788.205     27.5066  774.613     29.8784  115.865    155.236     76.1426     335.236     
1 1 1 23 14 12 o 9  92.9314 2.7359  158.815     12.0823  148.568     13.265   39.3445    239.555     51.7468     59.5553     
1 1 1 23 14 13 o 10 48.1494 3.81718 38.2063     8.93513  45.527      9.12136  5.2939     261.809     46.184      81.8091     
1 1 1 23 14 14 o 14 37.3081 4.6315  22.3491     7.86973  28.9759     8.82306  16.8243    58.7624     76.0899     58.7624     
1 1 1 23 14 15 o 10 182.774 2.55572 593.405     22.8687  593.13      23.9374  157.854    222.127     51.1717     222.127     
1 1 1 23 14 16 o 8  72.9295 2.85701 93.7462     10.0313  95.8736     10.7647  21.922     181.227     55.6216     1.22682     
1 1 1 23 14 17 o 13 120.263 2.5075  263.183     14.6915  251.075     15.4653  61.4402    220.452     49.1859     40.4521     
1 1 1 23 14 18 o 3  240.674 3.10654 1043.77     35.9014  1016.7      38.9285  170.453    240.732     10.9965     60.7321     
1 1 1 23 14 19 o 6  97.7424 2.80166 173.74      13.3423  166.47      14.019   47.7607    237.979     41.8493     57.9787     
1 1 1 23 14 20 o 16 87.5721 2.82365 138.462     11.7037  134.777     12.9621  76.1912    49.924      41.9463     49.9241     
1 1 1 23 14 21 f 0  83.2167 2.72315 116.052     10.9663  130.885     11.6859  67.2636    307.083     0           0           
1 1 1 23 14 22 o 10 21.6267 5.53591 3.60111     7.43685  9.98657     8.27929  29.3487    49.3498     76.1442     49.3498     
1 1 1 23 14 23 o 13 104.367 2.88675 203.042     15.4447  185.277     14.6953  77.5584    22.804      10.0972     22.804      
1 1 1 23 14 24 o 18 89.5359 2.90191 141.999     12.1165  143.877     13.8093  75.3043    250.554     32.0595     250.554     
1 1 1 23 14 25 o 16 93.2393 3.13269 150.91      14.8071  159.5       14.3595  43.0761    86.4256     44.4587     266.426     
1 1 1 23 14 26 o 11 83.9739 3.192   133.968     13.0155  118.29      13.6597  68.249     184.85      25.8901     184.85      
1 1 1 23 14 27 o 17 113.627 2.96789 238.06      17.0633  222.579     16.675   83.9024    16.6651     8.24359     16.665      
1 1 1 23 14 28 o 2  141.975 3.05244 382.255     19.968   337.495     23.0434  128.781    57.535      57.0392     57.535      
1 1 1 23 14 29 o 2  63.6217 3.65971 71.9825     10.8063  73.6555     12.2923  39.8363    41.8392     1.02095     221.839     
1 1 1 23 14 30 o 1  125.251 2.82777 291.941     17.423   267.914     17.9765  110.967    280.034     46.9854     280.034     
1 1 1 23 14 31 o 8  64.0427 3.38214 78.0902     10.0915  69.407      11.3113  41.5259    245.878     2.17503     245.878     
1 1 1 23 14 32 o 8  59.8173 3.43005 66.8535     9.89562  61.9725     10.4477  40.7011    191.725     11.875      191.725     
1 1 1 23 14 33 o 2  53.6332 3.70579 54.1323     9.7205   49.9412     9.92064  22.3861    198.303     22.4259     18.3032     
1 1 1 23 14 34 o 12 69.465  3.37064 93.8188     10.9618  79.901      12.1617  50.0948    192.515     10.6387     192.515     
1 1 1 23 14 35 o 10 81.4151 2.89559 124.085     11.7635  113.284     11.7692  75.5891    5.10359     46.8866     5.10359     
1 1 1 23 14 36 o 18 54.779  3.97338 62.14       9.76018  47.3543     11.2494  29.7231    103.015     11.4309     283.015     
1 1 1 23 14 37 o 2  123.872 2.85639 283.393     17.0704  265.526     18.2694  74.9461    335.498     25.2013     155.498     
1 1 1 23 14 38 o 7  123.626 2.8266  277.209     16.6938  269.569     18.2241  91.9995    259.686     9.57411     259.686     
1 1 1 23 14 39 o 7  24.4926 5.96778 6.59818     8.57493  13.6053     9.46041  6.13479    295.045     40.5408     295.045     
1 1 1 23 14 40 f 0  90.9091 3.2164  150.085     14.4988  147.196     14.7107  35.4647    234.677     0           0           
1 1 1 23 14 41 o 11 102.095 3.10713 196.972     15.9583  177.951     15.7404  73.3666    315.853     4.18035     315.853     
1 1 1 23 14 42 o 19 43.8165 4.90705 37.1886     10.7335  34.6738     10.1024  30.3415    153.886     6.85398     153.886     
1 1 1 23 14 43 o 16 18.2241 5.42922 -1.01187    8.9543   2.91925     8.12369  4.18452    209.254     22.8204     209.254     
1 1 1 23 14 44 o 16 26.4931 5.90065 20.6642     9.57269  2.78858     9.93713  5.54594    3.92623     43.5327     3.92623     
1 1 1 23 14 45 o 5  69.5774 3.24828 89.3225     10.768   85.9674     11.7113  45.5487    111.122     3.67847     291.122     
1 1 1 23 14 46 o 19 67.2536 3.37579 81.8099     10.7478  82.4018     11.8335  41.022     243.454     9.41238     63.4539     
1 1 1 23 14 47 o 3  99.7784 2.8374  180.892     13.4689  177.589     14.801   84.5369    279.044     32.0182     279.044     
1 1 1 23 14 48 o 7  40.4406 4.94346 33.5031     8.76046  28.6118     10.3549  21.9823    18.3671     7.29193     198.367     
1 1 1 23 14 49 o 7  59.5474 3.72362 68.4071     10.0836  61.5832     11.7062  42.1334    166.54      5.02249     166.54      
1 1 1 23 14 50 o 10 98.0968 2.90518 163.334     13.76    184.365     14.7441  70.5497    358.909     6.77959     358.909     
1 1 1 23 14 51 o 10 19.3803 5.40466 6.98766     7.89586  1.33307     7.86317  0.776586   173.492     16.0802     353.492     
1 1 1 23 14 52 o 4  27.4214 5.67653 12.8112     8.29081  16.4222     8.37951  13.8097    99.5747     0.192633    99.5748     
1 1 1 23 14 53 o 19 91.0167 2.91224 142.24      12.9637  158.126     13.5299  73.7689    162.788     24.0866     162.788     
1 1 1 23 14 54 o 18 33.7259 5.36032 27.6271     8.87583  17.4515     8.94379  24.457     38.9708     11.5759     38.9708     
1 1 1 23 14 55 o 12 76.902  3.23006 100.698     12.3972  116.004     12.3293  70.8933    129.818     39.316      129.818     
1 1 1 23 14 56 o 2  67.5568 3.43384 82.9463     11.4055  85.3649     11.6907  48.7758    256.527     7.41562     256.527     
1 1 1 23 14 57 o 4  71.4233 3.50311 99.809      11.6875  89.0632     13.0598  42.8895    321.812     9.80577     141.812     
1 1 1 23 14 58 o 9  23.1979 5.91819 6.28479     8.90937  12.804      9.04099  9.57104    295.353     0.50403     115.353     
1 1 1 23 14 59 o 9  29.6202 5.8219  22.8942     9.09437  13.0681     9.31787  15.2216    346.344     3.99418     166.344     
1 1 1 23 14 60 o 5  24.3365 5.91376 14.4516     8.69329  8.01024     9.15085  9.45705    173.893     6.19271     353.893     
1 1 1 23 14 61 o 1  26.0756 6.03211 14.0454     9.09303  13.5276     9.06533  10.1753    316.75      7.77455     136.75      
1 1 1 23 14 62 o 10 46.0518 4.83967 43.8072     11.253   39.6194     10.4128  31.124     255.822     4.82183     255.822     
1 1 1 23 14 63 o 15 21.0508 5.92863 14.5287     11.3451  -5.19015    8.98598  2.13808    211.71      17.4872     31.7102     
1 1 1 23 14 64 o 9  32.4954 6.48957 26.6275     12.0011  18.8715     10.1359  18.1603    25.6369     1.42908     205.637     
1 1 1 23 14 65 o 18 40.5685 6.38432 34.9066     13.7822  34.8174     11.5096  20.1864    11.3964     10.4289     191.396     
1 1 1 23 14 66 o 4  31.4148 7.06381 25.7252     14.6523  18.4376     10.3889  15.0462    177.123     6.91701     357.123     
1 1 1 23 14 67 o 11 23.9699 6.74737 12.8873     12.2855  6.43942     12.2793  8.92161    355.961     7.28274     175.961     
1 1 1 23 14 68 f 0  22.0197 6.34419 -0.735237   11.871   12.7009     11.3183  7.0833     287.124     0           0           
1 1 1 23 14 69 o 16 24.948  6.85616 13.6041     12.4895  11.7572     12.1015  8.20951    152.357     9.16448     332.357     
1 1 1 23 14 70 f 0  31.4902 7.01477 14.7902     13.5497  32.136      12.8339  14.7281    344.053     0           0           
1 1 1 23 14 71 o 13 18.406  5.99171 -16.2311    14.9425  3.43212     12.1801  0.819603   270.92      7.26417     90.9201     
1 1 1 23 14 72 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 15 0  o 5  266.591 3.06972 1262.33     40.987   1262.33     40.987   213.088    2.43449e-06 28.4339     2.43449e-06 
1 1 1 23 15 1  o 8  79.1715 2.85404 111.413     10.7165  111.92      11.8299  40.9327    354.011     26.3338     174.011     
1 1 1 23 15 2  o 10 87.3542 2.7158  125.713     11.4922  146.311     12.2199  18.0345    86.2169     88.1147     266.217     
1 1 1 23 15 3  o 1  21.8285 5.56075 6.03615     7.7202   8.2214      7.86571  19.3973    257.474     50.7431     257.474     
1 1 1 23 15 4  o 13 152.139 2.70877 408.469     18.9131  414.228     22.255   104.433    200.728     12.558      20.7283     
1 1 1 23 15 5  o 8  152.494 2.5657  411.986     19.3178  414.039     19.894   80.0393    270.591     62.8407     90.5911     
1 1 1 23 15 6  o 7  160.369 2.63865 448.446     20.9097  465.329     21.5042  161.59     185.351     93.5216     185.351     
1 1 1 23 15 7  o 11 247.776 2.97833 1108.7      34.784   1074.18     38.9855  150.228    34.8232     65.8263     214.823     
1 1 1 23 15 8  o 9  175.233 2.56924 546.278     21.8046  544.582     23.2926  124.061    223.715     8.15606     43.7148     
1 1 1 23 15 9  o 18 288.511 3.18535 1479.74     44.3428  1481.5      47.7075  251.901    342.846     77.8538     342.846     
1 1 1 23 15 10 o 3  137.799 2.7411  338.24      18.5919  337.165     19.2225  98.9305    110.593     1.00932     290.593     
1 1 1 23 15 11 o 7  152.841 2.64361 434.699     19.1013  396.157     21.189   157.189    287.706     97.3561     287.706     
1 1 1 23 15 12 o 11 71.9371 2.94748 94.0814     10.2294  90.578      10.9034  2.58098    270.663     106.168     270.663     
1 1 1 23 15 13 o 4  178.816 2.59511 563.981     22.4406  572.303     24.0527  153.346    148.025     46.684      148.025     
1 1 1 23 15 14 f 0  136.507 2.56433 331.718     17.209   330.932     17.8381  37.8935    228.779     0           0           
1 1 1 23 15 15 o 4  69.0301 3.13099 84.8997     10.2954  85.3781     11.2336  36.0336    309.621     19.3367     129.621     
1 1 1 23 15 16 o 5  138.52  2.58241 343.898     17.2851  338.594     18.5051  147.899    140.582     103.57      140.582     
1 1 1 23 15 17 o 1  106.617 2.72013 206.39      14.0158  198.384     14.9643  93.4519    66.1823     39.5923     66.1823     
1 1 1 23 15 18 o 11 231.716 2.81891 966.421     32.6923  943.696     32.7712  143.626    44.64       52.6513     224.64      
1 1 1 23 15 19 f 0  21.1158 5.48234 3.33397     7.44403  9.11877     8.02719  32.336     78.8126     0           0           
1 1 1 23 15 20 o 5  247.027 3.06062 1092.08     38.6193  1081.04     37.1512  193.204    73.8161     24.9334     73.8161     
1 1 1 23 15 21 o 9  77.3295 3.17554 106.165     11.7845  107.626     12.7094  60.0499    179.097     19.0131     179.097     
1 1 1 23 15 22 f 0  126.148 2.81919 282.217     17.2298  284.837     18.3567  82.0709    36.4084     0           0           
1 1 1 23 15 23 o 10 52.34   4.62734 63.8229     10.9647  37.6822     11.756   25.3704    337.615     11.8819     157.615     
1 1 1 23 15 24 o 18 111.975 3.17535 227.622     18.057   220.264     17.509   106.602    278.514     58.4572     278.514     
1 1 1 23 15 25 o 7  127.681 3.00286 294.727     17.8163  287.098     20.4282  83.1835    285.236     16.3277     105.236     
1 1 1 23 15 26 o 18 94.507  2.81864 159.642     12.9047  159.183     13.7199  47.5223    75.2992     38.0978     255.299     
1 1 1 23 15 27 o 10 105.417 2.82788 198.958     15.2411  197.729     14.5777  75.2885    265.114     2.55056     265.114     
1 1 1 23 15 28 o 16 99.3145 2.793   169.694     13.8256  182.61      13.9094  56.9834    304.895     25.7282     124.895     
1 1 1 23 15 29 o 14 91.2662 2.91107 154.831     13.6769  143.079     12.8873  60.801     47.6287     4.77415     227.629     
1 1 1 23 15 30 o 2  39.4277 5.16217 31.0204     9.867    27.0492     9.77091  3.98058    316.283     37.4411     136.283     
1 1 1 23 15 31 o 6  127.741 2.79533 290.856     17.283   291.911     18.4458  84.2112    243.613     13.1973     63.6127     
1 1 1 23 15 32 o 8  77.353  3.33252 116.602     11.844   98.7289     13.5782  40.3501    17.8638     26.2113     197.864     
1 1 1 23 15 33 o 4  134.608 2.96101 334.271     17.5192  314.01      21.9622  74.787     316.75      42.7449     136.75      
1 1 1 23 15 34 o 15 97.1867 3.03468 178.475     13.2209  160.243     15.9446  81.9616    7.1467      28.3213     7.1467      
1 1 1 23 15 35 o 19 69.7525 3.51124 77.6529     11.3331  98.5164     13.0682  63.8851    211.843     34.7381     211.843     
1 1 1 23 15 36 o 7  21.0055 5.73228 0.516755    8.18189  9.67451     9.41852  0.481244   234.477     16.3634     234.477     
1 1 1 23 15 37 o 3  80.0301 3.15661 111.179     12.4328  119.298     12.7849  37.3248    175.755     37.8288     355.755     
1 1 1 23 15 38 o 7  68.7882 3.35181 80.5608     11.1998  90.4752     11.7641  50.6812    47.1283     6.97392     47.1282     
1 1 1 23 15 39 o 2  27.2215 5.82655 15.7076     8.51834  11.9931     8.85548  3.58148    221.698     23.9967     41.6979     
1 1 1 23 15 40 o 11 91.0765 3.0246  147.752     12.4921  150.761     14.9467  80.8897    49.4952     35.5561     49.4952     
1 1 1 23 15 41 f 0  46.7164 4.47509 31.6831     9.43222  50.4277     10.7962  28.3233    152.275     0           0           
1 1 1 23 15 42 o 12 45.4198 4.89229 50.7631     9.1679   28.1079     11.0764  36.9254    287.427     22.0438     287.427     
1 1 1 23 15 43 o 7  54.5074 4.0825  50.3577     10.3935  59.2144     11.5807  25.9742    238.101     21.996      58.1007     
1 1 1 23 15 44 o 9  82.0313 3.06017 117.848     12.2137  125.287     12.8602  55.1037    115.25      3.26303     295.25      
1 1 1 23 15 45 o 16 18.2657 5.19439 -3.98855    8.16944  7.15486     7.50566  0.0426613  35.284      10.4236     215.284     
1 1 1 23 15 46 o 19 50.6391 3.9757  47.261      10.1129  47.3818     9.71998  42.7718    42.2442     21.1688     42.2442     
1 1 1 23 15 47 o 5  23.9341 5.80315 11.7509     8.88271  8.70538     7.92634  6.27922    83.1946     10.774      263.195     
1 1 1 23 15 48 o 7  25.6634 5.70296 12.3215     8.11157  12.6346     8.2362   8.21331    309.119     11.0711     129.119     
1 1 1 23 15 49 o 16 23.7971 5.74747 10.2501     8.16365  10.1478     8.29584  3.07295    314.014     21.0147     134.014     
1 1 1 23 15 50 o 1  39.0128 4.88177 31.3054     9.30326  27.0324     9.07528  23.7794    138.463     2.11713     318.463     
1 1 1 23 15 51 o 17 82.6883 2.99239 115.614     12.3866  132.909     12.2729  61.1953    318.377     9.4789      318.377     
1 1 1 23 15 52 o 15 70.3286 3.34346 96.1348     11.9854  85.2302     11.4391  51.5904    279.461     7.97117     279.461     
1 1 1 23 15 53 o 6  57.2846 4.01711 54.2479     11.1208  68.8226     11.5405  41.4165    242.995     6.44063     242.995     
1 1 1 23 15 54 o 13 36.3975 5.67837 25.8102     9.87936  27.4123     10.2811  28.0073    112.421     12.9718     112.421     
1 1 1 23 15 55 o 14 21.6526 5.86575 9.74259     8.49181  3.93407     9.76632  6.23655    185.069     0.515853    185.069     
1 1 1 23 15 56 o 4  42.023  5.23698 39.0839     10.1222  31.0551     10.9614  24.5064    64.8588     5.19761     244.859     
1 1 1 23 15 57 o 16 38.95   5.43956 31.6918     9.8376   29.3774     10.622   23.414     112.625     2.38586     292.625     
1 1 1 23 15 58 o 15 18.6014 5.49613 1.0208      8.69181  4.53886     8.53188  2.83724    314.547     10.5636     134.547     
1 1 1 23 15 59 o 3  39.0038 5.27675 34.3132     10.0125  27.0114     9.84167  20.6062    126.393     7.86413     306.393     
1 1 1 23 15 60 o 19 20.8968 5.8293  8.00178     9.12413  4.86285     8.94056  4.65584    201.971     2.95812     21.9707     
1 1 1 23 15 61 o 13 17.9955 5.48133 2.14283     9.23243  0.492186    8.69298  1.02795    123.822     1.9362      303.822     
1 1 1 23 15 62 o 15 19.0617 5.80823 4.72819     10.9565  -1.16645    9.20453  0.968619   58.9049     17.1688     238.905     
1 1 1 23 15 63 o 2  15.6881 5.13018 -11.6955    10.7099  -1.90624    8.83774  0.923304   136.576     9.20622     316.576     
1 1 1 23 15 64 o 6  34.7966 6.44069 26.2379     11.9773  25.9583     10.7622  17.0478    123.848     8.66483     303.848     
1 1 1 23 15 65 o 8  22.504  6.3803  5.69002     11.4797  9.84558     10.6152  8.76694    187.942     0.475851    187.942     
1 1 1 23 15 66 o 10 57.613  5.71686 68.7275     17.5084  68.9694     14.2633  45.5219    22.239      17.9905     22.239      
1 1 1 23 15 67 o 16 47.8637 6.79355 44.9727     14.0217  58.5206     17.4818  38.798     224.757     20.1931     224.757     
1 1 1 23 15 68 o 13 20.3461 6.36557 3.80321     14.0569  1.49024     11.4717  4.04146    337.869     5.29079     157.869     
1 1 1 23 15 69 o 12 27.8703 7.50879 10.8795     15.7534  25.0972     14.6414  10.5049    329.798     2.42249     329.798     
1 1 1 23 15 70 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 15 71 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 16 0  o 13 27.2759 6.84005 17.4662     8.50697  17.4662     8.50697  4.37014    8.26462e-06 19.0705     8.26462e-06 
1 1 1 23 16 1  o 13 100.55  2.75832 177.121     14.11    182.924     13.6201  54.3029    156.958     35.1745     336.958     
1 1 1 23 16 2  o 10 89.3316 2.85385 139.347     12.4512  145.071     13.0362  51.7324    292.961     22.0916     112.961     
1 1 1 23 16 3  o 11 69.9642 3.14826 89.9656     11.1536  84.9981     10.8091  38.2189    198.073     17.2123     18.0727     
1 1 1 23 16 4  o 2  80.0832 2.95536 114.287     11.7408  114.489     11.8982  18.3286    46.4119     76.8985     226.412     
1 1 1 23 16 5  o 18 159.174 2.67051 451.398     20.2866  449.352     22.2668  167.349    264.699     106.319     264.699     
1 1 1 23 16 6  o 1  192.662 2.75417 674.75      26.545   645.377     26.6268  158.064    334.6       32.9231     334.6       
1 1 1 23 16 7  o 17 267.843 3.04286 1283.26     39.9825  1269.99     41.6768  254.748    124.209     113.626     124.209     
1 1 1 23 16 8  o 8  114.006 2.59096 227.623     14.1545  234.925     15.4031  29.102     24.486      107.861     204.486     
1 1 1 23 16 9  o 11 112.567 2.5946  224.659     14.2219  226.302     15.0042  52.6026    87.0612     57.6956     267.061     
1 1 1 23 16 10 o 15 103.528 2.73155 203.36      14.0292  178.763     14.207   81.5379    245.73      17.3393     245.73      
1 1 1 23 16 11 o 5  28.2645 5.6368  13.5875     7.82774  16.0024     8.83648  20.8713    314.268     70.6941     314.268     
1 1 1 23 16 12 o 6  135.324 2.56478 335.928     16.7678  315.814     17.9193  105.297    315.429     14.9552     315.429     
1 1 1 23 16 13 o 9  70.5868 2.99292 86.6946     10.1377  91.3624     10.9395  47.8715    312.242     2.9665      312.242     
1 1 1 23 16 14 o 7  73.2175 3.12985 102.262     11.2878  89.6119     11.5158  41.401     267.447     17.0269     87.4472     
1 1 1 23 16 15 o 16 55.4384 3.67258 53.8837     10.0613  56.8096     10.1026  7.78501    83.4337     58.9412     263.434     
1 1 1 23 16 16 o 18 85.0818 3.14682 130.801     13.0749  127.894     13.6519  66.4217    214.832     16.7204     214.832     
1 1 1 23 16 17 o 11 24.5586 5.5839  -1.80305    8.42542  19.501      9.65149  6.68339    359.536     25.5953     359.536     
1 1 1 23 16 18 o 18 122.092 2.99769 267.53      17.4824  264.286     19.0971  71.8525    233.263     32.7213     53.2634     
1 1 1 23 16 19 o 11 131.101 3.22985 318.823     19.549   295.283     22.5701  99.9999    302.06      11.1311     302.06      
1 1 1 23 16 20 o 19 188.666 3.01646 627.875     27.2302  641.246     29.7768  154.655    214.437     34.1374     214.437     
1 1 1 23 16 21 o 12 22.3779 5.71922 8.93464     7.79112  5.99875     8.81854  4.85414    116.796     16.5787     116.796     
1 1 1 23 16 22 o 10 130.743 2.8694  303.51      18.0059  306.474     19.5251  109.116    146.173     31.106      146.173     
1 1 1 23 16 23 o 9  141.954 2.79142 362.447     19.0622  356.442     20.5712  126.975    133.098     50.6086     133.098     
1 1 1 23 16 24 o 18 132.86  2.76429 313.425     17.1321  316.441     19.5662  87.2082    250.198     16.8681     70.1976     
1 1 1 23 16 25 o 1  42.757  4.74421 38.7649     9.05716  29.0248     10.2436  15.2587    195.897     15.4972     15.8971     
1 1 1 23 16 26 o 2  155.301 2.63568 427.62      19.2732  432.417     21.6746  125.821    226.632     28.1423     226.632     
1 1 1 23 16 27 o 14 89.4746 2.90166 148.692     11.934   137.802     13.852   53.5382    100.999     18.425      280.999     
1 1 1 23 16 28 o 17 153.003 2.82072 430.627     20.8596  405.513     22.2901  124.873    100.983     29.7149     100.983     
1 1 1 23 16 29 o 18 130.219 2.80855 310.774     17.6933  295.328     18.8608  92.0353    141.633     2.71719     321.633     
1 1 1 23 16 30 o 13 33.5195 5.41593 16.7298     8.81507  26.0623     9.11243  8.33862    131.093     20.1379     311.093     
1 1 1 23 16 31 o 2  61.224  3.66732 75.9641     11.1079  60.1299     11.0577  45.0604    56.5396     7.78185     56.5397     
1 1 1 23 16 32 o 16 117.981 3.04356 238.963     17.9338  260.223     17.9725  83.9602    172.335     1.15553     352.335     
1 1 1 23 16 33 o 8  108.668 2.93322 207.981     16.7065  215.316     15.1068  73.7685    86.2451     7.74337     266.245     
1 1 1 23 16 34 o 14 79.218  3.19878 113.4       12.6679  112.515     12.6245  55.5605    179.571     0.19792     359.571     
1 1 1 23 16 35 o 9  66.9108 3.38709 77.7473     10.8902  84.1509     11.6788  53.7194    110.814     15.6318     110.814     
1 1 1 23 16 36 o 4  85.2578 3.27105 133.997     13.04    128.184     14.7065  56.333     204.548     7.50555     24.5482     
1 1 1 23 16 37 o 5  33.2884 5.31513 21.7056     8.08716  20.6525     9.23051  17.5913    1.34346     5.81804     1.34346     
1 1 1 23 16 38 o 9  19.2348 5.41547 2.87899     7.19331  5.09886     8.46527  1.31047    181.571     17.2976     181.571     
1 1 1 23 16 39 o 1  23.3509 5.5807  13.266      7.5627   4.29645     8.88803  4.4193     74.5377     4.34436     254.538     
1 1 1 23 16 40 o 19 51.8282 4.02611 57.2707     9.25164  42.1595     10.725   39.4507    229.721     10.4739     229.721     
1 1 1 23 16 41 o 19 84.5893 2.96968 129.284     11.8509  128.862     13.2054  61.3347    21.3772     4.62491     21.3772     
1 1 1 23 16 42 o 15 115.542 2.77108 245.124     15.2843  235.237     16.6909  77.3172    299.958     8.1654      119.958     
1 1 1 23 16 43 o 3  36.0446 4.97873 33.1        8.62848  17.4475     8.63532  20.3738    287.898     3.81959     107.898     
1 1 1 23 16 44 o 17 52.2219 4.00961 53.0097     10.056   47.7816     10.5271  35.5944    243.607     1.38309     243.607     
1 1 1 23 16 45 o 10 88.6139 2.9963  138.285     13.0737  145.713     13.4616  69.3019    350.944     15.8308     350.944     
1 1 1 23 16 46 o 18 63.888  3.56772 73.4985     10.9274  75.8955     11.728   37.4163    62.6129     12.6917     242.613     
1 1 1 23 16 47 o 4  36.3575 5.69354 35.2181     10.0404  17.2902     10.5306  3.86053    172.999     56.3817     172.999     
1 1 1 23 16 48 o 18 72.7236 3.28726 95.073      12.3819  97.8231     11.4125  54.9692    8.7697      10.349      8.7697      
1 1 1 23 16 49 o 13 44.7675 4.69822 41.6967     11.0561  34.7792     9.40605  18.0737    144.565     23.9946     324.565     
1 1 1 23 16 50 o 8  57.6983 3.89625 68.9702     11.6421  55.2123     10.5985  39.7304    178.43      1.4961      178.43      
1 1 1 23 16 51 o 3  124.66  2.79751 286.743     16.8781  277.143     17.9872  112.005    79.8973     52.0795     79.8973     
1 1 1 23 16 52 o 18 22.8464 5.89695 3.39611     8.60223  13.9776     9.62501  6.85835    44.0773     12.0918     224.077     
1 1 1 23 16 53 o 7  50.9779 4.11443 51.5712     10.2925  46.784      10.3254  48.25      55.5922     31.5198     55.5922     
1 1 1 23 16 54 o 19 29.9083 5.81448 26.2552     9.77904  10.5215     9.17349  18.9718    110.688     4.18311     110.688     
1 1 1 23 16 55 o 4  26.1525 6.03282 16.5501     9.43771  10.9967     8.88754  9.76648    158.097     4.72496     158.097     
1 1 1 23 16 56 o 13 45.2535 4.6518  38.8054     10.3436  40.9565     10.1203  25.3323    145.187     8.46858     325.187     
1 1 1 23 16 57 o 11 36.5774 5.51983 29.0761     9.90693  25.5445     9.71966  25.013     136.678     5.91483     136.678     
1 1 1 23 16 58 o 19 33.7298 6.71718 25.3605     9.77922  23.5663     14.4189  21.2886    262.448     4.21415     262.448     
1 1 1 23 16 59 o 11 63.8041 4.04554 68.8535     12.0757  86.6266     13.515   44.337     302.752     4.69635     302.752     
1 1 1 23 16 60 o 3  18.2015 5.59354 1.49183     8.99032  0.193302    10.0372  2.72271    328.006     8.34237     148.006     
1 1 1 23 16 61 o 10 21.1485 6.27695 0.197374    12.3534  7.50724     10.6364  2.58021    214.619     0.309575    214.619     
1 1 1 23 16 62 o 6  20.8765 6.23356 2.78812     11.6827  5.4076      10.7786  6.52428    310.161     7.62966     130.161     
1 1 1 23 16 63 f 0  17.3774 5.61151 -3.20589    11.0571  -4.08216    10.6988  4.87114    162.607     0           0           
1 1 1 23 16 64 o 15 43.4813 6.39071 49.6842     15.771   33.2744     11.2665  29.5192    172.481     4.70595     172.481     
1 1 1 23 16 65 o 17 29.5213 7.29129 20.3212     15.268   19.9857     11.572   17.2857    295.739     4.74257     295.739     
1 1 1 23 16 66 o 13 19.1397 6.20006 7.86119     14.9349  -17.2631    12.6508  3.19307    219.825     7.31836     39.8252     
1 1 1 23 16 67 o 4  23.8821 7.16021 10.6407     15.0929  9.23179     14.6327  7.25096    169.433     1.99687     349.433     
1 1 1 23 16 68 o 18 32.1307 8.01513 24.6968     17.1579  30.6587     15.4587  16.8541    320.804     2.4403      320.804     
1 1 1 23 16 69 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 17 0  o 3  19.4951 6.98743 10.0238     8.50703  10.0238     8.50703  4.61165    360         12.6143     360         
1 1 1 23 17 1  o 2  73.2807 3.27927 89.8623     11.9944  102.566     11.9195  28.5729    149.213     45.7368     329.213     
1 1 1 23 17 2  o 1  97.5599 3.06632 166.544     14.8948  173.252     15.0111  37.7576    113.216     65.751      293.216     
1 1 1 23 17 3  o 1  135.906 2.8404  322.84      19.7741  335.363     18.8392  99.716     322.988     0.956467    322.988     
1 1 1 23 17 4  f 0  89.8914 2.99211 150.229     13.3779  138.355     13.4818  101.211    229.207     0           0           
1 1 1 23 17 5  o 13 99.7931 2.89407 171.472     14.4172  183.857     14.4558  38.1852    8.09649     68.3706     188.096     
1 1 1 23 17 6  o 17 186.712 3.0866  618.037     29.5411  624.334     28.1977  158.231    190.369     41.2515     190.369     
1 1 1 23 17 7  o 13 43.0966 4.73697 29.3696     9.57152  39.1958     10.1471  0.190226   65.374      54.2696     245.374     
1 1 1 23 17 8  o 5  108.43  2.87975 214.648     15.0808  204.73      16.1105  103.815    182.235     55.613      182.235     
1 1 1 23 17 9  o 4  64.2104 3.6544  86.2408     10.635   62.9166     12.123   46.718     265.118     28.3637     265.118     
1 1 1 23 17 10 o 15 110.061 3.03325 223.689     15.6555  208.835     17.5974  119.178    300.175     91.9626     300.175     
1 1 1 23 17 11 f 0  42.8961 5.12689 39.3971     9.89244  28.9682     11.0517  25.5716    34.1409     0           0           
1 1 1 23 17 12 o 8  103.599 3.05265 187.073     15.2501  196.315     16.3777  84.371     171.66      21.5495     171.66      
1 1 1 23 17 13 o 8  29.7794 5.9971  17.5693     8.94592  15.3432     9.88332  3.07099    161.018     30.3779     161.018     
1 1 1 23 17 14 o 8  80.0461 3.34179 116.635     12.7787  112.985     13.8673  46.3648    344.231     19.5156     164.231     
1 1 1 23 17 15 o 12 132.545 2.75501 310.142     17.1258  316.366     19.3836  94.5774    226.538     3.56846     46.5377     
1 1 1 23 17 16 o 4  99.6592 2.93626 178.579     14.0419  176.238     15.191   44.6779    37.0026     54.3425     217.003     
1 1 1 23 17 17 f 0  113.403 2.72939 223.311     14.1985  235.626     16.7326  83.0119    190.209     0           0           
1 1 1 23 17 18 f 0  91.62   2.74823 149.794     12.1772  149.975     12.989   64.2359    53.7223     0           0           
1 1 1 23 17 19 o 1  23.487  5.24782 17.2686     8.08313  -1.40093    8.12456  3.93405    249.555     15.9157     249.555     
1 1 1 23 17 20 o 17 27.7413 5.36986 19.9073     7.78373  8.25494     8.4065   3.92835    151.309     28.1713     151.309     
1 1 1 23 17 21 o 18 122.669 2.63698 264.692     15.9992  272.272     16.3853  91.0545    153.719     5.61478     153.719     
1 1 1 23 17 22 o 16 47.5157 4.14966 45.2038     9.29856  37.3819     9.87591  23.9344    52.5677     6.86817     232.568     
1 1 1 23 17 23 o 11 176.579 2.64609 562.129     22.6289  549.917     24.1574  153.263    353.705     49.5474     353.705     
1 1 1 23 17 24 o 11 190.67  2.91154 656.11      26.6834  642.596     28.8869  149.539    56.8212     20.717      56.8212     
1 1 1 23 17 25 o 19 92.9998 3.14099 162.083     14.9696  148.226     14.2254  66.3151    31.6501     0.572808    31.6507     
1 1 1 23 17 26 o 7  174.08  2.9925  539.89      25.0791  544.175     27.0784  164.004    4.55514     75.2822     4.55514     
1 1 1 23 17 27 o 3  56.8246 3.90977 56.2164     10.8229  61.1706     11.1594  45.5174    108.686     16.8349     108.686     
1 1 1 23 17 28 o 19 79.7161 3.28762 121.145     13.2377  107.694     12.8981  63.6576    298.216     14.8524     298.216     
1 1 1 23 17 29 o 16 125.235 2.78309 285.329     16.9023  276.041     17.9497  96.5457    333.538     12.1093     333.538     
1 1 1 23 17 30 o 1  26.5358 5.85741 11.2064     8.67245  14.7158     8.68896  6.79253    93.7545     2.96256     273.755     
1 1 1 23 17 31 o 15 51.984  3.87007 43.6331     9.24232  55.3506     10.6279  44.1657    160.097     21.1577     160.097     
1 1 1 23 17 32 o 18 108.176 2.76826 214.208     14.3683  205.388     15.5413  82.7988    352.394     10.5848     352.394     
1 1 1 23 17 33 o 8  91.2642 2.85295 155.151     12.2779  144.111     13.6479  67.3296    205.698     4.83068     205.698     
1 1 1 23 17 34 o 3  76.5637 3.10165 107.532     11.4492  103.89      12.2215  54.1854    357.996     0.513421    357.996     
1 1 1 23 17 35 o 15 41.008  4.72516 34.9031     8.76945  28.3385     9.78268  30.7898    48.1731     17.391      48.1731     
1 1 1 23 17 36 o 13 92.808  3.1072  152.411     14.0099  158.438     14.8112  91.7833    32.6654     53.7378     32.6654     
1 1 1 23 17 37 o 17 19.4447 5.47202 5.72314     7.93571  2.20361     8.18289  0.942276   231.352     8.79087     51.3523     
1 1 1 23 17 38 o 9  59.9292 3.64354 75.3005     10.8535  56.5492     10.653   32.7625    185.59      17.6444     5.58961     
1 1 1 23 17 39 o 8  21.4502 5.55477 12.1502     8.24247  -0.823072   8.80605  1.82462    172.032     27.2253     172.032     
1 1 1 23 17 40 o 17 75.2793 3.49868 120.73      12.9068  86.9794     13.0262  58.0338    188.287     11.3024     188.287     
1 1 1 23 17 41 f 0  79.9747 3.07893 121.125     12.4995  110.537     12.0831  57.7282    159.04      0           0           
1 1 1 23 17 42 o 2  116.799 2.89994 244.976     17.1182  247.291     16.7736  92.8307    21.3141     20.9152     21.3141     
1 1 1 23 17 43 o 15 93.4905 3.01326 149.197     14.2601  167.352     13.8337  82.9211    326.044     35.5364     326.044     
1 1 1 23 17 44 o 6  52.3796 3.87382 49.8408     10.1726  51.5758     9.85071  28.2341    169.202     15.0004     349.202     
1 1 1 23 17 45 o 4  89.6768 2.95749 146.964     13.5897  144.368     12.9155  65.8948    128.215     6.67609     128.215     
1 1 1 23 17 46 o 17 85.4762 3.02179 131.112     13.1286  134.241     12.6652  63.4698    200.744     8.04797     200.744     
1 1 1 23 17 47 o 19 124.593 2.82756 287.211     17.5713  275.122     17.6835  112.833    198.01      51.6572     198.01      
1 1 1 23 17 48 o 16 36.3049 6.06384 25.0975     10.3356  28.2366     11.3821  21.7281    49.6263     3.13474     229.626     
1 1 1 23 17 49 o 6  20.3038 5.83024 5.88961     8.47511  2.89762     10.2434  4.50855    309.746     12.4396     129.746     
1 1 1 23 17 50 o 3  56.781  4.39053 62.3017     12.4243  60.2269     12.156   43.487     227.723     10.3883     227.723     
1 1 1 23 17 51 o 12 67.0448 3.66046 85.232      12.9211  82.2121     11.4576  44.1969    190.512     3.1924      10.5116     
1 1 1 23 17 52 o 19 42.1368 5.18167 35.1511     11.278   35.2715     9.75103  10.4739    288.562     35.5131     108.562     
1 1 1 23 17 53 o 9  65.0744 3.93638 70.9117     13.1732  89.2701     11.8523  43.3951    272.512     1.34031     92.5116     
1 1 1 23 17 54 o 1  26.7715 5.91653 8.49771     9.57523  19.9773     9.04228  13.5968    317.057     2.54602     137.057     
1 1 1 23 17 55 o 10 23.2125 6.23846 8.42571     9.94216  10.4396     10.1221  8.92261    344.13      3.54278     164.13      
1 1 1 23 17 56 o 15 17.3332 5.20454 -8.29082    8.91692  6.53648     8.27839  0.970784   158.371     2.30688     338.371     
1 1 1 23 17 57 o 13 43.5341 5.39265 30.3222     10.803   47.2491     11.7406  23.6288    344.502     8.85268     164.502     
1 1 1 23 17 58 o 18 23.13   6.42726 6.79646     9.55161  11.2705     12.2092  5.141      122.464     15.4417     302.464     
1 1 1 23 17 59 o 8  20.0647 5.86364 3.58791     10.068   5.3158      9.16429  5.71698    14.657      2.05262     194.657     
1 1 1 23 17 60 o 13 37.0995 6.32452 26.4435     12.669   32.3982     10.7432  19.7299    268.934     7.46417     88.9335     
1 1 1 23 17 61 o 7  22.111  6.2643  -26.6325    18.3448  14.9731     10.3251  4.61295    50.1032     1.41354     50.1032     
1 1 1 23 17 62 o 16 29.5272 7.31622 26.1004     15.7675  14.3445     10.9813  18.201     178.094     4.76714     178.094     
1 1 1 23 17 63 o 1  44.9764 6.71366 41.271      16.5723  49.1351     12.6251  33.0554    357.408     10.0497     357.408     
1 1 1 23 17 64 o 4  31.2551 7.4449  24.2116     15.8234  23.4898     12.0986  17.8772    104.271     1.41654     104.271     
1 1 1 23 17 65 o 12 23.9215 7.07707 17.4053     15.2154  2.14599     13.8904  5.35259    106.652     0.411616    106.652     
1 1 1 23 17 66 o 12 47.0466 7.54279 48.014      18.5688  62.2086     16.4406  38.1382    50.2124     23.3482     50.2124     
1 1 1 23 17 67 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 18 0  o 4  101.656 3.20795 184.883     16.2684  184.883     16.2684  95.0546    360         37.5771     360         
1 1 1 23 18 1  o 12 22.6039 6.05362 7.4934      9.93767  6.22558     8.88861  14.3258    65.2898     45.6654     65.2898     
1 1 1 23 18 2  o 8  33.09   5.87266 14.2656     10.5022  26.7849     9.4986   1.26087    40.8522     28.5609     220.852     
1 1 1 23 18 3  o 4  51.9417 4.17291 41.9114     10.4973  56.6893     10.6297  25.3718    227.086     14.9123     47.0855     
1 1 1 23 18 4  o 3  79.4319 3.26165 123.458     12.8856  103.111     12.8853  31.9121    48.9284     49.7942     228.928     
1 1 1 23 18 5  o 4  44.1548 4.63201 37.7282     9.9102   33.9755     9.94284  4.01847    47.9708     66.6074     47.9708     
1 1 1 23 18 6  o 11 86.8344 3.6747  154.531     15.9216  117.621     15.7048  50.3608    178.928     23.3287     358.928     
1 1 1 23 18 7  o 10 65.3442 3.88581 79.5845     13.2693  74.5829     11.9415  48.9671    148.216     13.6264     148.216     
1 1 1 23 18 8  o 18 62.9907 3.80981 74.7386     11.7898  68.5424     12.0013  25.0855    139.225     36.7863     319.225     
1 1 1 23 18 9  o 19 101.323 3.10927 193.989     15.7513  173.585     15.7136  62.3454    345.428     21.7646     165.428     
1 1 1 23 18 10 f 0  62.172  4.03088 73.0201     12.5307  66.9443     12.2975  33.563     54.1919     0           0           
1 1 1 23 18 11 o 17 70.034  3.32764 81.3117     11.4885  95.1269     11.6912  40.0598    249.374     16.7066     69.3744     
1 1 1 23 18 12 o 18 95.5363 2.83529 163.41      13.1157  162.78      13.9575  71.8868    70.4162     7.81588     70.4161     
1 1 1 23 18 13 o 2  130.14  2.75626 298.879     17.4716  305.761     18.4359  109.184    83.6755     29.3821     83.6755     
1 1 1 23 18 14 o 12 94.1209 2.88673 152.911     13.1796  163.984     13.9916  71.0819    186.739     8.62991     186.739     
1 1 1 23 18 15 o 16 95.2802 2.88278 153.008     13.324   171.937     14.1425  96.9111    45.257      66.291      45.257      
1 1 1 23 18 16 o 16 55.854  3.73821 55.2919     10.0989  57.6349     10.5801  38.1779    168.764     8.70965     168.764     
1 1 1 23 18 17 o 3  68.9792 3.54266 78.8106     12.1857  92.9186     12.0588  31.8618    340.938     32.8906     160.938     
1 1 1 23 18 18 o 5  62.3088 3.66427 69.8824     11.3544  70.3796     11.3222  39.6164    191.365     4.96553     11.3647     
1 1 1 23 18 19 o 16 143.844 2.97427 358.939     21.7999  381.424     20.9858  125.13     348.921     40.5        348.921     
1 1 1 23 18 20 o 14 58.3113 4.25689 59.8379     12.9543  64.1134     11.4274  33.6889    317.388     12.0475     137.388     
1 1 1 23 18 21 o 3  87.2441 3.68673 134.976     15.5225  139.525     16.5648  81.1998    185.708     40.1147     185.708     
1 1 1 23 18 22 o 17 121.771 3.03798 258.368     18.5188  273.065     18.4896  112.919    139.384     49.5348     139.384     
1 1 1 23 18 23 f 0  110.629 3.18047 213.924     18.0197  225.451     17.1261  93.4161    137.598     0           0           
1 1 1 23 18 24 o 12 118.506 2.84596 248.002     16.7472  254.907     17.0073  98.4957    292.272     24.5893     292.272     
1 1 1 23 18 25 o 19 70.7097 3.5333  89.3441     11.7255  91.3632     13.1252  54.9663    231.061     9.98777     231.061     
1 1 1 23 18 26 o 9  30.2939 6.05592 16.3386     9.71999  18.6357     9.5149   13.1092    212.786     5.02094     32.7859     
1 1 1 23 18 27 o 16 112.74  2.92352 236.471     16.2545  219.77      16.6875  82.1817    238.597     0.810275    238.597     
1 1 1 23 18 28 o 12 43.9995 4.5562  43.4328     9.40378  29.1531     9.69599  27.4766    173.356     3.29868     353.356     
1 1 1 23 18 29 o 17 93.6986 2.95125 159.538     14.1643  156.104     13.4794  90.066     284.445     46.8538     284.445     
1 1 1 23 18 30 o 8  108.773 2.83126 212.151     15.2315  212.761     15.5811  75.0744    275.783     6.98299     95.7834     
1 1 1 23 18 31 o 10 50.2323 3.97607 47.149      9.76186  45.5598     9.90649  45.5567    301.77      29.4925     301.77      
1 1 1 23 18 32 o 5  87.7869 3.1073  142.457     14.1684  135.715     13.0829  78.1856    152.15      31.8716     152.15      
1 1 1 23 18 33 o 2  62.3051 3.5059  67.5621     10.9004  73.8172     10.7877  38.7318    41.0077     9.91718     221.008     
1 1 1 23 18 34 o 17 30.6849 5.60083 19.0151     8.44054  17.4899     8.92172  13.104     173.564     10.4903     353.564     
1 1 1 23 18 35 o 16 83.3085 3.01295 120.888     12.3537  129.875     12.7187  75.116     282.274     32.9653     282.274     
1 1 1 23 18 36 o 6  43.3345 4.79604 32.807      9.27083  38.183      10.8903  36.2942    288.373     21.8529     288.373     
1 1 1 23 18 37 f 0  44.1518 4.49853 34.3829     9.49274  38.7842     9.82918  33.5245    195         0           0           
1 1 1 23 18 38 o 3  18.9748 5.32672 0.20503     7.9554   6.76907     7.59967  1.34803    340.137     10.3105     160.137     
1 1 1 23 18 39 o 15 117.027 2.71647 243.172     16.0288  250.05      15.7835  97.451     95.6214     28.4485     95.6214     
1 1 1 23 18 40 o 12 17.3472 5.18625 -1.76189    8.16132  3.22893     7.60957  0.192645   39.4155     9.87344     219.416     
1 1 1 23 18 41 o 17 53.646  3.95993 55.3587     11.1001  51.23       9.87581  35.3573    161.429     2.78039     341.429     
1 1 1 23 18 42 o 3  83.4365 3.13384 117.669     13.5137  135.576     12.437   61.507     105.465     5.82529     105.465     
1 1 1 23 18 43 o 9  79.1282 3.39479 110.555     13.3921  118.391     13.3916  40.4502    296.303     30.4174     116.303     
1 1 1 23 18 44 o 10 87.8384 3.20499 127.663     14.3438  154.355     13.5809  58.4636    331.92      6.51627     151.92      
1 1 1 23 18 45 o 12 80.2649 3.16874 122.256     12.7435  113.179     12.6357  57.5694    323.284     2.96354     323.284     
1 1 1 23 18 46 o 14 64.6702 3.58143 76.1197     11.5145  78.5699     11.5118  66.0739    23.8485     45.0973     23.8485     
1 1 1 23 18 47 o 11 32.9544 5.93681 19.2853     10.4784  24.9163     9.36193  24.3079    93.5267     9.79418     93.5267     
1 1 1 23 18 48 f 0  56.9083 3.87951 59.5084     11.125   62.016      10.7076  47.496     238.617     0           0           
1 1 1 23 18 49 o 14 70.1359 3.38598 91.5733     11.846   90.5616     11.8132  47.1526    57.1971     2.42017     237.197     
1 1 1 23 18 50 o 1  78.7699 3.36121 113.843     12.7861  116.06      13.6191  61.0005    41.3266     13.5542     41.3266     
1 1 1 23 18 51 o 9  24.838  6.22333 10.8294     9.16917  13.1901     10.2215  11.6103    332.477     3.62217     152.477     
1 1 1 23 18 52 o 19 21.7901 5.98484 2.98026     8.96638  11.7036     10.1368  2.86462    87.6424     19.3591     267.642     
1 1 1 23 18 53 o 5  39.0325 6.04905 35.3515     11.9245  28.5758     11.1153  29.7395    82.0693     11.7978     82.0693     
1 1 1 23 18 54 o 11 17.6815 5.30312 -10.1248    9.71327  7.11881     8.48733  1.15526    82.5175     2.10988     262.518     
1 1 1 23 18 55 o 10 61.2712 4.06429 75.0405     12.8493  68.4251     11.8245  40.5661    126.468     0.912153    306.468     
1 1 1 23 18 56 o 19 22.8242 6.15291 12.3223     10.536   6.00476     9.12437  8.59733    43.1098     4.94667     223.11      
1 1 1 23 18 57 o 6  52.5905 4.79998 54.8697     12.3346  53.9131     12.375   32.9035    139.637     3.90947     319.637     
1 1 1 23 18 58 o 11 20.572  6.40936 1.04075     10.3515  2.30899     15.1666  5.86501    230.375     9.58212     50.3751     
1 1 1 23 18 59 o 7  28.5236 7.32965 16.2019     13.8659  19.0495     13.304   16.8431    158.018     8.16384     158.018     
1 1 1 23 18 60 f 0  62.705  5.2652  69.8424     16.2514  90.1453     15.7621  40.7746    96.526      0           0           
1 1 1 23 18 61 o 3  23.5352 7.24041 8.39016     19.3877  5.75946     12.4536  2.81962    279.403     1.02195     279.403     
1 1 1 23 18 62 o 13 30.6977 7.3206  23.6255     15.2407  22.0086     11.6744  14.7826    298.561     6.34029     118.561     
1 1 1 23 18 63 o 19 23.1295 6.70496 7.89282     14.1424  11.0877     11.0583  6.60569    303.31      0.435345    123.31      
1 1 1 23 18 64 o 8  23.3263 6.93266 2.66224     14.4528  15.2067     13.8663  5.8649     257.754     10.6086     77.7538     
1 1 1 23 18 65 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 18 66 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 19 0  o 10 12.2402 5.67212 -1.12693    8.67025  -1.12693    8.67025  1.85973    180.001     4.19774     180.001     
1 1 1 23 19 1  o 10 102.311 3.03342 182.569     15.5823  192.206     15.4427  88.5374    17.288      30.4596     17.288      
1 1 1 23 19 2  o 8  85.6961 3.19578 130.885     13.795   132.513     13.5539  68.8506    46.5279     16.9977     46.5279     
1 1 1 23 19 3  o 2  62.6619 3.70303 73.005      11.5303  68.871      11.5063  43.1252    223.768     30.2267     223.768     
1 1 1 23 19 4  o 10 95.5102 3.09512 163.523     14.7707  163.274     14.7796  66.2509    273.471     5.35608     93.4709     
1 1 1 23 19 5  o 7  88.9891 3.14632 145.431     14.0383  138.512     13.9313  88.1554    193.324     55.2257     193.324     
1 1 1 23 19 6  o 19 67.6419 3.33488 78.8261     11.2293  85.8462     11.221   29.7125    303.915     36.1112     123.915     
1 1 1 23 19 7  o 18 58.7029 3.87766 62.6288     11.5341  62.2544     11.0113  45.8338    104.087     24.3124     104.087     
1 1 1 23 19 8  o 10 85.5269 3.00017 128.634     12.9659  133.461     12.6606  55.872     17.4219     11.0145     197.422     
1 1 1 23 19 9  o 8  69.9846 3.48351 92.2449     12.7651  84.2891     11.5191  27.3963    106.112     45.1463     286.112     
1 1 1 23 19 10 o 17 86.3083 3.14198 135.729     13.4741  131.509     13.6089  50.9818    352.567     22.7001     172.567     
1 1 1 23 19 11 o 10 115.613 2.94934 253.925     17.7904  224.905     16.3398  109.763    200.071     52.0712     200.071     
1 1 1 23 19 12 o 6  79.1936 3.34718 114.227     13.1755  111.334     13.2681  73.6145    218.046     37.8409     218.046     
1 1 1 23 19 13 f 0  51.1333 4.13456 42.9649     10.3904  52.7316     10.2979  41.1358    231.57      0           0           
1 1 1 23 19 14 o 18 138.289 3.0426  354.899     21.1418  330.294     20.9639  99.1012    343.271     5.93169     163.271     
1 1 1 23 19 15 o 11 83.5044 3.33902 124.027     13.9641  126.833     13.8652  62.1491    294.651     4.1265      294.651     
1 1 1 23 19 16 o 11 111.389 3.2535  221.72      19.0044  223.863     17.1817  91.3027    354.686     19.7079     354.686     
1 1 1 23 19 17 o 1  88.8473 3.28118 140.679     14.531   143.229     14.5862  67.0783    286.828     5.24061     286.828     
1 1 1 23 19 18 o 5  166.362 3.053   488.701     23.9035  503.156     26.9235  158.776    197.359     71.9031     197.359     
1 1 1 23 19 19 o 6  231.622 3.43894 968.434     37.7524  959.785     41.9462  207.304    181.862     71.1899     181.862     
1 1 1 23 19 20 f 0  16.3998 5.25036 -8.36149    8.1936   -0.981741   10.2989  21.3641    186.673     0           0           
1 1 1 23 19 21 o 9  71.4107 3.24256 93.6713     10.9794  90.2349     12.0528  56.1428    329.768     10.3565     329.768     
1 1 1 23 19 22 o 16 39.6215 4.83921 32.0328     8.59066  26.8892     9.77741  19.593     199.415     13.4775     19.4153     
1 1 1 23 19 23 o 19 23.7916 5.83381 8.04245     7.56942  11.4701     9.41561  4.87522    339.992     9.64026     159.992     
1 1 1 23 19 24 o 9  85.4584 2.97829 135.299     11.9094  127.485     13.4166  47.0304    132.488     30.1114     312.488     
1 1 1 23 19 25 o 12 25.943  5.86384 12.4744     7.81338  12.2634     9.45932  4.35083    319.145     21.0816     139.145     
1 1 1 23 19 26 o 5  20.8106 5.82962 6.35393     8.42721  2.97879     9.81544  4.86939    241.691     32.6313     241.691     
1 1 1 23 19 27 o 4  139.501 2.77488 354.257     18.0331  344.549     20.5964  139.373    49.8878     75.7723     49.8878     
1 1 1 23 19 28 o 10 34.2973 5.461   26.9788     8.55229  18.3675     9.8831   8.37781    131.357     28.7707     311.357     
1 1 1 23 19 29 o 9  20.549  5.54493 -2.63777    8.1068   11.4362     9.0595   1.78402    315.085     12.6872     135.085     
1 1 1 23 19 30 o 12 18.5579 5.40261 4.82196     7.73328  -0.820585   8.8253   0.316502   3.74196     10.0355     183.742     
1 1 1 23 19 31 o 10 41.2851 4.76796 27.1849     8.82114  37.593      10.2279  21.9642    279.284     11.6085     99.2838     
1 1 1 23 19 32 o 8  89.6094 3.0297  150.054     12.6546  140.195     14.3447  73.8763    91.069      19.4841     91.069      
1 1 1 23 19 33 o 15 79.6654 3.21457 132.751     11.6983  98.6111     13.3125  47.6751    119.948     18.7081     299.948     
1 1 1 23 19 34 o 17 82.9206 3.0904  126.227     11.9157  122.787     13.5893  57.9392    167.219     2.55645     347.219     
1 1 1 23 19 35 o 18 43.8208 4.56112 32.3909     9.73756  40.0483     9.57565  25.9609    234.156     7.34062     54.156      
1 1 1 23 19 36 o 15 25.6711 5.41559 19.5019     8.1605   4.08121     8.4372   9.46593    228.14      0.991429    228.14      
1 1 1 23 19 37 o 1  33.9785 5.30616 27.6077     8.72017  17.5687     8.97996  20.8293    289.104     0.326048    109.104     
1 1 1 23 19 38 f 0  12.7933 4.28227 -3.22111    7.59128  -17.2587    7.5331   18.1445    189.168     0           0           
1 1 1 23 19 39 o 1  26.398  5.39411 21.5021     8.33816  3.72655     8.66953  11.8539    1.70374     3.86644     1.70374     
1 1 1 23 19 40 o 15 20.7143 5.48993 10.8425     8.11655  0.284359    8.25956  6.0211     306.602     4.26033     126.602     
1 1 1 23 19 41 o 8  36.4626 5.48628 21.7582     9.0894   31.0463     10.4034  28.7133    269.718     12.3162     269.718     
1 1 1 23 19 42 o 10 38.3594 5.13493 33.9395     9.31055  23.8331     9.60773  25.7465    329.053     0.832004    329.053     
1 1 1 23 19 43 o 10 62.3398 3.65937 68.9375     10.9409  75.1792     11.7221  51.2075    60.8935     16.0207     60.8935     
1 1 1 23 19 44 o 3  20.7618 5.6786  7.9367      8.41043  4.61161     8.50024  7.33188    276.474     5.52188     96.4739     
1 1 1 23 19 45 o 13 22.1948 5.82317 4.09986     8.87306  11.8466     8.86788  2.36751    240.976     22.5382     60.9761     
1 1 1 23 19 46 o 2  30.8192 5.89009 24.6679     9.36501  14.3244     9.77612  10.4094    76.368      19.4657     256.368     
1 1 1 23 19 47 o 6  16.3027 5.15576 -2.81172    8.51702  -1.10811    8.76551  2.01941    107.679     5.00156     287.679     
1 1 1 23 19 48 o 8  18.7115 5.54672 6.06215     8.99702  -1.38677    8.90928  4.61047    62.3819     6.4435      242.382     
1 1 1 23 19 49 f 0  78.6618 3.43645 113.171     12.9743  117.206     13.9804  47.6665    249.896     0           0           
1 1 1 23 19 50 o 17 36.6402 5.85434 26.7137     9.9832   29.1598     11.0111  23.3561    177.309     0.0433255   177.309     
1 1 1 23 19 51 o 1  18.5334 5.53376 5.62287     9.04     -1.2327     8.91461  2.01678    126.596     1.81211     306.596     
1 1 1 23 19 52 o 4  17.2861 5.35579 1.06436     8.78694  -0.929736   8.97516  1.63261    257.965     6.72386     77.9649     
1 1 1 23 19 53 o 8  60.7513 4.62435 64.6076     13.5705  79.8274     14.0388  46.6394    209.706     11.7728     209.706     
1 1 1 23 19 54 o 7  28.2612 6.87138 15.8427     10.6789  18.3755     12.8687  12.1224    13.7413     9.57436     193.741     
1 1 1 23 19 55 o 16 17.7631 5.67603 -1.54129    9.74585  -3.47906    11.8205  2.6942     112.436     25.4252     112.436     
1 1 1 23 19 56 o 1  72.6494 4.64476 115.91      15.8796  90.7345     17.0756  61.9751    217.034     26.0379     217.034     
1 1 1 23 19 57 o 19 47.018  5.9379  42.8037     14.0466  50.0642     12.737   28.2149    17.0891     5.57017     197.089     
1 1 1 23 19 58 o 16 35.1738 7.69671 28.2842     14.8799  31.2488     15.0459  26.7812    175.269     16.0892     175.269     
1 1 1 23 19 59 o 17 32.3623 8.01085 31.1313     14.857   19.5136     19.107   8.34355    236.591     24.1816     56.5905     
1 1 1 23 19 60 o 19 33.5013 7.86258 24.1106     14.9865  33.4493     16.0278  22.5174    321.306     8.64676     321.306     
1 1 1 23 19 61 o 14 21.3583 6.86998 -0.439132   17.8462  2.94104     14.5468  5.0948     149.976     2.54412     329.976     
1 1 1 23 19 62 o 14 23.2031 7.09653 2.00316     14.5566  14.8252     16.0481  6.55931    83.0298     2.37356     263.03      
1 1 1 23 19 63 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 19 64 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 20 0  o 19 53.2642 5.03889 53.5509     12.7762  53.5509     12.7762  20.857     180         38.5405     8.65135e-06 
1 1 1 23 20 1  o 12 46.5994 5.15602 50.4086     11.8687  31.598      11.1277  9.74419    324.437     45.996      144.437     
1 1 1 23 20 2  o 9  55.3023 4.32382 58.4132     11.6904  53.5568     11.8447  29.2618    147.093     19.5464     327.093     
1 1 1 23 20 3  o 12 88.9599 3.63191 133.884     15.3772  151.948     16.8799  67.8385    355.259     5.59424     355.259     
1 1 1 23 20 4  o 17 25.2633 6.2137  15.1833     9.93089  5.22727     10.0682  3.74312    159.657     11.1331     339.657     
1 1 1 23 20 5  o 6  23.2282 6.11868 11.4067     9.71353  3.38002     9.86558  0.43767    197.297     22.176      197.297     
1 1 1 23 20 6  o 1  169.323 3.12717 523.323     26.5576  504.929     26.4632  122.402    137.478     8.39587     317.478     
1 1 1 23 20 7  o 12 112.972 3.30298 220.91      17.6027  238.043     19.7146  87.7154    104.78      8.13457     104.78      
1 1 1 23 20 8  o 15 61.6762 3.87992 70.9509     11.7277  67.2887     11.9892  27.7936    205.156     33.7642     25.1555     
1 1 1 23 20 9  o 6  46.4486 4.85923 37.1249     10.9605  43.1285     10.9217  32.112     165.309     1.31707     165.309     
1 1 1 23 20 10 o 1  78.4391 3.53831 106.655     12.8387  115.646     14.8232  51.5468    278.094     11.6757     98.0936     
1 1 1 23 20 11 o 13 77.9135 3.47146 111.636     12.9595  107.534     13.966   38.6365    259.912     37.1838     79.9116     
1 1 1 23 20 12 o 14 75.4541 3.46977 95.8014     12.8699  110.095     13.1987  66.091     191.248     23.4956     191.248     
1 1 1 23 20 13 o 15 41.9578 5.1101  29.1578     10.1321  37.2013     10.5381  24.0695    77.6028     8.35051     257.603     
1 1 1 23 20 14 o 1  41.8814 5.07628 30.2256     10.0505  35.7821     10.4779  29.8529    87.0038     5.7939      87.0038     
1 1 1 23 20 15 o 15 65.6819 3.57433 73.9694     11.3653  82.5479     11.9831  39.7762    103.918     15.3935     283.918     
1 1 1 23 20 16 f 0  113.021 2.86151 227.578     15.4258  230.834     16.911   70.9568    196.673     0           0           
1 1 1 23 20 17 o 13 67.3636 3.40397 87.6476     10.6911  76.7837     11.9629  49.3461    97.7078     1.85823     97.7078     
1 1 1 23 20 18 o 12 46.7864 4.32499 43.574      9.3484   37.4588     10.2706  40.7458    139.208     26.977      139.208     
1 1 1 23 20 19 o 18 31.3193 6.5326  18.0751     10.5164  19.7687     11.3926  8.02448    353.837     24.1196     173.837     
1 1 1 23 20 20 o 16 49.6577 4.08282 44.3988     9.67658  46.3665     10.2657  38.9049    61.1366     10.2295     61.1366     
1 1 1 23 20 21 o 2  34.2574 5.16726 19.5248     8.36531  25.4938     8.86136  17.3647    22.3468     8.75648     202.347     
1 1 1 23 20 22 o 11 71.8457 3.19493 88.1591     10.999   98.7089     11.8968  49.7583    4.22648     4.18444     184.227     
1 1 1 23 20 23 o 9  57.9764 3.49472 58.1569     9.65088  64.3552     10.4685  34.7413    108.289     13.1097     288.289     
1 1 1 23 20 24 o 2  90.7717 2.89074 147.717     12.6557  149.165     13.5638  75.253     79.8863     18.7224     79.8863     
1 1 1 23 20 25 o 8  60.9052 3.49238 62.4773     10.0181  72.9211     11.1271  47.5088    171.866     9.01105     171.866     
1 1 1 23 20 26 o 1  46.5366 4.73161 43.6324     9.93452  37.7928     11.2727  21.4508    273.373     22.1481     93.3733     
1 1 1 23 20 27 o 15 33.7465 5.61754 15.1259     9.84636  29.4282     9.29553  20.4174    328.485     10.1982     328.485     
1 1 1 23 20 28 o 3  67.5264 3.41714 93.4049     10.7805  73.2293     11.8685  44.3239    326.282     8.07719     146.282     
1 1 1 23 20 29 o 16 176.488 2.7194  579.091     23.3154  541.406     24.698   138.992    89.1666     19.3298     89.1666     
1 1 1 23 20 30 o 5  57.8731 3.71948 66.6505     10.065   56.5091     11.0755  47.8257    6.01165     15.0543     6.01165     
1 1 1 23 20 31 o 16 75.8944 3.33019 111.388     11.6931  98.3736     13.3024  62.3872    280.246     16.4485     280.246     
1 1 1 23 20 32 o 19 87.4581 2.86562 142.23      12.5333  134.186     12.51    58.9438    292.123     8.22977     112.123     
1 1 1 23 20 33 f 0  23.3766 5.58032 4.85351     8.14641  13.9749     8.08111  33.9316    268.617     0           0           
1 1 1 23 20 34 o 19 19.4432 5.48422 2.33721     7.81699  6.09785     8.3672   2.96499    305.441     5.39819     125.441     
1 1 1 23 20 35 o 2  52.8948 3.95345 49.7065     10.0722  54.119      10.5711  36.6961    64.1738     0.302032    244.174     
1 1 1 23 20 36 o 14 37.9544 4.99472 25.8897     8.99727  29.7488     9.30124  25.7436    221.863     1.50829     221.863     
1 1 1 23 20 37 o 3  26.7175 5.70739 19.2481     8.81822  8.25161     8.4646   2.27648    97.583      30.459      277.583     
1 1 1 23 20 38 f 0  17.3851 5.19428 3.72226     7.84346  -1.64795    7.95761  13.9864    276.397     0           0           
1 1 1 23 20 39 o 19 50.6227 4.16717 47.2246     10.028   49.1841     10.7185  39.9249    169.383     10.0408     169.383     
1 1 1 23 20 40 o 5  19.8437 5.56855 7.3033      8.27549  2.16317     8.49164  6.10972    25.0923     6.72602     205.092     
1 1 1 23 20 41 o 7  19.5687 5.56361 4.78552     8.29328  4.39822     8.40959  5.10796    285.459     10.0728     105.459     
1 1 1 23 20 42 o 15 61.1782 3.85604 78.0233     12.2945  62.6435     11.0934  45.2616    155.975     4.94656     155.975     
1 1 1 23 20 43 o 6  25.3115 6.14515 13.0604     8.81518  11.8648     10.0861  13.1629    94.9534     2.71689     274.953     
1 1 1 23 20 44 o 17 26.8377 5.8972  19.3109     9.10188  9.68657     9.03307  9.75046    152.155     5.78786     152.155     
1 1 1 23 20 45 o 12 24.5908 5.972   14.5207     8.95159  8.95862     9.09348  5.1125     88.7085     20.6053     268.709     
1 1 1 23 20 46 f 0  49.4884 4.35941 46.8599     10.4803  47.6419     10.6755  34.248     256.185     0           0           
1 1 1 23 20 47 o 12 16.9535 5.26181 -3.17681    8.58346  2.18381     8.76372  0.893884   79.3262     14.1265     259.326     
1 1 1 23 20 48 o 3  43.8628 5.17919 43.0642     11.3675  34.3972     10.5786  33.9078    42.4418     10.3955     42.4418     
1 1 1 23 20 49 o 13 39.1888 5.99319 31.2167     11.5982  33.3352     11.2577  23.7942    25.8932     3.35161     205.893     
1 1 1 23 20 50 o 7  32.4493 6.40363 12.9589     11.1154  32.9528     11.8585  17.5846    209.31      4.73392     29.31       
1 1 1 23 20 51 o 15 55.6002 4.8465  60.7156     13.4329  61.4192     12.9931  38.9612    126.405     2.79912     126.405     
1 1 1 23 20 52 o 8  49.4769 5.60897 71.3775     13.3536  31.9147     12.4623  40.8356    84.4591     16.5924     84.4591     
1 1 1 23 20 53 o 5  20.9609 5.88671 -9.04058    10.4447  14.6789     10.7228  7.60839    278.452     6.44543     98.4516     
1 1 1 23 20 54 o 15 66.6565 4.2131  79.7939     13.9342  91.6892     13.8389  59.2385    3.00327     28.3981     3.00327     
1 1 1 23 20 55 f 0  45.7698 6.2384  47.7814     12.8317  42.1204     14.6247  22.1623    111.144     0           0           
1 1 1 23 20 56 o 14 35.5415 6.76414 30.2742     11.8935  27.1257     12.8199  25.6914    229.212     7.80263     229.212     
1 1 1 23 20 57 o 7  28.0415 7.44835 12.0459     14.6266  23.3836     14.4531  16.4782    245.65      5.71242     245.65      
1 1 1 23 20 58 o 1  32.5872 8.01452 32.3033     16.2704  23.2398     16.1302  15.1539    81.3178     9.5032      261.318     
1 1 1 23 20 59 o 2  22.2429 7.22181 -0.659146   14.7153  6.87402     21.3911  6.58293    356.095     6.17149     176.095     
1 1 1 23 20 60 o 9  19.9303 6.45651 7.33169     15.4018  -10.0974    14.1761  2.03926    116.203     2.00818     296.203     
1 1 1 23 20 61 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 20 62 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 21 0  o 13 26.8914 7.89867 18.5812     10.6053  18.5812     10.6053  6.47016    4.06838e-06 24.7025     180         
1 1 1 23 21 1  o 6  55.285  3.95255 55.1985     10.7944  56.5753     10.8052  27.8285    147.91      24.205      327.91      
1 1 1 23 21 2  o 9  98.3499 3.0028  169.387     14.8051  178.484     14.7144  88.1266    334.416     30.9294     334.416     
1 1 1 23 21 3  o 4  34.2244 5.63275 17.4897     9.06099  27.9019     10.0521  1.46565    119.265     44.3106     299.265     
1 1 1 23 21 4  o 5  56.9982 3.93734 55.1099     11.0204  63.7854     11.1409  49.979     89.5869     20.3785     89.5869     
1 1 1 23 21 5  o 13 22.0885 5.86081 11.1432     8.73356  0.486004    9.89653  2.77032    150.721     13.4356     330.721     
1 1 1 23 21 6  o 7  89.8319 3.38073 147.504     14.86    144.044     15.4535  51.0221    338.591     31.2868     158.591     
1 1 1 23 21 7  o 1  23.875  6.15912 18.034      11.4179  -7.344      10.8854  5.17392    33.4892     40.1077     33.4892     
1 1 1 23 21 8  o 8  40.1059 5.84286 38.5177     11.0781  23.8206     11.6298  23.2211    74.4985     7.3497      254.498     
1 1 1 23 21 9  o 17 48.3389 4.76864 43.83       11.1967  43.2888     11.2776  39.7995    350.378     14.4553     350.378     
1 1 1 23 21 10 o 1  45.3007 4.99811 32.0005     10.7954  45.6429     10.9162  27.813     336.444     7.11542     156.444     
1 1 1 23 21 11 o 16 129.471 2.86907 291.381     19.4569  311.001     17.6     109.431    349.156     26.0573     349.156     
1 1 1 23 21 12 o 7  180.914 2.89845 575.952     26.238   599.529     26.312   158.136    53.4673     45.6545     53.4673     
1 1 1 23 21 13 o 13 30.2181 5.84787 16.1813     9.34818  19.0518     8.93294  11.4688    68.327      14.5301     248.327     
1 1 1 23 21 14 o 1  45.5807 4.45061 39.6576     9.96923  37.6693     9.81895  5.63278    100.161     54.2336     280.161     
1 1 1 23 21 15 o 17 28.3293 5.89506 18.3206     9.19766  12.4172     8.82753  13.8593    178.65      66.66       178.65      
1 1 1 23 21 16 o 10 72.0857 3.36193 98.007      12.0981  90.5748     12.0428  64.188     273.798     24.5164     273.798     
1 1 1 23 21 17 o 3  108.557 2.89035 212.731     15.6312  211.639     15.7603  84.6656    30.3676     8.82363     30.3676     
1 1 1 23 21 18 o 17 114.682 3.32044 257.406     17.9637  219.421     19.8165  91.8503    326.286     14.1183     326.286     
1 1 1 23 21 19 o 9  43.8596 4.90922 42.5513     10.0382  30.5702     10.524   8.54424    177.004     45.3538     357.004     
1 1 1 23 21 20 o 17 38.0004 5.20738 27.0518     9.0212   28.3218     10.0909  26.5094    189.979     16.7767     189.979     
1 1 1 23 21 21 o 12 50.3645 4.1986  50.147      9.77756  44.0075     10.8343  30.4475    171.332     10.3102     351.332     
1 1 1 23 21 22 o 2  53.862  4.13612 57.5156     10.8811  49.9694     11.0213  41.733     218.171     7.85835     218.171     
1 1 1 23 21 23 o 2  41.4038 4.91305 24.2302     9.31358  42.0202     10.1125  32.9903    312.88      12.5727     312.88      
1 1 1 23 21 24 o 4  43.9476 4.7317  39.5824     9.61288  33.4668     10.4135  31.7204    297.7       3.78435     297.7       
1 1 1 23 21 25 o 10 70.698  3.49625 97.5731     11.7113  85.0658     12.7499  47.6743    280.083     6.95106     100.083     
1 1 1 23 21 26 o 16 27.545  6.13265 13.8352     8.67539  15.3407     10.2291  12.3691    21.2386     2.55345     21.2386     
1 1 1 23 21 27 o 19 71.574  3.88105 99.1599     12.8343  89.3275     14.5853  51.298     253.976     0.634002    73.9756     
1 1 1 23 21 28 o 11 28.4004 6.15787 11.9063     9.05045  19.6013     10.3386  3.72337    297.763     45.6954     297.763     
1 1 1 23 21 29 f 0  15.2395 4.82343 -7.43703    7.82558  0.451579    7.71655  25.7763    319.124     0           0           
1 1 1 23 21 30 f 0  35.4918 5.30565 25.3305     9.24099  23.7484     9.04325  30.6642    191.174     0           0           
1 1 1 23 21 31 o 7  78.0188 3.18482 111.938     12.5738  109.656     12.2247  67.4243    298.474     22.8149     298.474     
1 1 1 23 21 32 o 17 75.0159 3.26011 98.6279     12.3006  106.78      12.0647  48.2944    282.326     11.6361     102.326     
1 1 1 23 21 33 o 5  16.2739 5.05234 0.0231654   7.99385  -2.20888    7.88685  5.34435    191.249     28.751      191.249     
1 1 1 23 21 34 o 12 29.918  5.86766 17.3657     8.92105  18.4593     9.29012  6.09681    129.726     28.1192     309.726     
1 1 1 23 21 35 o 10 21.3878 5.74321 5.45618     8.35642  8.61022     8.68738  3.93043    110.165     17.8105     290.165     
1 1 1 23 21 36 o 3  47.2539 4.40009 40.1018     10.2582  44.8075     10.0214  19.6758    113.011     27.3984     293.011     
1 1 1 23 21 37 o 15 17.7393 5.29349 4.53103     8.18769  -2.00706    8.27553  3.58697    42.7118     8.87848     222.712     
1 1 1 23 21 38 o 14 65.803  3.56072 83.7701     11.5901  77.0166     11.6916  57.3897    125.749     21.8405     125.749     
1 1 1 23 21 39 o 16 22.7116 5.85717 9.25379     8.6715   9.15267     8.64512  10.8115    345.065     1.19796     345.065     
1 1 1 23 21 40 o 1  25.7721 5.71742 20.5092     9.10802  4.85192     8.86026  11.1707    130.635     6.07745     130.635     
1 1 1 23 21 41 f 0  63.0306 3.86551 74.2193     11.8885  75.5118     12.2894  23.5523    2.96765     0           0           
1 1 1 23 21 42 o 6  72.2068 3.55542 105.218     12.4094  89.8828     13.0221  59.001     16.6762     16.2413     16.6762     
1 1 1 23 21 43 o 14 33.7634 5.67216 29.852      9.69847  17.7418     9.50416  14.5434    103.557     15.9583     283.557     
1 1 1 23 21 44 o 15 35.8211 5.52764 16.8923     9.87292  36.9353     9.83698  29.4055    41.7992     15.9409     41.7991     
1 1 1 23 21 45 o 2  38.6972 5.80533 29.5921     11.0266  32.7199     10.7933  29.4891    153.847     9.34152     153.847     
1 1 1 23 21 46 o 9  37.2679 6.03275 31.9777     11.2154  26.8587     10.8583  26.4749    271.324     5.5669      271.324     
1 1 1 23 21 47 o 2  56.6095 4.54821 64.0823     12.6575  61.1303     12.6825  41.554     288.33      5.74414     288.33      
1 1 1 23 21 48 o 10 29.0317 6.58014 20.1483     11.2253  16.4568     10.4772  17.6225    194.56      4.07379     194.56      
1 1 1 23 21 49 o 9  40.2594 5.97405 26.9234     11.9626  41.8875     11.4283  19.7564    295.959     14.2818     115.959     
1 1 1 23 21 50 o 14 50.2929 5.27084 48.9493     13.0862  53.1575     12.622   39.1275    27.3207     10.6219     27.3207     
1 1 1 23 21 51 o 3  58.8824 4.71202 63.3493     13.8617  73.2667     13.3031  55.9502    254.326     32.7071     254.326     
1 1 1 23 21 52 o 10 33.3852 6.79503 20.6905     13.036   29.1411     11.4951  24.2343    238.73      7.84349     238.73      
1 1 1 23 21 53 o 7  74.3228 4.27557 110.419     16.0023  104.692     15.5725  69.0083    142.237     36.6371     142.237     
1 1 1 23 21 54 o 11 27.7834 6.86695 12.0409     11.991   22.2908     12.1517  13.4576    238.085     6.7795      58.0855     
1 1 1 23 21 55 o 17 56.8656 5.87438 90.6467     15.8734  49.9621     15.3667  48.6317    5.92882     21.8878     5.92882     
1 1 1 23 21 56 o 17 16.1416 5.48644 -16.9877    13.2963  -8.14115    12.8251  0.380326   145.406     1.18879     325.406     
1 1 1 23 21 57 o 15 25.4646 7.80145 30.0689     22.0186  -2.18776    14.7366  7.76403    168.663     1.8609      168.663     
1 1 1 23 21 58 o 8  31.3772 8.13997 31.7814     17.2578  23.9773     16.4004  16.0785    228.721     7.32349     228.721     
1 1 1 23 21 59 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 21 60 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 22 0  o 14 11.5927 5.47201 -2.5229     8.69015  -2.5229     8.69015  26.7251    8.6515e-06  67.3086     8.6515e-06  
1 1 1 23 22 1  f 0  54.5931 4.29222 50.2738     11.5536  60.2134     11.4248  71.342     300.788     0           0           
1 1 1 23 22 2  o 4  62.9406 3.77684 74.5827     11.4286  70.3512     12.1265  46.2737    190.339     1.02193     190.339     
1 1 1 23 22 3  o 2  86.8493 3.14085 141.458     13.6118  131.324     13.6221  64.5166    326.473     0.158075    326.473     
1 1 1 23 22 4  o 9  67.2067 3.46682 89.2659     11.6987  75.3536     11.4446  45.9673    296.412     6.58778     116.412     
1 1 1 23 22 5  o 19 36.643  5.36118 26.099      9.52097  25.5763     9.51918  10.8506    331.806     29.2186     151.806     
1 1 1 23 22 6  o 10 47.1859 4.55027 38.3047     10.5549  45.0155     10.3085  29.8304    107.769     6.98447     287.769     
1 1 1 23 22 7  o 8  56.6289 3.88357 62.4259     10.8741  55.4619     10.857   47.1287    346.869     13.6901     346.869     
1 1 1 23 22 8  o 17 29.0221 5.77875 8.11972     9.00838  24.1671     9.65074  8.20441    271.937     20.9058     91.9369     
1 1 1 23 22 9  o 10 134.969 2.99474 332.794     21.2047  324.257     19.2294  106.275    179.526     10.3547     179.526     
1 1 1 23 22 10 o 18 25.3606 5.92573 6.40039     8.90662  16.5395     9.2817   8.70954    56.9568     1.46265     236.957     
1 1 1 23 22 11 o 17 38.5414 5.73693 36.3602     10.7073  21.9336     10.8286  19.5983    265.323     13.5965     85.3232     
1 1 1 23 22 12 o 7  184.85  3.0587  616.206     28.3353  616.62      28.3339  160.984    266.163     44.5971     266.163     
1 1 1 23 22 13 o 3  54.7015 4.44945 47.3621     11.7277  64.6791     11.9753  33.8894    162.319     11.0429     342.319     
1 1 1 23 22 14 o 7  17.2868 5.36909 -8.79463    9.40176  2.83625     9.26179  2.27422    148.044     19.1157     148.044     
1 1 1 23 22 15 o 15 99.1452 3.34164 181.318     16.1653  175.598     16.9192  76.3972    206.5       5.77837     206.5       
1 1 1 23 22 16 o 12 23.2638 6.15865 11.3175     9.80139  4.89792     9.89297  3.46195    146.439     19.8693     326.439     
1 1 1 23 22 17 o 13 38.4295 5.97019 28.4492     11.155   29.5982     11.212   22.9911    285.029     5.8557      105.029     
1 1 1 23 22 18 o 9  114.81  2.83136 244.049     16.2534  231.546     16.2686  100.679    119.926     31.1767     119.926     
1 1 1 23 22 19 o 10 30.3579 5.33743 31.385      9.48402  3.77771     9.2312   4.32955    6.08937     32.4795     186.089     
1 1 1 23 22 20 o 16 55.441  3.90874 58.2476     10.0636  55.2577     11.2739  21.9502    178.289     36.6309     358.289     
1 1 1 23 22 21 o 5  48.7215 4.18273 36.9198     9.44108  52.1587     10.458   26.864     7.50857     15.7235     187.509     
1 1 1 23 22 22 o 19 27.3014 5.69415 19.4232     8.28436  8.52334     9.30293  12.742     282.683     6.21719     102.683     
1 1 1 23 22 23 o 12 32.9607 5.57012 26.3508     8.73303  16.3034     9.71298  18.5594    301.694     5.51735     121.694     
1 1 1 23 22 24 o 13 39.7538 5.186   35.7011     9.22154  25.5642     10.44    26.2217    13.4835     1.46246     193.483     
1 1 1 23 22 25 o 11 72.2211 3.35243 94.6391     11.6409  95.8242     12.4801  47.1564    130.532     10.927      310.532     
1 1 1 23 22 26 o 13 83.1722 3.06384 123.526     12.7671  127.801     12.6808  87.0885    154.377     54.3593     154.377     
1 1 1 23 22 27 o 19 20.7207 5.48916 10.6468     8.13831  0.962988    8.05736  2.3419     309.138     0.461246    129.138     
1 1 1 23 22 28 o 5  57.8245 4.04843 56.068      11.735   68.69       11.2301  33.0999    269.325     17.1546     89.3246     
1 1 1 23 22 29 o 7  22.0742 5.74632 10.6859     8.34062  4.72534     8.75851  5.22239    125.483     15.8199     305.483     
1 1 1 23 22 30 o 16 46.748  4.36278 39.5536     9.86998  43.1786     10.0632  26.8363    36.2        12.668      216.2       
1 1 1 23 22 31 o 18 68.2024 3.61658 92.6154     12.8677  79.5933     11.6826  52.1501    119.469     5.87446     119.469     
1 1 1 23 22 32 o 14 70.5955 3.51558 101.486     12.5905  82.9924     12.0704  51.7331    38.4553     1.47823     38.4555     
1 1 1 23 22 33 o 2  62.5497 3.67694 66.2519     11.4127  79.489      11.3341  39.3812    162.179     11.2608     342.179     
1 1 1 23 22 34 o 10 20.8313 5.73098 7.38558     8.75201  5.39393     8.46226  2.14466    215.193     0.480905    215.193     
1 1 1 23 22 35 o 11 38.3336 5.47552 32.7461     10.0412  26.4218     10.2585  10.8725    197.619     32.0268     17.6193     
1 1 1 23 22 36 o 13 93.8122 3.18067 163.208     15.1943  160.855     14.6227  79.1755    264.411     22.8701     264.411     
1 1 1 23 22 37 o 16 54.1213 4.27181 69.6031     11.1641  43.7132     11.0158  44.1081    277.157     12.2303     277.157     
1 1 1 23 22 38 o 11 52.5512 4.27414 59.722      10.9383  46.6057     10.9728  24.1094    324.004     26.3827     144.004     
1 1 1 23 22 39 o 18 39.1569 5.3194  33.9755     10.0309  28.1692     10.0655  32.0675    177.043     12.5889     177.043     
1 1 1 23 22 40 o 3  17.5273 5.38266 2.65913     8.9869   -1.54536    8.6789   3.60624    328.088     7.13242     148.088     
1 1 1 23 22 41 o 3  35      6.11338 32.8018     11.024   19.6342     10.6692  11.8205    267.056     23.871      87.0559     
1 1 1 23 22 42 o 13 42.3301 5.68571 39.8954     12.0346  34.1754     11.2141  23.9636    263.315     9.85698     83.3147     
1 1 1 23 22 43 o 13 40.9843 5.72561 33.2413     11.4217  36.5581     11.2561  28.2444    288.96      1.90531     288.96      
1 1 1 23 22 44 o 7  29.104  6.58332 18.852      11.0153  18.0089     10.6856  15.495     206.12      3.89786     26.1198     
1 1 1 23 22 45 o 11 19.7006 5.70674 11.604      10.0677  -8.37581    9.96442  3.40631    333.587     1.30481     153.587     
1 1 1 23 22 46 o 9  28.5521 6.48805 12.5533     10.9452  22.3061     10.7321  11.8696    315.088     7.15607     315.088     
1 1 1 23 22 47 o 18 36.5724 6.19169 41.9201     11.5908  16.3406     12.2649  22.2253    48.3154     3.67973     228.315     
1 1 1 23 22 48 o 14 25.0089 6.57001 10.1045     11.1153  14.395      10.9829  13.9938    324.341     4.97448     324.341     
1 1 1 23 22 49 o 19 17.0935 5.50138 -6.76681    10.4708  -0.173178   10.4109  3.97427    132.239     5.28151     312.239     
1 1 1 23 22 50 o 13 46.2568 5.71202 45.9449     12.7853  43.8099     12.7307  31.6376    111.582     0.807606    111.582     
1 1 1 23 22 51 f 0  20.353  6.21628 -5.89234    12.3355  9.30487     11.9552  11.1658    272.54      0           0           
1 1 1 23 22 52 o 3  31.0982 7.74222 24.1938     14.7645  23.9138     15.2138  20.8927    81.2462     5.88947     81.2462     
1 1 1 23 22 53 o 10 53.9367 5.48106 57.163      14.3669  66.2352     14.3126  45.4244    225.231     19.0473     225.231     
1 1 1 23 22 54 o 19 20.5933 6.22293 11.255      12.0548  -2.25476    11.4631  5.88701    192.185     5.27463     12.1852     
1 1 1 23 22 55 o 14 50.5519 7.44849 62.1916     18.2254  64.845      18.289   46.2631    139.97      30.7537     139.97      
1 1 1 23 22 56 o 4  20.5608 7.09034 -40.7661    29.1292  -3.71974    21.315   3.70994    18.5002     5.35969     198.5       
1 1 1 23 22 57 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 22 58 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 23 0  o 9  9.4466  4.78292 -16.3469    10.5017  -16.3469    10.5017  5.09784    360         11.3058     360         
1 1 1 23 23 1  o 7  56.3007 3.8681  58.5773     10.6612  58.5773     10.6612  68.8006    30          55.0471     30          
1 1 1 23 23 2  o 17 12.4004 5.75733 -0.984422   8.9967   -0.984422   8.9967   1.92124    60          6.58629     60          
1 1 1 23 23 3  o 14 147.228 3.03373 388.744     22.3405  388.744     22.3405  121.955    90          20.5872     90          
1 1 1 23 23 4  o 19 18.8713 7.16489 9.62724     9.32801  9.62724     9.32801  3.44322    300         31.6157     300         
1 1 1 23 23 5  o 18 53.2243 4.22271 52.9488     10.8995  52.9488     10.8995  63.3524    330         48.422      330         
1 1 1 23 23 6  o 2  145.465 2.88237 379.106     20.9748  379.106     20.9748  152.157    180         83.8313     180         
1 1 1 23 23 7  o 18 43.5191 5.26153 37.1881     10.4688  37.1881     10.4688  28.9004    210         8.10816     30          
1 1 1 23 23 8  o 15 102.328 2.91134 188.11      14.8745  188.11      14.8745  98.8393    60          42.6988     60          
1 1 1 23 23 9  o 14 11.4829 5.45829 -3.17998    8.92302  -3.17998    8.92302  1.95315    89.9998     6.02555     89.9998     
1 1 1 23 23 10 o 9  56.4971 3.89847 59.0489     10.7799  59.0489     10.7799  36.5333    120         12.4155     300         
1 1 1 23 23 11 o 4  48.841  4.28815 44.9665     10.0603  44.9665     10.0603  49.3973    150         25.1775     150         
1 1 1 23 23 12 o 15 17.4343 6.88887 7.87812     8.99634  7.87812     8.99634  0.818932   360         20.0807     360         
1 1 1 23 23 13 o 12 22.5841 7.41116 13.8701     9.28511  13.8701     9.28511  4.71156    210         0.407431    29.9999     
1 1 1 23 23 14 o 1  13.1999 5.92007 1.53283     8.48404  1.53283     8.48404  4.10273    60          16.3928     60          
1 1 1 23 23 15 o 6  77.173  3.29759 107.953     12.6456  107.953     12.6456  75.7664    90          35.1698     90          
1 1 1 23 23 16 o 10 15.3889 6.76612 3.54197     10.5046  3.54197     10.5046  8.60452    120         36.0557     120         
1 1 1 23 23 17 o 14 64.3951 4.08471 76.6073     12.9261  76.6073     12.9261  54.448     150         11.9716     150         
1 1 1 23 23 18 o 3  118.363 3.10941 252.087     18.3862  252.087     18.3862  97.1061    5.961e-07   16.2293     5.961e-07   
1 1 1 23 23 19 o 11 58.2836 4.634   63.8962     13.0958  63.8962     13.0958  66.9833    30          46.5571     30          
1 1 1 23 23 20 o 6  18.3883 7.51622 8.44519     11.2194  8.44519     11.2194  0.103716   240         23.3739     240         
1 1 1 23 23 21 o 16 90.7824 3.88967 150.348     17.5457  150.348     17.5457  75.6682    270         15.2677     270         
1 1 1 23 23 22 o 11 12.928  5.87656 0.768368    8.70852  0.768368    8.70852  0.805362   300         4.70188     300         
1 1 1 23 23 23 o 7  30.9347 6.81523 22.0291     9.26033  22.0291     9.26033  21.2947    150         2.93504     330         
1 1 1 23 23 24 o 19 12.3563 5.65474 0.271391    8.24408  0.271391    8.24408  0.541494   180         3.12887     180         
1 1 1 23 23 25 o 2  64.598  3.5748  76.5893     11.405   76.5893     11.405   61.4843    30          26.6372     30          
1 1 1 23 23 26 o 15 60.6852 3.68319 67.941      11.0038  67.941      11.0038  41.0196    60          8.32957     240         
1 1 1 23 23 27 o 8  16.5852 6.60927 7.1974      8.36968  7.1974      8.36968  1.37321    90.0001     1.34177     270         
1 1 1 23 23 28 o 17 46.5047 4.53375 41.5645     9.995    41.5645     9.995    26.3818    120         16.2821     300         
1 1 1 23 23 29 o 1  108.226 2.92661 211.371     15.8201  211.371     15.8201  92.801     330         25.172      330         
1 1 1 23 23 30 o 2  58.5272 3.81789 63.6961     10.9671  63.6961     10.9671  50.5291    180         14.4408     180         
1 1 1 23 23 31 o 6  11.3479 5.34529 -1.79119    8.21813  -1.79119    8.21813  5.21257    210         21.0402     210         
1 1 1 23 23 32 o 5  14.6038 6.26867 4.37362     8.52949  4.37362     8.52949  3.81201    60          26.4093     60          
1 1 1 23 23 33 o 6  11.3865 5.37618 -1.9625     8.39871  -1.9625     8.39871  1.93076    90          9.89368     90          
1 1 1 23 23 34 o 12 14.9685 6.3788  4.91495     8.69977  4.91495     8.69977  0.859552   300         19.2892     300         
1 1 1 23 23 35 o 19 55.3332 4.44593 58.3996     11.918   58.3996     11.918   24.3937    330         32.3709     150         
1 1 1 23 23 36 o 4  10.9434 5.2751  -4.18446    8.93345  -4.18446    8.93345  3.58865    8.65809e-06 14.1561     8.65809e-06 
1 1 1 23 23 37 o 10 17.0516 7.01546 7.65906     9.87478  7.65906     9.87478  3.34334    30          3.39862     210         
1 1 1 23 23 38 o 12 53.4153 4.68099 55.0864     12.0129  55.0864     12.0129  43.3414    60          8.81052     60          
1 1 1 23 23 39 o 8  10.2333 5.04829 -7.7446     9.41244  -7.7446     9.41244  1.34739    89.9999     4.43701     89.9999     
1 1 1 23 23 40 o 15 63.0736 4.27787 75.2546     13.2179  75.2546     13.2179  26.2647    120         39.0279     300         
1 1 1 23 23 41 o 6  44.6416 5.96257 41.2212     11.9519  41.2212     11.9519  29.2606    150         6.13232     330         
1 1 1 23 23 42 o 8  79.9814 3.9334  119.011     15.5877  119.011     15.5877  73.6737    180         31.7719     180         
1 1 1 23 23 43 o 17 37.5432 7.25702 32.2537     11.8026  32.2537     11.8026  37.9478    30          24.4123     30          
1 1 1 23 23 44 o 1  24.3175 8.12254 17.4153     11.1896  17.4153     11.1896  13.6716    60          5.65111     240         
1 1 1 23 23 45 o 3  15.4009 6.76723 4.51879     10.4918  4.51879     10.4918  2.83033    90          5.84504     270         
1 1 1 23 23 46 o 2  14.5094 6.5996  2.13766     11.0057  2.13766     11.0057  0.378652   120         0.791978    300         
1 1 1 23 23 47 f 0  39.9523 7.71467 37.1339     13.3516  37.1339     13.3516  16.9597    150         0           0           
1 1 1 23 23 48 o 15 25.3994 9.19149 20.9279     14.8032  20.9279     14.8032  11.318     360         12.9136     180         
1 1 1 23 23 49 o 8  13.8098 6.46802 -0.273167   11.7508  -0.273167   11.7508  0.727925   30          5.59412     210         
1 1 1 23 23 50 o 6  75.7083 4.85512 111.129     18.0546  111.129     18.0546  70.6121    240         34.0264     240         
1 1 1 23 23 51 o 7  29.3513 10.2044 29.9543     17.8806  29.9543     17.8806  15.439     90          9.78984     270         
1 1 1 23 23 52 o 18 16.1533 7.563   2.22463     16.0435  2.22463     16.0435  0.831722   300         3.88585     120         
1 1 1 23 23 53 o 12 14.6868 7.0411  -1.9892     15.474   -1.9892     15.474   0.102916   150         1.73879     150         
1 1 1 23 23 54 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 23 23 55 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 0  0  o 18 16.4985 6.67048 6.14584     8.69474  6.14584     8.69474  13.3416    180         27.0793     180         
1 1 1 24 0  1  o 4  707.322 6.91126 8884.16     244.877  8884.16     244.877  599.978    60          163.518     60          
1 1 1 24 0  2  o 13 37.8829 4.21397 27.256      7.40905  27.256      7.40905  57.0351    300         136.952     300         
1 1 1 24 0  3  o 7  205.959 3.15713 752.903     32.5516  752.903     32.5516  146.737    180         8.19183     360         
1 1 1 24 0  4  o 18 178.814 2.80203 567.515     25.0814  567.515     25.0814  154.428    60          49.1502     60          
1 1 1 24 0  5  f 0  175.973 2.76213 549.622     24.3314  549.622     24.3314  114.216    120         0           0           
1 1 1 24 0  6  o 15 33.4745 5.00694 22.332      7.38904  22.332      7.38904  4.02881    180         9.31989     180         
1 1 1 24 0  7  o 12 74.2128 2.91856 98.5153     10.7771  98.5153     10.7771  16.1531    60          120.367     60          
1 1 1 24 0  8  o 5  176.757 2.95186 554.667     26.1147  554.667     26.1147  152.433    120         48.7137     120         
1 1 1 24 0  9  o 1  175.618 3.11719 547.685     27.3951  547.685     27.3951  129.044    360         2.05847     360         
1 1 1 24 0  10 o 6  514.205 5.51792 4693.51     142.117  4693.51     142.117  396.753    60          42.1012     60          
1 1 1 24 0  11 o 13 304.649 3.77051 1646.86     57.5255  1646.86     57.5255  264.026    300         83.1284     300         
1 1 1 24 0  12 o 3  406.563 4.86739 2933.98     99.1069  2933.98     99.1069  330.451    360         67.5165     360         
1 1 1 24 0  13 o 17 451.794 4.96392 3622.85     112.328  3622.85     112.328  408.633    240         158.32      240         
1 1 1 24 0  14 o 13 211.694 2.98629 795.265     31.6527  795.265     31.6527  214.84     120         122.965     120         
1 1 1 24 0  15 o 3  67.1133 2.60813 80.5495     8.711    80.5495     8.711    2.325      2.23097e-05 41.1258     2.23097e-05 
1 1 1 24 0  16 o 1  42.9536 3.68348 34.1239     7.61893  34.1239     7.61893  37.7252    60          99.1527     60          
1 1 1 24 0  17 o 16 380.57  3.94449 2569.61     75.1927  2569.61     75.1927  417.667    300         282.107     300         
1 1 1 24 0  18 o 13 224.498 2.75426 894.095     30.9659  894.095     30.9659  193.8      360         61.6027     360         
1 1 1 24 0  19 o 3  393.374 3.69712 2744.96     72.8546  2744.96     72.8546  306.057    240         41.4106     240         
1 1 1 24 0  20 o 16 391.134 3.69188 2713.83     72.3367  2713.83     72.3367  324.279    120         81.7163     120         
1 1 1 24 0  21 o 14 117.584 2.47233 245.693     14.5393  245.693     14.5393  29.8064    3.11575e-06 110.104     180         
1 1 1 24 0  22 o 15 546.585 4.98847 5302.63     136.591  5302.63     136.591  417.414    60          44.5394     60          
1 1 1 24 0  23 o 7  57.8999 3.11947 60.4552     8.92759  60.4552     8.92759  6.58266    300         72.5218     300         
1 1 1 24 0  24 o 3  328.04  3.56343 1909.29     58.5497  1909.29     58.5497  199.29     180         74.517      8.65146e-06 
1 1 1 24 0  25 o 1  47.6609 3.22794 41.3664     7.53713  41.3664     7.53713  1.38553    60.0002     12.9367     60.0003     
1 1 1 24 0  26 o 6  145.503 2.59223 375.968     18.8748  375.968     18.8748  12.9417    120         183.381     300         
1 1 1 24 0  27 o 18 211.464 2.72537 793.437     28.86    793.437     28.86    119.704    1.21234e-06 64.278      180         
1 1 1 24 0  28 o 6  327.879 3.39425 1907.33     55.7453  1907.33     55.7453  169.442    60          131.271     240         
1 1 1 24 0  29 o 19 85.0326 2.61341 128.89      11.0886  128.89      11.0886  45.5901    120         212.799     120         
1 1 1 24 0  30 o 14 496.4   4.41449 4373.58     109.779  4373.58     109.779  494.29     180         279.057     180         
1 1 1 24 0  31 o 7  238.675 2.74981 1010.64     32.8709  1010.64     32.8709  144.683    60          51.2075     240         
1 1 1 24 0  32 o 3  362.506 3.64549 2331.89     66.1962  2331.89     66.1962  293.913    300         71.4553     300         
1 1 1 24 0  33 o 2  137.943 2.46808 337.936     17.0369  337.936     17.0369  48.0518    180         100.03      8.81433e-06 
1 1 1 24 0  34 o 16 282.833 3.00512 1419.24     42.5726  1419.24     42.5726  144.761    240         111.891     60          
1 1 1 24 0  35 o 16 419.361 4.00294 3121.43     84.091   3121.43     84.091   362.574    300         131.099     300         
1 1 1 24 0  36 o 10 327.908 3.94055 1909.05     64.7123  1909.05     64.7123  281.354    0           99.1185     0           
1 1 1 24 0  37 o 6  74.0745 2.80105 98.1111     10.3296  98.1111     10.3296  27.3577    60          37.3337     240         
1 1 1 24 0  38 o 14 9.54294 4.52273 -2.33837    6.04399  -2.33837    6.04399  41.9773    120         85.6087     120         
1 1 1 24 0  39 f 0  225.046 2.94761 898.94      33.2174  898.94      33.2174  179.099    9.56165e-08 0           0           
1 1 1 24 0  40 o 11 126.802 2.62977 285.799     16.6786  285.799     16.6786  78.1527    60          21.3587     240         
1 1 1 24 0  41 o 8  268.673 3.26174 1281.44     43.888   1281.44     43.888   121.798    120         132.228     300         
1 1 1 24 0  42 o 11 114.931 2.80952 235.072     16.1379  235.072     16.1379  100.56     360         42.8392     360         
1 1 1 24 0  43 o 6  173.966 2.74131 537.488     23.8724  537.488     23.8724  121.954    60          1.68927     60          
1 1 1 24 0  44 o 17 94.5173 2.91056 159.35      13.7267  159.35      13.7267  85.5977    300         51.8977     300         
1 1 1 24 0  45 f 0  172.348 3.05015 527.946     26.307   527.946     26.307   129.082    180         0           0           
1 1 1 24 0  46 o 11 109.108 2.90397 212.09      15.8274  212.09      15.8274  107.477    240         66.3963     240         
1 1 1 24 0  47 o 8  258.073 3.48994 1183.76     45.0985  1183.76     45.0985  193.203    120         30.6391     120         
1 1 1 24 0  48 o 5  109.395 2.89155 213.246     15.8018  213.246     15.8018  74.4118    180         1.57304     8.68616e-06 
1 1 1 24 0  49 f 0  27.8447 7.02313 18.24       8.93775  18.24       8.93775  4.45269    60.0001     0           0           
1 1 1 24 0  50 o 9  24.3889 6.9944  14.7838     8.36804  14.7838     8.36804  23.3217    120         66.7921     120         
1 1 1 24 0  51 o 5  70.6655 3.30362 89.8668     11.5802  89.8668     11.5802  49.9631    180         5.6866      180         
1 1 1 24 0  52 o 14 93.4815 2.84429 156.035     13.2685  156.035     13.2685  48.6521    60          29.8105     240         
1 1 1 24 0  53 f 0  49.8882 4.11742 46.0833     9.92795  46.0833     9.92795  36.2643    300         0           0           
1 1 1 24 0  54 o 13 86.2905 3.17653 133.444     13.651   133.444     13.651   40.3708    3.25876e-07 35.9058     180         
1 1 1 24 0  55 o 16 71.7068 3.23518 92.5539     11.5158  92.5539     11.5158  61.7804    240         34.9342     240         
1 1 1 24 0  56 o 6  80.6597 2.95908 116.595     11.8873  116.595     11.8873  67.853     300         27.6776     300         
1 1 1 24 0  57 o 18 91.9208 2.97921 151.215     13.658   151.215     13.658   31.2913    180         60.5447     8.65141e-06 
1 1 1 24 0  58 o 12 122.774 2.65833 268.706     16.3212  268.706     16.3212  116.463    60          68.9929     60          
1 1 1 24 0  59 o 5  88.3921 3.22899 140.283     14.2158  140.283     14.2158  80.7079    120         43.7735     120         
1 1 1 24 0  60 o 19 114.74  2.86736 235.231     16.4408  235.231     16.4408  87.6991    1.9587e-07  23.1886     1.9587e-07  
1 1 1 24 0  61 o 2  10.6725 5.02396 -2.0504     7.23997  -2.0504     7.23997  12.1307    60          29.0419     60          
1 1 1 24 0  62 o 17 30.8702 6.21217 20.8373     8.3253   20.8373     8.3253   8.78647    120         2.53701     120         
1 1 1 24 0  63 o 11 89.0774 3.3651  142.947     14.9234  142.947     14.9234  56.9414    360         3.08491     180         
1 1 1 24 0  64 f 0  219.335 2.93768 859.021     32.2642  859.021     32.2642  124.312    60          0           0           
1 1 1 24 0  65 o 16 39.541  5.27413 30.9871     9.36631  30.9871     9.36631  13.3811    120         24.7058     300         
1 1 1 24 0  66 o 13 152.242 2.94589 414.623     22.4375  414.623     22.4375  115.685    360         33.5882     360         
1 1 1 24 0  67 o 10 13.9488 5.71748 4.46048     6.52013  4.46048     6.52013  0.622909   240         2.49063     240         
1 1 1 24 0  68 o 7  16.9551 6.94623 6.83934     9.61611  6.83934     9.61611  0.18778    120         2.95235     300         
1 1 1 24 0  69 o 9  58.8583 4.20476 64.3637     12.0892  64.3637     12.0892  41.3208    180         7.02803     180         
1 1 1 24 0  70 o 14 12.2813 5.57972 0.6285      7.83804  0.6285      7.83804  2.62405    240         10.1378     240         
1 1 1 24 0  71 o 18 21.3387 7.61578 12.7951     10.0823  12.7951     10.0823  0.270452   120         26.6135     120         
1 1 1 24 0  72 o 1  13.8072 6.49276 -2.19386    12.0388  -2.19386    12.0388  1.41936    180         9.28149     180         
1 1 1 24 0  73 o 10 14.8258 6.53622 3.37533     9.87035  3.37533     9.87035  1.58749    240         13.2247     240         
1 1 1 24 0  74 o 1  29.9156 8.33208 23.4465     11.9909  23.4465     11.9909  18.7764    120         5.46428     120         
1 1 1 24 0  75 o 8  13.1967 6.20197 -1.84062    10.9569  -1.84062    10.9569  12.4294    360         37.8502     360         
1 1 1 24 0  76 o 16 19.2434 7.90625 9.81174     12.5139  9.81174     12.5139  1.06657    60          2.59282     240         
1 1 1 24 0  77 o 14 16.1746 7.17531 4.11189     12.0899  4.11189     12.0899  0.257373   120         9.898       120         
1 1 1 24 0  78 o 2  14.8748 6.92807 -0.595073   13.1864  -0.595073   13.1864  0.668474   180         10.6881     180         
1 1 1 24 0  79 o 13 14.5527 6.84063 -1.68367    13.3413  -1.68367    13.3413  0.0240154  240         2.99467     60          
1 1 1 24 0  80 o 19 28.6397 9.28148 24.1612     14.5405  24.1612     14.5405  17.0504    300         6.88601     300         
1 1 1 24 0  81 o 16 12.8367 6.21224 -5.79401    12.6583  -5.79401    12.6583  0.788596   180         3.65037     180         
1 1 1 24 0  82 o 8  61.6838 6.67018 78.5078     19.1893  78.5078     19.1893  52.0379    60          29.0378     60          
1 1 1 24 0  83 o 15 13.6747 6.46956 -1.66191    12.2705  -1.66191    12.2705  0.518086   120         1.92738     120         
1 1 1 24 0  84 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 1  0  o 19 418.548 4.2968  3108.09     90.0834  3108.09     90.0834  249.526    1.30894e-05 114.792     180         
1 1 1 24 1  1  o 8  201.877 2.87199 721.409     29.033   723.698     29.0783  132.368    205.825     13.8045     25.8246     
1 1 1 24 1  2  o 6  133.433 2.50925 319.227     16.7732  312.466     16.754   46.7402    32.5504     81.6354     212.55      
1 1 1 24 1  3  o 16 673.579 6.54097 8045.07     220.79   8086.69     220.801  482.83     327.211     16.9617     147.211     
1 1 1 24 1  4  o 5  375.158 4.32617 2511.59     85.7407  2483.24     76.7279  201.391    149.373     139.868     329.373     
1 1 1 24 1  5  o 7  109.625 2.8664  216.591     15.7317  210.154     15.7063  45.5657    132.809     32.4374     312.809     
1 1 1 24 1  6  o 14 214.067 3.23425 820.381     34.6811  804.874     34.7089  63.9889    266.236     175.175     86.2358     
1 1 1 24 1  7  o 9  47.1736 3.71143 43.2722     8.57778  36.7837     8.61534  24.4892    84.8961     70.0055     84.8961     
1 1 1 24 1  8  o 13 337.001 3.94888 2038.98     68.451   1990.82     64.9186  267.006    353.81      52.201      353.81      
1 1 1 24 1  9  o 8  360.609 3.74944 2322.51     67.7442  2291.05     67.7703  256.383    311.39      5.50275     131.391     
1 1 1 24 1  10 o 12 173.908 2.59426 545.758     22.0704  526.667     23.1129  103.336    291.421     28.4284     111.421     
1 1 1 24 1  11 o 18 313.747 3.31542 1767.3      51.0383  1724.37     53.1655  194.396    144.938     60.1927     324.938     
1 1 1 24 1  12 o 19 210.703 2.7914  796.779     28.2336  777.575     30.6347  176.331    117.255     68.106      117.255     
1 1 1 24 1  13 o 13 212.591 2.91093 813.299     29.5899  789.533     32.3287  187.191    58.9833     156.189     58.9833     
1 1 1 24 1  14 o 1  319.285 3.73892 1790.12     56.798   1827.04     62.76    225.439    200.642     4.83081     20.6417     
1 1 1 24 1  15 o 14 134.642 2.47364 328.415     15.9996  314.663     17.3045  19.4638    325.349     143.341     145.349     
1 1 1 24 1  16 o 7  335.933 3.51454 1996.24     56.6672  2007.43     61.5785  193.562    348.786     94.7719     168.786     
1 1 1 24 1  17 o 6  450.12  4.42078 3614.86     99.7612  3578.31     99.6799  351.293    161.721     54.4364     161.721     
1 1 1 24 1  18 o 10 69.5054 3.04051 92.2822     9.88447  79.9441     11.0299  18.6438    212.183     115.767     212.183     
1 1 1 24 1  19 o 9  393.501 4.22539 2786.08     79.0239  2711.04     87.2936  291.882    83.9227     18.8933     83.9227     
1 1 1 24 1  20 o 13 397.729 4.25407 2842.52     80.4146  2773.66     88.8438  374.362    234.643     180.383     234.643     
1 1 1 24 1  21 o 5  370.41  4.02455 2453.15     70.8799  2417.2      78.2904  247.111    127.364     37.0628     307.364     
1 1 1 24 1  22 o 18 71.5609 2.96509 86.8189     10.4184  95.5487     10.7499  16.9325    299.421     41.0298     119.421     
1 1 1 24 1  23 f 0  322.779 3.64191 1852.34     55.9351  1845.14     61.7314  205.719    36.7867     0           0           
1 1 1 24 1  24 o 5  330.477 3.73667 1957.06     57.2679  1919.46     66.0949  183.22     359.144     105.942     179.144     
1 1 1 24 1  25 o 12 224.527 2.82195 895.545     30.3106  892.572     33.1269  137.929    216.629     40.2133     36.6287     
1 1 1 24 1  26 o 3  350.044 3.66213 2184.02     59.9014  2165.14     68.2701  283.101    311.468     68.6126     311.468     
1 1 1 24 1  27 o 5  98.1341 2.54569 178.254     11.7138  163.894     13.161   19.8347    75.4755     171.587     75.4755     
1 1 1 24 1  28 o 5  195.686 2.75283 669.279     26.4535  689.095     27.5392  133.535    11.8096     3.82928     191.81      
1 1 1 24 1  29 o 13 251.627 3.06047 1128.86     38.5792  1117.65     38.6055  220.245    333.966     90.4443     333.966     
1 1 1 24 1  30 o 13 318.071 3.48949 1792.89     55.6104  1798.18     55.6335  255.141    294.442     62.2319     294.442     
1 1 1 24 1  31 o 11 143.594 2.77093 356.9       20.3317  375.221     19.4701  92.2466    249.115     6.7463      69.1146     
1 1 1 24 1  32 o 14 128.025 2.86426 285.928     17.3592  296.204     19.3252  97.4589    108.588     35.0118     108.588     
1 1 1 24 1  33 o 13 223.948 2.9566  892.773     32.3502  886.77      33.9872  120.568    85.0692     70.7276     265.069     
1 1 1 24 1  34 o 19 242.879 3.09666 1068.47     36.7435  1025.22     38.5673  116.005    48.2658     107.208     228.266     
1 1 1 24 1  35 o 18 178.631 2.88015 560.247     25.1633  571.992     26.3985  117.089    217.183     8.9205      37.1829     
1 1 1 24 1  36 o 7  241.904 3.22953 996.804     38.0101  1081.19     40.303   171.704    207.988     8.63354     207.988     
1 1 1 24 1  37 o 1  106.528 2.67085 202.341     13.8567  200.785     14.6021  32.6633    91.5977     73.6412     271.598     
1 1 1 24 1  38 o 18 131.673 2.66872 311.196     17.1416  304.481     18.0196  53.0173    128.503     70.1443     308.503     
1 1 1 24 1  39 o 8  312.313 3.40652 1722.42     50.811   1741.54     55.7336  249.123    94.0189     64.978      94.0189     
1 1 1 24 1  40 o 5  214.402 2.85228 810.664     29.1582  820.95      32.0823  189.335    10.5741     87.8369     10.5741     
1 1 1 24 1  41 f 0  217.532 3.04627 856.565     30.6107  823.83      35.5182  141.186    266.901     0           0           
1 1 1 24 1  42 o 19 224.635 2.94219 894.814     31.517   896.996     34.6546  153.285    208.586     1.93807     28.5865     
1 1 1 24 1  43 o 13 182.571 2.78219 591.144     25.4004  592.358     25.5104  145.292    348.675     43.2611     348.675     
1 1 1 24 1  44 o 3  129.398 2.63662 290.764     16.2135  304.284     17.9347  33.9764    35.4398     107.206     215.44      
1 1 1 24 1  45 o 2  179.884 2.76758 588.504     24.9154  561.036     24.9706  130.941    293.113     18.0842     293.113     
1 1 1 24 1  46 o 16 92.0424 2.74185 147.948     12.8424  153.585     12.3784  56.4978    205.163     3.84532     25.1631     
1 1 1 24 1  47 o 5  251.711 3.25664 1112.19     43.0049  1141.91     38.9974  225.417    290.246     108.508     290.246     
1 1 1 24 1  48 o 5  145.767 2.64038 361.512     19.6897  394.201     18.7885  96.7714    48.6155     1.44223     228.615     
1 1 1 24 1  49 o 13 231.778 3.16591 945.472     36.7326  966.844     36.8111  178.108    335.402     41.8871     335.402     
1 1 1 24 1  50 f 0  66.591  3.33796 87.7282     10.8521  71.4794     11.1506  62.7695    41.4763     0           0           
1 1 1 24 1  51 f 0  115.544 2.89347 242.39      15.9004  233.518     17.4818  87.5204    311.979     0           0           
1 1 1 24 1  52 o 13 166.032 2.77731 486.164     22.4348  495.355     23.7741  99.3556    206.435     23.6654     26.435      
1 1 1 24 1  53 o 17 84.8155 2.73174 124.925     11.4956  131.85      11.6632  56.7596    348.914     7.51216     348.914     
1 1 1 24 1  54 o 12 36.2555 4.81809 25.7598     8.66029  23.1196     8.20827  0.560623   192.941     32.1368     12.9407     
1 1 1 24 1  55 o 1  74.5647 3.05447 105.289     11.7976  93.9932     10.9372  42.8871    247.68      7.64614     67.6804     
1 1 1 24 1  56 o 9  38.9605 4.71008 30.5399     8.87414  25.8102     8.82718  13.1759    134.219     13.8477     314.219     
1 1 1 24 1  57 o 10 61.1265 3.37688 77.7477     10.2982  57.6081     10.0675  49.6031    286.143     26.7871     286.143     
1 1 1 24 1  58 o 19 148.64  2.66143 389.714     19.9018  399.24      19.7263  108.076    253.38      19.6042     253.38      
1 1 1 24 1  59 o 7  69.4268 3.25242 81.0796     11.8046  92.7        10.5234  48.1417    343.152     8.39347     343.152     
1 1 1 24 1  60 o 10 23.0267 5.67977 8.08494     8.03894  9.66837     8.08775  0.0473014  301.176     19.0713     121.176     
1 1 1 24 1  61 o 6  42.6175 4.58451 22.1031     9.13096  47.6896     8.78234  18.6196    286.55      13.7218     106.55      
1 1 1 24 1  62 o 16 104.537 2.79059 190.147     14.5898  202.153     14.5852  77.5929    246.023     19.9921     246.023     
1 1 1 24 1  63 o 6  26.8613 5.67114 9.96425     8.64805  16.9461     8.17185  3.04319    345.442     36.2714     345.442     
1 1 1 24 1  64 o 17 71.2455 3.2277  90.735      11.5198  92.9088     11.4042  36.3264    202.721     18.0639     22.7208     
1 1 1 24 1  65 o 10 58.5916 3.56493 62.0761     10.4995  63.0554     10.227   36.9136    115.395     1.19972     115.395     
1 1 1 24 1  66 o 7  94.4543 2.99476 159.671     14.7288  162.215     13.5107  69.1527    172.472     17.8998     172.472     
1 1 1 24 1  67 o 11 35.9755 5.34672 10.3292     10.8648  40.4036     8.71742  5.91845    230.581     31.5136     50.5811     
1 1 1 24 1  68 o 1  33.1419 5.4332  24.9895     10.4978  18.1666     7.23833  17.4788    26.7996     1.9604      206.8       
1 1 1 24 1  69 o 1  50.5846 4.96332 39.8697     13.1384  58.0676     9.90689  29.7438    26.8041     2.47497     206.804     
1 1 1 24 1  70 o 2  19.991  5.97729 4.87994     12.5023  1.02994     7.84291  4.0423     236.576     5.22766     56.5761     
1 1 1 24 1  71 o 17 36.2748 5.95261 24.7626     11.3819  28.184      9.88636  16.6534    96.3871     9.11726     276.387     
1 1 1 24 1  72 o 12 14.8804 4.88748 -2.01676    9.65035  -10.6779    7.75763  7.51255    131.861     28.7693     131.861     
1 1 1 24 1  73 o 7  51.6642 5.64784 48.7122     15.5949  57.0844     11.9283  32.638     219.176     3.2613      219.176     
1 1 1 24 1  74 o 8  48.1687 5.91498 54.612      14.344   39.4615     13.1233  31.5576    106.069     6.74497     106.069     
1 1 1 24 1  75 f 0  35.3433 7.26191 26.5429     13.4096  27.6316     13.8392  37.8606    8.07798     0           0           
1 1 1 24 1  76 o 5  23.5438 6.84394 10.5608     14.5561  4.10037     11.319   6.44891    91.0934     5.29304     271.093     
1 1 1 24 1  77 o 9  23.1488 6.49147 -6.01089    13.6579  14.6604     11.4221  7.30007    345.029     1.81394     165.029     
1 1 1 24 1  78 o 16 61.9252 5.50378 74.0542     17.2152  78.2078     16.0945  45.9743    5.30872     18.1887     5.30872     
1 1 1 24 1  79 o 16 19.9209 6.167   -3.12014    12.2505  3.88439     11.5191  1.87959    249.673     0.620195    69.6731     
1 1 1 24 1  80 o 15 23.6673 6.75469 7.30412     13.1736  10.0797     11.6863  1.28357    256.22      0.324717    256.22      
1 1 1 24 1  81 o 18 20.5852 6.32894 -0.610081   12.0825  5.72374     12.4252  3.3976     117.315     6.82033     297.315     
1 1 1 24 1  82 o 13 41.3984 8.13085 45.9536     20.2078  39.7659     14.9363  26.659     292.633     14.0612     292.633     
1 1 1 24 1  83 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 1  84 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 2  0  o 8  471.522 4.70991 3945.43     111.245  3945.43     111.245  449.262    180         206.348     180         
1 1 1 24 2  1  f 0  404.385 4.25255 2919.67     88.2213  2884.23     84.1117  247.958    73.8388     0           0           
1 1 1 24 2  2  o 14 241.085 3.31869 1005.8      41.1129  1056.1      38.98    117.474    65.4975     107.978     245.497     
1 1 1 24 2  3  o 17 342.473 3.91745 2058.03     70.482   2103.87     63.7357  231.275    187.57      30.7111     7.57047     
1 1 1 24 2  4  f 0  436.401 4.21687 3395.56     90.1822  3363.64     94.198   315.477    341.934     0           0           
1 1 1 24 2  5  o 13 228.224 2.89706 945.159     34.6318  902.194     31.6254  193.433    145.03      72.7795     145.03      
1 1 1 24 2  6  o 1  249.562 3.00866 1104.53     38.4565  1104.26     36.7812  150.876    174.164     52.1533     354.164     
1 1 1 24 2  7  o 2  374.559 3.59576 2485.3      67.4928  2491.97     67.4973  268.569    162.543     3.03288     342.543     
1 1 1 24 2  8  o 13 535.202 4.64457 5097.22     126.858  5072.97     122.255  366.571    187.488     45.3764     7.48844     
1 1 1 24 2  9  o 7  112.851 2.42409 217.683     14.1804  234.423     13.1324  14.6057    5.58304     117.441     185.583     
1 1 1 24 2  10 o 4  131.252 2.29797 303.306     15.3684  307.652     14.8398  74.8211    38.9491     43.9493     38.9491     
1 1 1 24 2  11 o 7  136.67  2.37814 333.588     16.2429  328.675     16.3319  85.1506    244.665     2.73589     64.6648     
1 1 1 24 2  12 o 9  369.401 3.60806 2438.12     66.7779  2403.4      66.8054  176.382    350.018     181.442     170.018     
1 1 1 24 2  13 o 10 459.714 4.49449 3803.18     101.215  3700.68     105.748  332.955    339.257     0.332532    339.256     
1 1 1 24 2  14 o 7  337.531 3.4426  2051.25     57.0111  1990.77     59.3829  221.717    89.3205     41.9675     269.32      
1 1 1 24 2  15 o 10 153.075 2.75555 410.014     20.0034  421.284     22.2215  100.533    215.903     3.69134     35.9031     
1 1 1 24 2  16 o 17 143.231 2.74736 370.034     19.8383  358.075     19.5652  40.8896    194.325     115.473     14.3253     
1 1 1 24 2  17 o 7  446.484 4.76219 3538.57     103.744  3542.09     109.295  339.164    318.98      33.5584     318.98      
1 1 1 24 2  18 o 15 328.814 3.71987 1927.35     61.3098  1909.6      61.2832  234.352    255.371     3.13542     75.3713     
1 1 1 24 2  19 o 10 213.859 2.99424 803.535     30.5262  818.771     33.607   137.263    291.075     27.4988     111.075     
1 1 1 24 2  20 o 3  323.85  3.67861 1872.2      59.732   1849.98     59.6706  280.095    15.5205     97.366      15.5205     
1 1 1 24 2  21 o 2  264.051 3.17343 1237.91     41.0511  1235.66     42.9126  214.966    292.279     55.4582     292.279     
1 1 1 24 2  22 o 17 313.785 3.39039 1761.7      52.1639  1732.17     54.4184  225.824    120.144     3.18026     120.144     
1 1 1 24 2  23 o 15 238.833 2.81376 1000.87     33.7166  1022.45     33.6351  201.306    312.028     67.209      312.028     
1 1 1 24 2  24 o 2  102.672 2.40737 188.811     12.4321  185.426     12.307   64.4999    198.792     6.73359     198.792     
1 1 1 24 2  25 o 9  101.034 2.4715  178.585     12.2958  183.876     12.6947  33.5768    33.7946     64.0918     213.795     
1 1 1 24 2  26 o 7  130.197 2.51161 301.077     16.0747  300.556     16.6639  105.052    295.518     48.3412     295.518     
1 1 1 24 2  27 o 19 119.987 2.495   267.291     14.7231  244.012     15.1999  56.1026    195.69      46.7777     15.6903     
1 1 1 24 2  28 o 14 204.597 2.77846 750.937     27.8876  734.047     29.0603  93.0089    107.275     100.923     287.275     
1 1 1 24 2  29 o 6  84.6271 2.62716 124.134     10.9216  130.427     11.3088  41.002     63.2573     3.2379      63.2574     
1 1 1 24 2  30 o 12 184.642 2.6939  589.097     24.4372  620.494     25.4203  171.777    328.843     97.4805     328.843     
1 1 1 24 2  31 o 18 82.7258 2.7866  121.791     11.8585  121.548     11.1701  24.4687    338.331     49.7855     158.331     
1 1 1 24 2  32 o 1  208.372 2.79533 768.399     27.7866  772.046     30.5347  193.205    177.775     103.823     177.775     
1 1 1 24 2  33 o 6  114.275 2.50171 228.516     13.7824  235.163     14.8303  56.9808    219.943     34.1516     39.9429     
1 1 1 24 2  34 o 19 262.239 3.06859 1213.26     37.6802  1227.39     42.8369  167.621    150.686     31.3745     330.686     
1 1 1 24 2  35 o 7  138.774 2.60595 343.064     17.859   340.63      18.3501  83.4125    239.393     17.9917     59.3925     
1 1 1 24 2  36 o 2  238.607 3.05396 985.096     34.8164  1036        38.2087  188.022    265.552     46.3029     265.552     
1 1 1 24 2  37 o 19 196.839 2.76931 686.078     27.3311  688.83      27.3039  122.331    147.728     26.0092     327.728     
1 1 1 24 2  38 o 14 264.112 3.03184 1226.02     39.2262  1250.3      41.0259  222.321    120.256     79.5568     120.256     
1 1 1 24 2  39 o 8  335.796 3.41622 1999.13     57.4708  2006.33     57.5065  273.405    207.271     79.1615     207.271     
1 1 1 24 2  40 o 9  52.5544 3.43912 49.155      9.04831  49.8144     8.85861  8.86341    2.27784     12.107      182.278     
1 1 1 24 2  41 o 18 221.1   2.7413  867.943     30.3302  867.544     30.4183  176.638    351.131     49.6495     351.131     
1 1 1 24 2  42 o 4  155.737 2.61969 430.838     20.9029  430.186     19.9787  96.3288    243.994     19.047      63.9937     
1 1 1 24 2  43 o 3  241.069 2.94451 1025.75     34.7324  1038.74     36.4023  196.94     155.326     62.5198     155.326     
1 1 1 24 2  44 o 9  111.032 2.62289 216.413     14.5219  221.91      14.6255  59.9779    338.602     27.1904     158.602     
1 1 1 24 2  45 f 0  71.1411 3.02993 95.4654     10.3325  85.2447     11.0849  85.7106    148.604     0           0           
1 1 1 24 2  46 o 1  101.751 2.71533 182.66      14.0471  185.771     13.5863  90.0306    77.8245     64.809      77.8245     
1 1 1 24 2  47 o 19 117.869 2.66593 255.314     16.0192  239.101     15.4363  74.0903    206.473     7.89236     26.4735     
1 1 1 24 2  48 o 11 45.1541 3.89919 35.0654     8.48916  38.794      8.78566  2.81231    265.801     44.1077     85.8005     
1 1 1 24 2  49 o 13 209.486 2.80446 788.802     30.099   772.566     28.7809  148.836    130.398     13.4076     130.398     
1 1 1 24 2  50 o 9  32.8707 5.22825 28.5533     8.88896  12.5452     8.31083  0.0188542  263.736     19.535      263.735     
1 1 1 24 2  51 o 17 22.6961 5.47947 5.4893      7.72424  11.1702     7.55812  3.35074    171.078     10.5148     171.078     
1 1 1 24 2  52 o 6  168.324 2.72616 485.28      22.8503  524.229     23.1263  112.737    109.015     0.00111473  109.179     
1 1 1 24 2  53 o 13 190.794 2.79284 658.281     25.4845  639.186     27.8307  161.001    186.561     67.3501     186.561     
1 1 1 24 2  54 o 8  41.7798 4.31673 27.5174     8.25609  36.8548     9.25922  14.3275    309.458     11.4854     129.458     
1 1 1 24 2  55 o 4  20.5495 5.39516 1.54618     6.89068  9.92115     8.35527  18.4923    258.544     55.2962     258.544     
1 1 1 24 2  56 o 4  76.2661 2.99142 106.27      11.6253  102.221     11.1526  59.997     23.6755     23.0135     23.6755     
1 1 1 24 2  57 o 15 81.0016 2.93095 121.206     12.1213  114.028     11.5968  62.5497    84.171      20.9602     84.171      
1 1 1 24 2  58 o 7  81.1622 2.93808 115.775     11.8719  120.58      11.9466  53.8903    46.7771     2.74381     46.7772     
1 1 1 24 2  59 o 15 51.1502 4.25937 41.7206     11.018   54.7196     9.99391  25.0758    67.5016     13.3521     247.502     
1 1 1 24 2  60 o 6  24.2543 5.39836 17.6282     8.11754  0.734094    8.61059  3.12292    216.608     3.8938      36.6076     
1 1 1 24 2  61 o 10 64.4102 3.52101 72.6578     11.8993  77.915      10.5408  48.8303    72.409      17.4559     72.409      
1 1 1 24 2  62 o 17 29.0678 5.60457 14.6874     8.63164  17.6982     8.20939  3.79912    261.715     24.7238     81.7147     
1 1 1 24 2  63 o 14 100.084 3.07812 188.024     16.7523  173.251     14.0173  68.2421    283.174     7.12827     283.174     
1 1 1 24 2  64 o 11 30.0376 5.66858 17.4835     8.9302   17.4068     8.45599  12.9822    347.747     1.52815     167.747     
1 1 1 24 2  65 o 4  32.168  5.50338 17.8956     9.00309  22.2061     8.60545  16.2129    23.1893     5.27547     23.1893     
1 1 1 24 2  66 o 19 104.022 2.92788 172.636     15.6726  219.016     14.4394  69.5341    32.131      5.43354     32.1311     
1 1 1 24 2  67 o 10 21.2982 5.5028  1.69335     9.02453  10.5532     7.29206  1.41701    350.288     18.4745     170.288     
1 1 1 24 2  68 o 11 27.1959 5.92584 19.2649     10.2897  9.92041     7.64596  10.2568    246.594     8.4914      66.594      
1 1 1 24 2  69 o 1  49.0754 4.43148 51.7757     12.2454  39.5286     9.09371  25.8097    245.849     8.84154     65.8492     
1 1 1 24 2  70 o 10 20.0177 6.07484 3.23611     12.9504  0.793517    8.68631  2.76412    125.145     12.7528     305.145     
1 1 1 24 2  71 o 19 50.4431 6.25916 49.8082     18.0147  52.6901     11.5483  22.6975    156.134     16.4782     336.134     
1 1 1 24 2  72 o 1  25.651  6.78877 4.59325     16.459   14.3365     9.20638  7.27666    153.516     12.1089     333.516     
1 1 1 24 2  73 o 17 38.1618 7.06385 17.5924     18.6934  41.7036     11.9218  18.5479    358.054     6.72796     178.054     
1 1 1 24 2  74 o 19 35.0126 7.3788  33.1199     15.5938  20.8414     12.3878  19.5906    225.385     2.81331     225.385     
1 1 1 24 2  75 o 10 27.556  6.55765 -4.13053    14.6495  25.5776     11.6738  10.1861    195.234     6.52753     15.234      
1 1 1 24 2  76 o 17 24.3576 6.61524 0.845289    12.7629  15.8205     11.5079  8.5847     293.404     2.31967     113.404     
1 1 1 24 2  77 o 12 27.0444 6.99239 15.7656     13.3632  12.7752     11.3317  10.5076    174.835     6.97151     354.835     
1 1 1 24 2  78 o 1  31.0891 7.10406 20.655      13.4424  21.0889     11.8493  15.2776    197.796     2.46103     17.7959     
1 1 1 24 2  79 o 17 42.239  6.87533 36.0872     15.0344  41.8322     13.5387  32.0258    11.6512     20.274      11.6512     
1 1 1 24 2  80 o 17 26.2058 6.9925  10.7796     13.0727  16.5904     12.3072  9.23585    187.588     6.21358     7.58764     
1 1 1 24 2  81 o 16 29.697  7.53701 21.8545     14.4533  19.3447     14.0907  10.39      10.4178     3.74458     10.4178     
1 1 1 24 2  82 o 6  37.1296 7.55642 24.0284     15.2805  43.6896     15.5269  20.6139    58.8357     5.7001      58.8357     
1 1 1 24 2  83 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 3  0  o 11 174.525 2.78975 540.7       24.3715  540.7       24.3715  167.422    7.58228e-06 81.6937     7.58228e-06 
1 1 1 24 3  1  o 13 311.108 3.59642 1728.29     56.0759  1705.72     56.0654  239.505    257.024     32.5478     257.024     
1 1 1 24 3  2  o 14 96.5295 2.65914 175.238     12.1678  155.957     13.3755  38.2439    86.1693     5.47008     266.169     
1 1 1 24 3  3  o 10 197.713 2.87718 702.111     26.4132  684.242     30.4067  121.874    44.0373     32.356      224.037     
1 1 1 24 3  4  o 3  94.6345 2.47522 168.289     11.2372  149.949     12.1028  4.68447    175.069     108.926     355.069     
1 1 1 24 3  5  o 3  233.781 2.78525 963.587     32.6222  974.57      32.6396  153.213    301.488     24.8222     121.488     
1 1 1 24 3  6  o 9  355.433 3.67648 2235.77     65.482   2246.79     65.4905  269.94     307.373     26.7098     307.373     
1 1 1 24 3  7  o 14 153.329 2.45869 417.74      19.2641  415.848     18.5152  87.7197    11.6093     31.8263     191.609     
1 1 1 24 3  8  o 4  268.547 2.91162 1295.77     38.4291  1262.01     39.9016  176.957    171.841     30.3121     351.841     
1 1 1 24 3  9  o 3  179.538 2.45739 572.108     21.6829  570.821     22.5283  83.425     244.575     84.6328     64.5747     
1 1 1 24 3  10 o 12 253.33  2.8151  1122.55     35.0455  1153.5      36.4325  108.658    302.443     146.505     122.443     
1 1 1 24 3  11 o 9  422.421 4.1843  3168.98     90.4766  3165.43     86.6412  304.819    63.9485     3.10345     243.949     
1 1 1 24 3  12 o 11 211.974 3.0502  782.01      32.4306  811.904     32.3636  138.434    110.498     22.3931     290.498     
1 1 1 24 3  13 o 9  362.922 3.8826  2309.28     70.6288  2365.57     70.5929  306.427    140.298     89.7689     140.298     
1 1 1 24 3  14 o 19 100.406 2.55165 176.82      12.8805  181.142     12.753   2.41915    323.783     129.375     143.783     
1 1 1 24 3  15 o 4  373.564 4.07999 2475.76     76.4189  2478.28     76.3428  366.1      151.981     195.479     151.981     
1 1 1 24 3  16 f 0  139.451 2.77364 342.82      18.439   347.431     20.2578  149.651    237.425     0           0           
1 1 1 24 3  17 o 13 383.078 4.18926 2609        76.3037  2601.56     84.3306  365.676    113.541     180.167     113.541     
1 1 1 24 3  18 o 8  155.906 2.75205 421.888     21.5299  440.585     21.4464  117.018    28.6049     21.4005     28.6049     
1 1 1 24 3  19 o 16 358.976 3.64152 2335.13     62.6228  2238.99     68.1421  252.33     151.832     12.5259     331.832     
1 1 1 24 3  20 o 8  418.309 4.08129 3107.48     81.8916  3105.74     89.0682  313.47     231.139     23.661      231.139     
1 1 1 24 3  21 o 2  466.384 4.2934  3869.5      98.2803  3855.94     102.365  368.55     95.3745     64.5103     95.3745     
1 1 1 24 3  22 o 19 48.7174 3.1528  43.0181     7.40056  41.8973     7.80994  4.01247    356.926     33.9298     356.926     
1 1 1 24 3  23 o 5  368.537 3.70759 2433.25     68.4323  2388.42     68.5129  290.314    162.918     52.6281     162.918     
1 1 1 24 3  24 o 7  27.0288 4.79722 15.6484     6.17273  11.2112     6.92831  29.1499    17.7305     69.1806     17.7305     
1 1 1 24 3  25 o 16 178.459 2.48735 554.017     21.2981  575.6       23.1823  155.06     161.754     68.3949     161.754     
1 1 1 24 3  26 o 17 179.932 2.59126 579.023     22.8036  569.34      23.9043  81.5089    218.529     88.5299     38.5293     
1 1 1 24 3  27 o 1  60.5332 2.9458  73.2014     8.48843  57.8777     9.08912  3.39942    25.9234     50.5899     205.923     
1 1 1 24 3  28 o 11 132.997 2.45717 305.675     15.71    322.216     17.0159  69.0021    315.089     40.899      135.089     
1 1 1 24 3  29 o 18 240.179 2.88889 1019.79     33.3287  1026.96     36.1663  169.746    123.272     2.52949     123.272     
1 1 1 24 3  30 o 13 233.804 2.91391 972.703     33.3807  966.945     34.8821  158.174    112.959     11.0805     292.959     
1 1 1 24 3  31 o 15 202.405 2.82097 722.844     27.3964  730.742     29.7939  158.396    324.97      37.9517     324.97      
1 1 1 24 3  32 o 11 176.615 2.6332  551.923     22.1411  554.669     24.4208  116.035    295.14      10.1977     115.14      
1 1 1 24 3  33 o 4  28.9411 4.846   18.3488     6.69011  12.6187     7.25812  49.1065    158.053     119.381     158.053     
1 1 1 24 3  34 o 16 205.34  2.73953 765.685     28.8902  730.611     27.4956  129.862    236.414     24.9239     56.4138     
1 1 1 24 3  35 o 1  336.571 3.40404 1988.89     54.9873  2033.84     59.7916  243.992    43.6887     14.8018     43.6887     
1 1 1 24 3  36 o 11 97.124  2.65614 160.998     12.5133  174.355     13.2983  66.1167    341.739     29.3527     341.739     
1 1 1 24 3  37 o 18 342.174 3.57104 2008.48     62.4468  2152.47     59.8501  307.807    346.744     137.425     346.744     
1 1 1 24 3  38 o 13 500.422 4.69615 4391.36     120.287  4526.1      115.098  364.318    341.095     24.7962     341.095     
1 1 1 24 3  39 o 15 61.157  3.1888  67.4132     9.80919  66.1642     9.59982  10.2748    122.295     50.0356     302.295     
1 1 1 24 3  40 o 5  70.9333 2.90728 87.6755     10.3624  91.6245     10.2103  36.2943    82.6497     15.2978     82.6497     
1 1 1 24 3  41 o 12 125.935 2.56832 272.581     16.2515  291.054     16.1143  60.421     199.742     49.6339     19.742      
1 1 1 24 3  42 o 14 57.2145 3.36441 65.6135     9.47643  51.9804     9.52507  24.057     96.7775     5.00389     276.778     
1 1 1 24 3  43 o 13 138.255 2.62932 342.903     17.8298  336.504     18.5563  125.626    19.0837     69.5536     19.0837     
1 1 1 24 3  44 o 3  219.001 2.80734 843.742     31.4504  860.7       30.1416  170.114    176.54      39.7461     176.54      
1 1 1 24 3  45 o 14 96.0676 2.81788 152.664     13.3875  176.383     13.6495  43.6069    11.1762     39.2977     191.176     
1 1 1 24 3  46 o 8  51.3255 3.58436 51.3091     9.15603  43.6139     9.00143  18.5051    101.73      15.4088     281.73      
1 1 1 24 3  47 o 14 121.252 2.60419 248.085     16.0974  275.409     15.4393  94.059     154.999     28.2453     154.999     
1 1 1 24 3  48 o 17 159.422 2.63179 455.979     21.5442  447.928     20.503   139.727    106.514     66.0552     106.514     
1 1 1 24 3  49 o 6  42.8074 4.17376 35.2265     8.35224  31.6075     8.99719  0.887788   52.8982     46.248      232.898     
1 1 1 24 3  50 o 8  95.6087 2.8337  163.53      14.2346  162.625     12.8252  76.1556    102.43      31.3811     102.43      
1 1 1 24 3  51 o 14 90.0804 2.82069 146.017     12.9304  143.692     12.4722  74.8741    122.588     39.3411     122.588     
1 1 1 24 3  52 o 10 91.7147 2.84471 160.755     13.31    140.055     12.7611  60.5313    284.421     3.421       284.421     
1 1 1 24 3  53 o 2  156.161 2.77191 436.405     20.9921  433.405     22.3463  103.031    42.5069     3.02843     222.507     
1 1 1 24 3  54 o 13 92.5631 2.71833 153.324     12.5058  152.775     12.6577  73.7079    82.9636     27.9969     82.9636     
1 1 1 24 3  55 o 12 97.6745 2.71539 172.922     13.162   168.058     13.3633  56.6375    284.733     15.9656     104.733     
1 1 1 24 3  56 o 17 39.1572 4.74668 32.1313     8.26641  25.0932     9.46525  8.35102    336.573     30.8929     156.572     
1 1 1 24 3  57 o 3  96.2585 2.87048 160.896     13.4168  171.224     14.2182  84.3613    217.06      43.8809     217.06      
1 1 1 24 3  58 o 18 94.1735 2.95716 159.013     13.5332  159.33      14.2989  68.1896    178.853     13.4192     178.853     
1 1 1 24 3  59 o 18 60.7299 3.51801 75.9026     10.2549  58.4115     10.7339  42.1151    337.477     8.14845     337.477     
1 1 1 24 3  60 o 12 37.2289 4.832   28.429      8.59536  23.8959     8.73973  21.8347    66.5358     7.00982     66.5358     
1 1 1 24 3  61 o 7  25.3659 5.55675 16.9947     8.18965  6.07765     8.26703  5.9496     304.768     4.02287     124.768     
1 1 1 24 3  62 o 15 46.6463 4.21791 36.006      9.38184  44.7499     9.82852  28.7781    244.482     1.4459      244.482     
1 1 1 24 3  63 o 2  15.5869 4.88787 -1.18807    7.62322  -3.11103    7.59351  2.38688    79.531      10.8926     79.531      
1 1 1 24 3  64 o 5  36.2049 5.24659 33.9627     7.99782  16.7728     10.2858  16.7263    151.897     8.29362     331.897     
1 1 1 24 3  65 o 11 54.3189 3.75296 57.1483     9.15966  51.2314     10.7881  42.3248    195.894     18.6896     195.894     
1 1 1 24 3  66 o 9  16.8806 5.1196  1.11757     7.36878  -0.663823   8.18395  1.06837    255.294     14.6336     255.294     
1 1 1 24 3  67 o 1  14.2063 4.53687 -9.10508    7.3491   0.176245    6.95683  1.40721    286.534     9.3431      286.534     
1 1 1 24 3  68 o 15 52.0973 4.3074  45.3373     11.174   56.8384     10.657   30.3512    208.787     3.93761     28.7869     
1 1 1 24 3  69 f 0  45.2133 5.11757 35.4883     12.5663  43.7254     9.00926  27.3943    204.377     0           0           
1 1 1 24 3  70 o 15 24.5928 6.75321 16.1435     14.5154  4.26546     9.33395  8.87535    287.523     5.50528     107.523     
1 1 1 24 3  71 o 10 58.112  5.21645 87.5575     17.8246  47.2559     12.0311  39.6474    350.645     8.05487     350.645     
1 1 1 24 3  72 o 11 23.2003 6.95766 1.46052     19.3527  6.71973     9.55306  6.77044    48.1899     4.40048     228.19      
1 1 1 24 3  73 o 11 23.1624 7.13228 6.01194     19.5312  2.24185     10.9766  5.19686    17.2862     2.06384     197.286     
1 1 1 24 3  74 o 18 18.8373 5.9107  -25.5937    16.4471  5.3119      9.85557  1.3388     338.491     8.04069     158.491     
1 1 1 24 3  75 o 10 23.5663 6.8864  24.2222     18.1199  -14.0829    10.2047  4.40084    163.19      0.183144    163.19      
1 1 1 24 3  76 o 7  48.2289 5.83172 50.6064     14.254   43.5828     12.9363  37.8468    40.2918     20.397      40.2918     
1 1 1 24 3  77 o 8  49.3092 5.87061 56.7821     14.6583  42.7522     13.2949  37.0115    210.215     16.8259     210.215     
1 1 1 24 3  78 o 2  18.0425 5.7531  -0.745482   11.1811  -4.14943    10.8563  0.518689   1.86948     0.511272    181.869     
1 1 1 24 3  79 o 18 20.7554 6.19867 -3.25013    11.5541  9.49405     11.4542  3.62868    72.1206     1.83389     252.121     
1 1 1 24 3  80 o 15 37.1777 7.08914 38.4656     13.5922  25.6711     13.9609  23.0485    110.874     9.50795     110.874     
1 1 1 24 3  81 o 14 33.8076 7.60238 25.9841     13.9772  30.1964     15.0098  17.1182    197.164     5.22707     197.164     
1 1 1 24 3  82 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 4  0  o 14 64.9889 2.72879 75.6499     8.81487  75.6499     8.81487  1.71936    180         4.55076     360         
1 1 1 24 4  1  o 9  330.898 3.6062  1966.13     62.4708  1919.21     57.0664  230.123    145.144     19.2555     325.144     
1 1 1 24 4  2  o 11 169.108 2.68392 515.338     23.2855  498.859     22.2056  127.439    28.4231     24.053      28.4231     
1 1 1 24 4  3  o 12 88.5581 2.57612 135.499     11.2961  143.121     11.5193  18.7687    253.748     70.5479     73.7475     
1 1 1 24 4  4  o 17 366.275 3.87923 2388.8      72.8766  2372.6      69.5049  226.381    38.1857     80.063      218.186     
1 1 1 24 4  5  o 19 408.374 4.36945 3008.41     89.4153  2913.36     89.4121  289.714    58.9248     15.2085     238.925     
1 1 1 24 4  6  o 9  353.465 3.79886 2242.84     65.6712  2191.28     68.8306  234.506    189.786     44.3435     9.7858      
1 1 1 24 4  7  o 19 308.767 3.75138 1703.01     59.6091  1680.41     56.4617  196.556    316.062     53.8581     136.062     
1 1 1 24 4  8  o 15 107.47  2.68935 196.305     15.4525  213.992     13.2695  21.6016    140.932     100.938     320.932     
1 1 1 24 4  9  o 9  173.126 2.9488  540.588     25.7015  522.591     25.4643  62.1101    93.007      121.32      273.007     
1 1 1 24 4  10 o 13 205.721 3.18833 742.738     32.9275  758.672     32.8089  142.572    107.097     6.49676     287.097     
1 1 1 24 4  11 o 7  265.893 3.41014 1306.28     45.4973  1203.31     45.3321  198.435    216.769     14.876      216.769     
1 1 1 24 4  12 f 0  239.312 3.30642 1027.84     39.7175  1004.17     39.5871  221.113    134.601     0           0           
1 1 1 24 4  13 o 15 181.961 2.9118  610.394     25.8741  564.485     27.1356  101.948    265.817     53.8356     85.8166     
1 1 1 24 4  14 o 14 226.135 2.98834 928.239     32.2752  885.997     35.3033  195.944    120.988     71.9703     120.988     
1 1 1 24 4  15 o 17 363.508 3.72898 2351.98     67.9083  2338.26     67.9521  298.064    45.9825     70.6295     45.9825     
1 1 1 24 4  16 o 14 182.654 2.72535 599.605     24.8658  583.752     25.0219  151.424    17.0384     49.5        17.0384     
1 1 1 24 4  17 o 6  375.093 3.73337 2529.6      68.7121  2464.84     71.5682  265.541    236.033     11.435      56.033      
1 1 1 24 4  18 o 5  172.116 2.64112 533.729     22.7897  517.014     22.768   112.179    12.732      15.8982     192.732     
1 1 1 24 4  19 o 1  65.1452 2.90704 81.8741     9.138    69.5284     9.64458  11.9044    277.282     39.2412     97.282      
1 1 1 24 4  20 o 11 349.015 3.64932 2135.05     62.4104  2189.2      65.2437  269.889    169.599     37.8404     169.599     
1 1 1 24 4  21 o 12 219.71  2.66734 883.925     28.7101  828.749     29.9518  149.766    303.706     11.3078     123.706     
1 1 1 24 4  22 o 1  70.3512 2.74345 87.9953     9.47273  88.1012     9.79428  21.4319    315.531     17.7767     135.531     
1 1 1 24 4  23 o 4  400.183 3.84562 2848.31     75.5202  2838.44     78.6879  254.377    315.483     67.1896     135.483     
1 1 1 24 4  24 f 0  482.586 4.40365 4156.18     104.298  4119.5      108.635  379.327    48.29       0           0           
1 1 1 24 4  25 o 19 170.734 2.44329 513.706     20.3941  520.173     21.4098  61.9392    38.48       115.434     218.48      
1 1 1 24 4  26 o 5  392.596 3.75883 2778.93     73.9144  2694.75     73.9785  312.523    45.6789     63.5108     45.6788     
1 1 1 24 4  27 o 16 131.856 2.41675 314.299     15.8484  302.808     16.0549  113.052    179.369     73.2705     179.369     
1 1 1 24 4  28 o 19 91.3408 2.51747 153.571     11.3869  142.915     11.5961  52.1879    311.267     5.08005     311.267     
1 1 1 24 4  29 o 14 275.15  2.93156 1323.53     41.1044  1363.08     39.7021  207.761    308.957     27.1912     308.957     
1 1 1 24 4  30 o 10 237.429 2.9026  1002.07     35.8265  998.3       33.2017  170.394    6.03583     7.81487     6.03582     
1 1 1 24 4  31 o 4  273.077 3.035   1341.17     40.6297  1305.53     42.39    239.584    104.017     96.4975     104.017     
1 1 1 24 4  32 o 14 150.17  2.56334 391.316     19.0813  408.815     19.5003  126.073    17.7286     54.3856     17.7286     
1 1 1 24 4  33 o 5  53.2855 3.38813 50.0069     8.8494   51.6334     9.05301  8.05389    12.2103     70.3874     12.2103     
1 1 1 24 4  34 o 17 338.161 3.37228 1999.68     55.9986  2061.55     58.3011  249.283    166.679     21.5812     166.679     
1 1 1 24 4  35 o 3  125.268 2.59511 279.178     15.1803  278.12      17.2932  89.129     265.978     14.4984     265.978     
1 1 1 24 4  36 o 17 204.062 2.76784 720.722     27.6263  757.547     28.9881  142.721    215.205     2.64391     215.205     
1 1 1 24 4  37 o 16 76.8534 2.76235 100.268     10.3951  110.06      10.8111  13.3909    93.5733     71.3182     273.573     
1 1 1 24 4  38 o 1  218.343 2.70439 838.418     29.0321  854.085     30.149   160.538    172.33      17.9353     172.33      
1 1 1 24 4  39 o 18 128.69  2.54493 287.442     15.699   300.976     17.09    81.799     18.3136     10.2871     198.314     
1 1 1 24 4  40 o 8  176.859 2.53135 526.323     21.9873  584.921     22.8753  148.973    139.215     56.1895     139.215     
1 1 1 24 4  41 o 17 74.6244 2.85586 91.3927     10.4306  107.357     10.8249  50.0306    216.415     22.6225     216.415     
1 1 1 24 4  42 o 3  37.8418 4.45397 22.1816     7.59176  30.5915     8.70455  1.18529    341.298     7.90474     161.298     
1 1 1 24 4  43 o 8  66.6576 3.02779 74.1812     9.93533  84.631      10.1656  18.2391    285.958     47.3183     105.958     
1 1 1 24 4  44 o 19 133.987 2.54267 322.87      16.7394  315.47      17.3612  85.6625    345.442     9.6526      165.442     
1 1 1 24 4  45 o 4  178.53  2.71826 544.469     22.747   589.196     25.8865  181.008    310.413     122.758     310.413     
1 1 1 24 4  46 o 11 40.2776 4.43878 31.6662     8.11172  27.7749     9.09811  7.37224    307.611     15.9131     127.611     
1 1 1 24 4  47 o 9  191.499 2.63859 625.722     24.3313  679.277     26.3234  159.259    308.052     58.0405     308.052     
1 1 1 24 4  48 f 0  91.419  2.67552 153.683     11.8068  144.322     12.6064  65.0418    288.764     0           0           
1 1 1 24 4  49 o 13 162.304 2.60225 458.87      20.6596  478.913     21.6747  98.1116    319.334     23.6081     139.334     
1 1 1 24 4  50 o 1  73.2736 2.88653 90.7977     10.176   101.327     10.9435  55.3304    43.7061     35.5473     43.7061     
1 1 1 24 4  51 o 3  124.834 2.50163 271.37      15.1966  284.022     16.0736  55.9987    333.201     55.3113     153.201     
1 1 1 24 4  52 o 2  132.856 2.55855 322.306     17.0854  307.112     16.948   80.6721    272.013     16.624      92.0132     
1 1 1 24 4  53 o 16 58.1545 3.48906 72.4746     10.1153  50.5055     9.80522  30.9503    170.583     10.6988     350.583     
1 1 1 24 4  54 o 12 103.481 2.68254 200.76      13.9284  182.093     13.8264  92.9935    304.993     50.0798     304.993     
1 1 1 24 4  55 o 2  76.8279 2.90582 103.209     10.7628  108.471     11.532   43.3419    101.508     14.0031     281.508     
1 1 1 24 4  56 o 19 28.1202 5.47449 12.5395     7.90455  17.3871     8.12082  3.96975    206.843     0.528989    26.8431     
1 1 1 24 4  57 o 13 58.4093 3.53441 60.0353     10.3672  63.6743     10.1066  43.6503    8.6147      14.9822     8.6147      
1 1 1 24 4  58 o 16 74.1561 3.24834 103.038     12.4147  95.4983     11.6143  55.5332    97.9939     15.84       97.9939     
1 1 1 24 4  59 o 12 78.3952 3.34211 120.218     12.1804  102.31      13.7037  47.7338    130.146     6.37819     310.147     
1 1 1 24 4  60 o 8  61.7207 3.6812  62.7957     10.4555  76.3332     12.1255  42.985     296.484     8.13821     296.484     
1 1 1 24 4  61 o 15 36.3224 5.37144 26.7449     8.24323  23.7599     10.6203  19.727     148.631     0.549026    328.631     
1 1 1 24 4  62 o 19 37.9621 4.93082 29.6132     8.42268  25.0985     9.5432   23.948     254.794     7.21959     254.794     
1 1 1 24 4  63 o 13 21.3683 5.63175 9.04731     7.80331  4.0205      8.687    1.82286    164.032     14.2162     344.032     
1 1 1 24 4  64 f 0  103.315 3.07607 198.771     13.9281  187.114     17.5043  42.8181    15.9921     0           0           
1 1 1 24 4  65 o 7  83.1589 2.94773 119.462     11.8558  130.823     12.6389  49.2927    96.3735     8.50972     276.373     
1 1 1 24 4  66 o 17 31.5232 5.23221 20.9132     8.19761  17.926      8.0655   19.1737    144.492     6.0734      144.492     
1 1 1 24 4  67 o 14 17.0313 5.08073 0.555486    7.30947  2.1198      7.54935  0.805079   240.254     16.2567     240.254     
1 1 1 24 4  68 o 15 60.1237 3.36515 50.8545     9.68436  84.0225     9.94824  35.5515    10.5381     4.58335     190.538     
1 1 1 24 4  69 o 13 57.9636 4.13549 58.6054     12.7741  67.7257     10.485   49.6655    23.8364     28.992      23.8364     
1 1 1 24 4  70 o 16 16.3324 5.49521 -12.2331    15.0938  -7.64303    8.46726  1.28639    320.578     15.2906     320.578     
1 1 1 24 4  71 o 10 19.8811 6.25133 -0.41144    14.9293  -0.708794   9.81122  3.38154    59.806      6.58306     239.806     
1 1 1 24 4  72 o 15 23.3887 6.93949 8.32127     17.8603  5.12002     9.38577  6.49708    99.1226     4.08884     279.123     
1 1 1 24 4  73 o 5  22.3733 6.67006 8.36199     14.9063  2.36363     10.439   4.69513    13.0472     7.38138     193.047     
1 1 1 24 4  74 o 11 29.7229 6.11792 -12.3347    16.0702  33.2098     11.4147  14.813     260.164     6.01462     260.164     
1 1 1 24 4  75 o 19 22.3193 6.70437 12.7349     15.7074  -3.33857    10.469   6.80424    32.7766     5.28606     212.777     
1 1 1 24 4  76 o 19 32.7661 7.44049 27.7136     15.5336  19.9285     12.1808  19.4184    298.886     4.84938     298.886     
1 1 1 24 4  77 o 13 43.2446 7.01065 33.1001     16.9647  48.8253     13.2342  23.4215    90.8476     3.73858     270.848     
1 1 1 24 4  78 o 6  35.7491 7.13164 28.4439     13.1937  29.4616     13.4642  20.1108    206.795     1.2047      206.795     
1 1 1 24 4  79 o 12 20.6485 6.29246 6.00956     11.3684  0.553437    12.5396  3.31994    37.5575     3.96857     217.558     
1 1 1 24 4  80 o 6  29.6462 7.21964 23.6593     12.8044  17.3697     13.5181  12.3575    257.597     2.05406     77.5969     
1 1 1 24 4  81 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 5  0  o 9  17.3882 5.96299 7.89184     6.07488  7.89184     6.07488  32.5632    180         69.4394     180         
1 1 1 24 5  1  o 3  162.065 2.6163  454.46      21.7292  477.131     20.7227  154.114    2.00617     93.9081     2.00617     
1 1 1 24 5  2  o 9  56.098  3.08053 62.4502     8.34258  50.1982     8.70869  20.1291    203.106     103.559     203.106     
1 1 1 24 5  3  o 4  448.954 4.69984 3584.62     110.897  3575.84     100.332  332.399    228.572     8.0182      228.572     
1 1 1 24 5  4  o 18 318.49  3.83417 1775.11     62.7759  1825.62     59.519   266.575    323.241     71.2275     323.241     
1 1 1 24 5  5  o 10 154.066 3.067   451.716     22.8804  392.041     24.2263  145.022    253.448     88.4883     253.448     
1 1 1 24 5  6  o 5  219.89  3.43566 863.115     35.4303  852.637     40.1133  145.53     129.851     24.5085     309.851     
1 1 1 24 5  7  o 18 432.855 5.17756 3386.68     104.96   3274.08     118.961  331.419    129.903     30.7232     129.903     
1 1 1 24 5  8  o 11 218.505 3.51344 842.435     34.4758  851.927     42.1283  150.04     241.243     12.8374     61.2427     
1 1 1 24 5  9  o 16 78.0845 2.99843 100.016     11.251   117.257     12.1246  7.5723     131.053     83.5922     311.053     
1 1 1 24 5  10 f 0  449.246 4.84462 3657.81     97.3866  3514.97     119.18   318.398    316.042     0           0           
1 1 1 24 5  11 o 2  157.611 2.55315 428.886     19.7413  452.25      20.5941  141.621    336.238     72.0487     336.238     
1 1 1 24 5  12 f 0  287.725 3.34869 1458.86     48.2908  1478.86     48.2777  218.621    50.8951     0           0           
1 1 1 24 5  13 o 5  314.102 3.40132 1738.49     55.685   1762.75     51.2709  231.676    212.315     8.98614     212.315     
1 1 1 24 5  14 o 10 196.591 2.59387 691.948     26.5329  678.794     24.5557  106.38     285.334     67.3925     105.334     
1 1 1 24 5  15 o 13 396.101 3.7681  2803.81     77.6386  2766.24     71.8821  265.046    334.713     45.2804     154.713     
1 1 1 24 5  16 o 18 114.635 2.34527 242.38      13.4105  224.197     13.4888  77.8572    254.803     9.16363     254.803     
1 1 1 24 5  17 o 14 62.9163 2.76023 67.8323     8.76152  73.1737     8.53824  11.8583    48.7069     17.2305     228.707     
1 1 1 24 5  18 o 9  221.697 2.77426 880.815     30.8487  862.734     30.7942  179.567    272.1       45.7527     272.1       
1 1 1 24 5  19 o 9  191.531 2.64325 662.949     26.3877  638.378     24.3451  116.018    240.672     38.384      60.6721     
1 1 1 24 5  20 o 7  335.656 3.42501 2020.41     56.3976  1978.74     58.773   272.953    247.453     63.4586     247.453     
1 1 1 24 5  21 o 9  201.127 2.53131 726.571     24.4878  708.272     26.4727  143.415    190.391     3.89806     190.391     
1 1 1 24 5  22 o 15 150.555 2.40332 397.147     17.7531  406.788     18.5119  78.2287    305.062     51.9357     125.062     
1 1 1 24 5  23 o 16 150.57  2.44095 401.455     18.0016  402.643     18.8274  71.6029    42.7469     65.5495     222.747     
1 1 1 24 5  24 o 9  557.275 4.86392 5480.36     130.487  5564.64     141.054  455.047    236.546     106.13      236.546     
1 1 1 24 5  25 o 19 60.6262 3.0341  67.6222     8.31829  63.4963     9.86795  3.7611     116.367     52.3235     296.367     
1 1 1 24 5  26 o 5  373.566 3.62462 2502.57     65.0979  2453.1      70.4494  311.087    175.446     87.9952     175.446     
1 1 1 24 5  27 o 8  362.74  3.50034 2331.24     61.0573  2340.76     66.1127  302.068    173.331     86.484      173.331     
1 1 1 24 5  28 o 11 232.407 2.78178 954.469     31.0018  962.01      33.7482  184.084    239.022     42.0005     239.022     
1 1 1 24 5  29 o 9  55.9251 3.237   63.7468     8.63329  48.5479     9.12884  14.4761    32.9336     91.2181     32.9336     
1 1 1 24 5  30 o 7  202.241 2.67098 735.174     25.849   716.104     28.2065  144.504    190.996     7.05027     190.996     
1 1 1 24 5  31 o 8  205.813 2.8295  765.182     26.9671  738.175     31.1658  172.574    276.373     60.1758     276.373     
1 1 1 24 5  32 o 6  113.46  2.59624 230.886     14.6895  226.368     14.7935  90.8083    120.134     47.2447     120.134     
1 1 1 24 5  33 o 13 306.321 3.12337 1661.43     45.8976  1670.21     49.9213  231.098    17.1092     29.6017     17.1092     
1 1 1 24 5  34 o 2  85.8223 2.60002 135.606     10.7503  126.339     11.5108  42.0713    86.7521     22.1909     266.752     
1 1 1 24 5  35 o 1  17.7339 4.89389 6.2425      6.40116  -1.42102    6.84043  45.5247    4.02527     100.271     4.02527     
1 1 1 24 5  36 o 14 176.811 2.6258  546.264     22.5351  563.517     23.9934  113.597    1.7598      17.9448     181.76      
1 1 1 24 5  37 o 17 36.1556 4.4455  25.2582     7.50968  22.6614     7.97941  4.11282    161.91      29.3313     161.91      
1 1 1 24 5  38 o 18 71.5458 2.89404 94.0647     10.1675  88.395      10.4782  36.8727    317.803     12.8851     137.803     
1 1 1 24 5  39 f 0  113.084 2.57927 234.185     13.6472  220.49      15.4282  105.392    117.806     0           0           
1 1 1 24 5  40 o 10 52.1202 3.485   48.2509     8.79769  49.2664     9.19029  6.0952     250.363     76.0744     250.363     
1 1 1 24 5  41 o 9  85.1717 2.74928 119.205     10.9984  139.506     12.4237  40.7191    298.256     29.5778     118.256     
1 1 1 24 5  42 o 10 158.903 2.51354 443.44      19.2299  453.615     20.7873  122.412    269.585     27.9821     269.585     
1 1 1 24 5  43 o 1  15.3491 4.70275 1.18835     6.54766  -4.1986     7.08592  10.5631    149.864     23.9628     149.864     
1 1 1 24 5  44 o 8  109.753 2.52639 212.258     13.3264  216.351     14.4154  83.1856    231.666     21.5571     231.666     
1 1 1 24 5  45 o 8  224.605 2.68492 882.081     29.07    912.467     31.3611  202.983    143.76      97.7181     143.76      
1 1 1 24 5  46 o 3  75.5345 3.01853 100.35      10.913   103.537     11.8393  28.9617    76.2347     40.2811     256.235     
1 1 1 24 5  47 o 9  170.785 2.63505 511.095     22.6857  527.085     22.4104  129.897    123.884     27.5075     123.884     
1 1 1 24 5  48 o 19 50.3803 3.69394 47.0834     8.85946  44.6664     9.48359  18.6926    99.6543     19.2498     279.654     
1 1 1 24 5  49 o 3  134     2.47866 316.142     16.0102  323.519     17.2405  98.0368    209.538     16.6491     209.538     
1 1 1 24 5  50 o 2  98.4736 2.61137 162.259     12.3496  184.048     13.3846  67.175     49.1445     5.18798     49.1445     
1 1 1 24 5  51 o 18 174.482 2.50566 526.72      21.1207  558.13      22.7019  111.053    137.045     14.5717     317.045     
1 1 1 24 5  52 o 18 118.911 2.54961 248.192     14.6588  256.384     15.689   94.9622    142.787     31.2186     142.787     
1 1 1 24 5  53 o 16 158.482 2.67248 438.931     21.1577  457.596     21.2885  131.852    222.436     50.072      222.436     
1 1 1 24 5  54 o 9  76.3784 3.28347 100.734     12.8211  109.281     12.1387  60.0403    118.889     21.1464     118.889     
1 1 1 24 5  55 o 5  105.569 2.84626 200.246     15.5807  199.121     14.4616  70.7938    199.792     1.11972     199.792     
1 1 1 24 5  56 o 7  50.7974 3.98591 40.9247     9.58268  53.9361     10.2902  31.0501    77.8254     0.896654    257.825     
1 1 1 24 5  57 o 1  29.313  5.54092 20.8608     8.22475  11.7639     8.81915  10.6856    318.256     3.96854     138.256     
1 1 1 24 5  58 o 16 58.923  3.76645 73.1823     10.3062  54.1415     11.2723  38.0607    239.09      1.40119     239.09      
1 1 1 24 5  59 o 10 63.625  3.43067 78.0352     10.0956  69.0455     11.4393  48.1393    244.526     15.8354     244.526     
1 1 1 24 5  60 o 11 41.0406 4.69489 35.5864     8.4585   27.867      9.87085  19.6646    174.413     10.2864     354.413     
1 1 1 24 5  61 o 9  114.869 2.638   240.305     14.7541  233.462     15.5516  86.1219    330.203     21.6717     330.203     
1 1 1 24 5  62 o 7  36.5097 5.39917 26.3025     8.57441  25.0347     10.5143  22.4767    31.9525     5.67918     31.9525     
1 1 1 24 5  63 o 5  44.8838 4.62554 44.9743     10.1639  31.3256     9.811    26.547     327.909     1.80107     147.909     
1 1 1 24 5  64 o 5  35.3659 5.5899  22.2383     9.48999  26.7467     9.84615  21.8023    188.83      13.8101     188.83      
1 1 1 24 5  65 o 10 56.4192 3.72752 56.8117     10.2358  60.6135     10.5987  34.3228    251.008     2.6978      71.0079     
1 1 1 24 5  66 o 4  23.0103 5.69441 12.4331     8.15436  5.78678     8.48174  6.50066    112.508     0.554485    112.508     
1 1 1 24 5  67 o 1  22.221  5.82403 9.03262     8.82304  7.33135     8.42327  6.60543    267.221     7.90888     87.221      
1 1 1 24 5  68 o 6  73.3431 3.7865  105.331     15.7643  94.6834     11.7245  56.6403    255.323     20.6863     255.323     
1 1 1 24 5  69 o 12 51.914  4.4522  46.6066     11.9769  56.3327     10.2812  33.9276    221.951     3.94221     221.951     
1 1 1 24 5  70 o 14 32.7529 6.57092 22.356      12.5938  22.5438     10.0899  13.0516    333.717     11.5121     153.717     
1 1 1 24 5  71 o 12 41.6165 6.2365  35.3378     13.4161  36.2204     11.774   21.0198    214.778     7.3047      34.7781     
1 1 1 24 5  72 o 6  23.9246 6.31007 3.26067     11.4795  14.7139     10.0216  5.01856    349.801     13.0122     169.801     
1 1 1 24 5  73 f 0  17.3755 5.44391 4.77235     10.1371  -12.8559    9.92939  4.76159    262.482     0           0           
1 1 1 24 5  74 f 0  25.0351 6.59321 10.9509     10.9063  12.0258     11.233   16.9695    126.189     0           0           
1 1 1 24 5  75 o 10 41.5578 7.28131 38.1274     16.1914  37.6786     14.0172  18.4103    212.608     12.5253     32.6078     
1 1 1 24 5  76 o 19 29.5243 7.31245 11.4837     15.7534  23.7629     12.5827  16.1221    65.8302     4.76778     65.8302     
1 1 1 24 5  77 o 18 33.5492 7.75409 33.0989     16.4398  20.013      13.8129  15.8896    332.35      5.18669     152.35      
1 1 1 24 5  78 o 8  20.6355 6.49179 10.4282     15.3053  -10.6683    12.2957  0.885421   216.746     0.542575    36.7464     
1 1 1 24 5  79 o 4  19.1033 6.07035 2.03216     10.8803  -3.88349    13.7276  1.24856    296.286     7.99838     116.286     
1 1 1 24 5  80 o 14 23.2861 6.74233 11.8342     12.2961  6.75887     12.9765  3.77491    160.619     3.38072     340.619     
1 1 1 24 5  81 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 6  0  o 9  88.3124 2.83648 139.107     12.4943  139.107     12.4943  46.8474    360         21.0866     360         
1 1 1 24 6  1  o 16 117.134 2.78303 247.719     16.0215  239.534     16.5872  75.1406    155.309     54.3526     155.309     
1 1 1 24 6  2  o 12 68.1449 2.90317 78.9126     9.61498  86.4996     10.1229  19.869     75.0557     13.7103     255.056     
1 1 1 24 6  3  o 12 65.9456 2.84707 74.5941     9.41692  80.2939     9.29611  1.14597    302.747     74.5075     122.747     
1 1 1 24 6  4  o 13 379.319 4.00914 2508.08     76.2072  2601.31     76.1946  257.853    194.027     38.7967     14.0266     
1 1 1 24 6  5  o 5  256.225 3.03417 1173.84     38.1179  1155.33     39.7701  182.848    19.6211     4.63573     199.621     
1 1 1 24 6  6  o 2  162.289 2.5825  466.468     20.1445  467.633     21.8306  125.801    7.58927     26.4206     7.58927     
1 1 1 24 6  7  o 5  162.598 2.54278 480.576     21.0802  457.212     20.3614  128.634    340.859     32.1539     340.859     
1 1 1 24 6  8  o 1  173.335 2.64788 532.031     23.407   533.616     22.5864  141.925    173.234     42.5845     173.234     
1 1 1 24 6  9  f 0  212.869 2.79173 791.955     29.0123  815.491     30.5487  188.176    80.8295     0           0           
1 1 1 24 6  10 o 3  156.923 2.53906 455.207     19.4255  418.528     20.428   115.681    201.633     14.2463     201.633     
1 1 1 24 6  11 o 11 315.536 3.38507 1766.54     51.2083  1766.98     55.7504  276.688    299.882     97.2263     299.882     
1 1 1 24 6  12 o 14 186.888 2.73243 621.203     25.5429  617.733     25.639   137.443    15.6184     11.269      15.6184     
1 1 1 24 6  13 o 5  478.052 4.6949  4088.37     104.836  4034.65     119.529  394.964    60.8167     92.8316     60.8167     
1 1 1 24 6  14 o 8  278.338 3.14373 1361.99     41.9807  1387.16     45.6739  181.389    175.344     39.2617     355.344     
1 1 1 24 6  15 o 15 306.581 3.2145  1649.58     48.4034  1686.07     50.3696  247.695    134.141     53.1177     134.141     
1 1 1 24 6  16 o 8  248.346 2.9214  1112.31     36.3686  1076.05     36.3418  160.97     329.555     34.7557     149.555     
1 1 1 24 6  17 o 19 83.3878 2.62709 112.314     10.4779  135.366     11.4192  39.0809    76.9138     8.55565     76.9138     
1 1 1 24 6  18 o 15 245.808 2.99138 1069.04     37.6907  1074.9      35.9827  227.7      153.382     107.373     153.382     
1 1 1 24 6  19 o 6  366     3.62744 2368.51     67.8074  2387.76     65.2234  297.572    50.9112     66.5887     50.9112     
1 1 1 24 6  20 o 15 298.627 3.16278 1586.37     46.3407  1578.58     48.2987  225.596    42.737      22.2024     42.737      
1 1 1 24 6  21 o 10 300.381 3.15263 1590.58     45.5984  1611.76     49.2683  261.487    231.314     93.2367     231.314     
1 1 1 24 6  22 o 1  230.115 2.68011 945.785     30.288   932.814     31.5045  167.696    117.254     8.8262      117.254     
1 1 1 24 6  23 o 13 90.0803 2.42137 143.971     10.666   144.26      11.1508  0.606216   278.319     120.941     278.318     
1 1 1 24 6  24 o 2  301.485 3.07561 1606.36     45.5506  1619.56     47.3749  263.341    21.2434     96.8655     21.2434     
1 1 1 24 6  25 o 1  170.872 2.49343 521.917     20.8638  513.809     21.8201  120.198    185.056     3.63199     185.056     
1 1 1 24 6  26 o 9  279.743 2.92936 1389.75     40.2367  1387.39     41.8793  228.636    355.204     59.6549     355.204     
1 1 1 24 6  27 o 6  294.542 3.01307 1542.02     43.5918  1537.11     45.338   265.201    9.33932     112.564     9.33932     
1 1 1 24 6  28 o 2  302.922 3.37762 1625.62     47.6242  1632.79     54.6942  224.527    75.6567     17.5601     75.6567     
1 1 1 24 6  29 o 6  106.192 2.77474 205.4       14.1569  195.39      15.2682  62.8216    210.079     11.4048     30.0792     
1 1 1 24 6  30 o 12 297.867 3.3043  1578.01     44.9105  1572.81     53.3587  208.14     336.195     7.07636     156.195     
1 1 1 24 6  31 f 0  115.554 2.91474 250.799     15.0241  224.178     18.2898  149.1      221.959     0           0           
1 1 1 24 6  32 o 12 62.7508 3.08261 69.3921     8.97256  71.1107     10.2636  15.5643    325.75      38.4411     145.75      
1 1 1 24 6  33 o 12 158.226 2.53604 440.216     19.4366  448.317     20.7706  45.7686    287.511     129.861     107.511     
1 1 1 24 6  34 o 3  71.9244 2.87751 85.3137     9.66169  99.2318     11.0109  40.7316    305.208     4.98893     305.208     
1 1 1 24 6  35 o 18 123.824 2.58734 268.326     15.1248  276.475     16.9238  60.5561    124.9       48.7492     304.9       
1 1 1 24 6  36 o 14 188.187 2.66278 609.447     24.2926  648.358     25.9376  135.074    194.883     7.69681     194.883     
1 1 1 24 6  37 o 13 96.0777 2.64116 158.109     11.91    170.319     13.4716  72.4979    184.629     22.047      184.629     
1 1 1 24 6  38 o 7  15.7912 4.81077 -5.02839    6.44391  2.53927     7.67262  16.9587    352.547     38.0668     352.547     
1 1 1 24 6  39 o 5  215.861 2.65021 804.463     27.2664  851.303     30.0651  170.947    253.493     41.34       253.493     
1 1 1 24 6  40 o 10 21.6056 5.35117 -0.162881   6.80516  13.4427     8.6626   20.2332    93.0564     52.2584     93.0564     
1 1 1 24 6  41 o 8  130.05  2.53204 308.274     15.5333  293.251     17.3357  98.3285    137.563     20.7349     137.563     
1 1 1 24 6  42 o 9  120.808 2.56068 259.185     14.4747  260.036     16.4356  104.458    77.1649     48.7586     77.1649     
1 1 1 24 6  43 o 6  133.876 2.48042 315.891     15.9556  321.671     17.2826  138.301    332.774     103.596     332.774     
1 1 1 24 6  44 o 12 164.605 2.48836 455.453     19.7075  508.742     21.3566  111.68     104.028     2.69203     284.028     
1 1 1 24 6  45 o 12 213.373 2.64468 787.927     27.1672  832.621     29.3931  175.683    266.842     57.6626     266.842     
1 1 1 24 6  46 o 17 97.1317 2.70651 154.614     12.3565  182.444     13.9569  69.4109    348.681     11.4806     348.681     
1 1 1 24 6  47 o 1  65.5587 3.15415 73.3102     9.87567  80.8779     10.732   46.0121    19.6247     20.4558     19.6247     
1 1 1 24 6  48 o 12 42.1983 4.15103 33.7156     8.29661  31.4175     8.74804  11.3153    127.388     1.81674     307.388     
1 1 1 24 6  49 f 0  72.9978 2.98236 96.8668     10.3203  93.9804     11.3613  33.2966    241.18      0           0           
1 1 1 24 6  50 o 2  180.971 2.66772 559.219     23.4098  609.248     24.987   118.899    206.552     9.01687     26.5524     
1 1 1 24 6  51 o 5  161.888 2.60269 450.728     20.4892  484.357     21.7475  108.573    346.081     3.06282     166.081     
1 1 1 24 6  52 f 0  65.4454 3.38785 79.7263     10.5802  74.7104     11.4292  51.3083    341.657     0           0           
1 1 1 24 6  53 o 6  120.008 2.74914 250.2       15.9676  265.238     17.0592  80.5312    29.1379     0.431165    209.138     
1 1 1 24 6  54 o 5  70.9261 3.13764 77.1598     10.5326  105.047     11.5941  45.5621    323.79      1.60156     143.79      
1 1 1 24 6  55 o 6  16.9911 5.07673 3.96862     7.09246  -5.63798    8.63873  3.90922    272.887     16.9973     272.887     
1 1 1 24 6  56 o 10 92.3953 2.90261 146.408     12.9389  160.604     13.8796  81.024     153.375     41.1563     153.375     
1 1 1 24 6  57 o 1  78.6698 3.1179  117.916     11.0556  105.535     13.1713  53.0167    112.58      3.07169     112.58      
1 1 1 24 6  58 o 10 59.2113 3.45113 58.4518     9.6196   69.248      10.6871  43.3508    344.753     11.9163     344.753     
1 1 1 24 6  59 o 18 24.4575 5.64592 9.14934     7.57404  12.7509     8.38815  3.71051    163.54      34.8797     163.54      
1 1 1 24 6  60 o 13 43.1325 4.47909 38.3863     9.23991  31.3313     9.43487  31.756     31.8986     15.0073     31.8986     
1 1 1 24 6  61 o 8  31.9083 5.55474 11.6669     8.39457  28.7414     9.90282  16.319     140.802     0.843701    320.802     
1 1 1 24 6  62 o 10 58.2502 3.69574 60.6318     10.286   63.8179     11.0616  48.731     280.526     25.2136     280.526     
1 1 1 24 6  63 o 5  67.9017 3.6081  89.5174     13.0192  79.546      11.365   31.4023    170.222     25.1157     350.222     
1 1 1 24 6  64 o 15 49.0817 4.67322 45.6298     12.3372  45.5139     9.87272  30.4242    168.4       0.553527    348.4       
1 1 1 24 6  65 o 6  36.8628 5.65868 22.5709     10.1362  31.5392     10.2272  24.2481    144.729     5.8349      144.729     
1 1 1 24 6  66 f 0  42.7508 4.97438 31.3975     10.2485  39.5718     10.2267  29.3637    136.766     0           0           
1 1 1 24 6  67 o 19 64.7402 3.99536 73.0538     13.4395  83.9088     11.9849  41.0412    39.8596     0.0655243   219.861     
1 1 1 24 6  68 o 6  28.0798 5.50735 6.79143     9.19261  23.8296     8.51438  13.6148    57.737      2.43413     237.737     
1 1 1 24 6  69 o 7  25.9126 6.43681 10.4474     10.8094  15.1686     10.1353  11.0509    346.631     0.0854178   346.631     
1 1 1 24 6  70 o 3  20.878  5.86366 -4.16321    10.3356  11.617      9.68683  4.17513    153.552     7.66194     333.552     
1 1 1 24 6  71 o 1  21.533  6.14181 7.71124     10.4972  4.57399     9.96621  1.90424    139.91      16.4198     319.91      
1 1 1 24 6  72 o 16 27.6581 6.58663 18.7121     11.0395  12.3697     10.7987  7.2911     178.333     15.7513     358.333     
1 1 1 24 6  73 o 6  24.5367 6.65209 8.34214     11.1753  12.4846     11.8068  3.43149    294.99      19.9913     114.99      
1 1 1 24 6  74 o 2  30.0097 7.00827 15.3941     11.725   23.0525     12.927   14.1437    349.977     4.4612      169.977     
1 1 1 24 6  75 o 11 19.3946 6.01134 1.7458      10.9983  -0.30724    11.3894  4.27023    127.975     5.26257     307.975     
1 1 1 24 6  76 o 4  24.7037 6.91285 6.60628     12.1831  14.9178     13.4155  5.90452    251.437     1.92428     251.437     
1 1 1 24 6  77 o 10 23.2548 6.83764 10.8987     13.9131  5.50204     12.408   6.79302    36.9518     3.68679     216.952     
1 1 1 24 6  78 o 3  26.1978 7.44852 19.5211     16.8058  9.41985     13.088   8.48055    61.8566     1.00215     241.857     
1 1 1 24 6  79 o 4  21.021  6.29828 -21.6065    15.8659  14.2922     12.0887  1.60575    287.325     2.84243     107.325     
1 1 1 24 6  80 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 7  0  o 9  486.747 5.64971 4210.43     137.729  4210.43     137.729  413.198    360         107.8       360         
1 1 1 24 7  1  o 8  86.6656 2.7853  146.525     11.6719  121.075     12.3032  6.33417    275.316     102.136     95.316      
1 1 1 24 7  2  o 17 187.501 2.79383 653.593     25.5664  594.27      26.8186  101.769    51.6661     65.0836     231.666     
1 1 1 24 7  3  f 0  285.511 3.26119 1479.13     45.5589  1414.11     47.6745  256.497    1.56212     0           0           
1 1 1 24 7  4  f 0  107.845 2.39556 197.893     12.5632  215.162     13.3019  22.5813    340.456     0           0           
1 1 1 24 7  5  o 4  231.226 2.73719 942.765     31.0308  953.847     32.3973  205.28     188.616     80.3503     188.616     
1 1 1 24 7  6  o 8  117.838 2.57017 263.276     14.3115  230.26      15.8157  74.4779    324.794     7.47388     144.794     
1 1 1 24 7  7  o 19 365.201 3.59342 2362.42     65.7365  2372.36     65.795   274.078    68.0025     14.9481     68.0024     
1 1 1 24 7  8  o 6  288.782 3.11198 1494.18     45.9251  1465.14     44.1453  244.567    252.215     71.3871     252.215     
1 1 1 24 7  9  o 3  349.271 3.54294 2144.77     63.1895  2185.94     60.7872  232.182    109.017     45.2517     289.017     
1 1 1 24 7  10 o 6  371.222 3.60666 2450.29     69.5937  2442.17     64.5105  366.023    98.1203     193.334     98.1203     
1 1 1 24 7  11 o 6  288.075 3.1427  1491.67     46.2185  1453.43     44.5218  198.079    228.822     21.5953     48.822      
1 1 1 24 7  12 o 16 134.393 2.54246 327.991     17.3271  313.185     16.8894  105.782    193.56      33.3759     193.56      
1 1 1 24 7  13 o 16 207.972 2.71547 757.53      28.186   776.917     28.4164  132.12     255.47      33.2517     75.4697     
1 1 1 24 7  14 o 16 221.581 2.77239 874.96      31.3074  866.91      30.2591  164.152    53.1653     11.7117     53.1653     
1 1 1 24 7  15 o 19 271.027 3.04434 1306.98     42.0933  1299.7      40.5952  187.355    228.301     16.4386     48.3011     
1 1 1 24 7  16 o 14 378.44  3.78206 2509.29     68.6634  2577.22     74.7341  262.911    99.6288     24.3654     279.629     
1 1 1 24 7  17 o 2  251.258 3.04899 1106.83     37.5114  1133.61     39.2685  187.394    345.666     14.3917     345.666     
1 1 1 24 7  18 o 9  118.63  2.74681 254.199     15.5363  245.664     17.0157  35.599     121.621     27.9394     121.621     
1 1 1 24 7  19 o 14 229.48  2.92822 945.735     35.1422  923.022     32.1746  193.416    154.669     61.2795     154.669     
1 1 1 24 7  20 o 10 180.279 2.6247  563.155     23.7489  589.999     23.6654  157.308    52.3562     65.7403     52.3562     
1 1 1 24 7  21 o 6  366.114 3.72947 2370.3      65.515   2390.56     71.2402  352.838    29.5984     179.031     29.5984     
1 1 1 24 7  22 o 9  120.774 2.46217 258.916     14.3326  258.923     15.4206  87.1228    296.165     17.0597     296.165     
1 1 1 24 7  23 o 16 85.9184 2.60766 129.249     11.0445  133.141     11.3596  42.3072    273.251     17.555      93.2506     
1 1 1 24 7  24 o 11 48.04   3.31977 42.2945     7.70512  40.4338     8.05809  5.39658    182.127     47.6217     182.127     
1 1 1 24 7  25 o 2  219.153 2.60975 848.297     28.0642  855.75      29.2521  151.204    114.614     8.30088     294.614     
1 1 1 24 7  26 o 12 150.188 2.476   404.693     18.2002  395.562     19.0498  100.82     235.422     5.13196     55.422      
1 1 1 24 7  27 o 2  193.569 2.6032  665.005     25.5846  664.516     24.9162  117.483    128.898     38.0082     308.898     
1 1 1 24 7  28 o 1  70.8644 2.94638 82.0895     10.0344  97.1078     10.7943  5.63456    40.7218     102.018     40.7219     
1 1 1 24 7  29 o 10 216.652 2.6602  835.439     28.2196  830.418     29.5269  194.959    96.3134     86.5858     96.3134     
1 1 1 24 7  30 o 10 211.139 2.85403 800.422     27.4939  782.308     32.6216  128.346    163.46      41.9603     343.46      
1 1 1 24 7  31 o 17 136.027 2.52132 331.153     17.0018  326.014     17.3385  39.608     346.401     110.663     166.401     
1 1 1 24 7  32 o 10 198.385 2.58026 671.749     24.5017  725.824     26.812   163.324    209.255     48.7353     209.255     
1 1 1 24 7  33 o 4  64.5266 3.06403 70.5683     9.2494   78.1141     10.4572  34.2549    192.843     5.66991     192.843     
1 1 1 24 7  34 o 18 61.6712 3.13404 65.2441     9.03305  70.6646     10.2089  21.2752    337.929     31.7903     157.929     
1 1 1 24 7  35 o 6  42.9886 3.99312 30.9168     7.84269  36.1153     8.95883  6.43586    61.596      15.279      241.596     
1 1 1 24 7  36 o 12 103.839 2.7564  187.487     13.2705  196.196     15.332   74.0788    108.727     10.2991     108.727     
1 1 1 24 7  37 o 5  96.1329 2.65543 169.43      11.9918  159.481     13.4475  29.3693    65.651      71.9032     245.651     
1 1 1 24 7  38 o 3  80.2539 2.79902 114.618     10.5443  114.875     11.8618  29.9227    114.414     46.1859     294.414     
1 1 1 24 7  39 o 18 20.8457 5.41712 3.6774      7.21293  8.50377     7.82063  15.5181    222.156     40.2059     222.156     
1 1 1 24 7  40 o 7  29.4198 5.39051 18.2212     7.37519  13.7534     8.82487  0.800488   80.0776     5.07881     80.0776     
1 1 1 24 7  41 o 6  20.9675 5.39799 9.34712     6.90347  1.55952     8.6263   11.0013    253.475     29.947      253.475     
1 1 1 24 7  42 f 0  95.6334 2.78238 162.162     12.1042  163.857     14.4157  79.4068    320.829     0           0           
1 1 1 24 7  43 o 11 50.4158 3.80767 44.6991     8.54413  47.175      10.3447  23.1763    103.725     6.15088     283.725     
1 1 1 24 7  44 o 17 163.165 2.58247 469.814     19.3797  477.754     22.7442  105.331    329.657     13.978      149.657     
1 1 1 24 7  45 o 1  68.6091 3.20318 77.2089     9.78651  91.8522     12.1321  31.5712    24.7296     24.5912     204.73      
1 1 1 24 7  46 o 9  275.81  3.22877 1287.13     40.467   1432.04     48.7459  192.911    224.29      4.00733     224.29      
1 1 1 24 7  47 o 16 79.5217 3.42545 114.574     12.1888  112.46      14.8167  46.5878    307.747     10.4503     127.747     
1 1 1 24 7  48 o 9  170.467 2.7954  503.926     22.2344  533.032     25.4912  139.405    7.49657     46.0315     7.49657     
1 1 1 24 7  49 o 10 50.1366 4.47897 42.676      10.2569  49.5544     11.7643  32.6421    16.3739     7.06091     16.3739     
1 1 1 24 7  50 o 13 98.5633 3.08371 167.069     13.5613  181.308     16.7639  74.3243    347.202     16.1912     347.202     
1 1 1 24 7  51 o 11 53.3479 4.41866 66.9937     9.6242   39.1169     11.8993  37.2368    195.372     8.02349     195.372     
1 1 1 24 7  52 o 5  45.916  4.55328 40.9555     8.55684  36.9988     11.3711  21.9753    247.773     13.5477     67.7728     
1 1 1 24 7  53 o 14 60.5642 3.70671 68.5022     9.4573   64.7553     12.4692  45.824     164.393     14.665      164.393     
1 1 1 24 7  54 o 1  72.1337 3.2059  93.5857     10.2942  94.1855     12.6406  50.9335    42.5        7.46154     42.5        
1 1 1 24 7  55 o 17 69.6598 3.21015 90.4344     10.5899  84.9563     11.6285  47.1989    336.413     3.45274     336.413     
1 1 1 24 7  56 o 10 89.3401 2.87703 134.05      12.7068  153.429     12.9577  44.6884    185.435     29.5565     5.4349      
1 1 1 24 7  57 o 9  49.4532 4.47665 53.2687     11.1092  38.2164     10.4074  21.9934    168.194     19.0617     348.194     
1 1 1 24 7  58 o 19 80.1446 3.28852 114.057     12.6746  118.615     13.6247  64.3569    113.204     24.3848     113.204     
1 1 1 24 7  59 o 17 37.9932 5.14589 30.0578     8.82682  25.1552     9.97015  22.6852    195.502     1.6091      195.502     
1 1 1 24 7  60 o 7  36.5831 5.39953 22.5293     9.16261  29.3798     10.0225  16.4393    40.3441     10.9988     220.344     
1 1 1 24 7  61 o 12 36.4742 5.43023 28.3139     10.114   23.415      9.12613  13.0999    342.033     18.4923     162.033     
1 1 1 24 7  62 o 2  51.5951 4.19376 54.6105     11.098   44.8243     10.1816  35.2972    148.552     5.55994     148.552     
1 1 1 24 7  63 o 19 39.1311 5.02826 30.3383     9.94493  28.7613     9.04746  7.14827    20.897      35.0927     200.897     
1 1 1 24 7  64 o 10 56.0548 4.17466 59.1258     12.4231  58.5484     10.5869  45.0596    16.2272     19.9335     16.2272     
1 1 1 24 7  65 o 16 31.7062 5.90996 16.5685     9.70321  24.108      9.56533  15.0516    129.602     6.92322     309.602     
1 1 1 24 7  66 o 2  47.5849 4.32216 47.0445     9.76364  39.173      10.2182  25.6541    327.213     8.27647     147.213     
1 1 1 24 7  67 o 12 18.7389 5.38682 -1.57441    8.38528  7.29043     8.1399   1.73147    108.506     22.5833     108.506     
1 1 1 24 7  68 o 3  19.1601 5.62472 9.68874     9.9826   -8.85573    9.51534  3.03094    16.8803     7.69477     196.88      
1 1 1 24 7  69 o 8  20.185  6.01488 0.50875     11.6198  5.22348     9.44939  3.3681     289.199     4.45157     109.199     
1 1 1 24 7  70 o 5  28.8465 6.62032 16.9343     11.193   17.7308     10.7166  9.49555    195.858     12.2334     15.8576     
1 1 1 24 7  71 o 9  31.4123 6.66148 17.551      11.467   24.3313     11.3989  17.5757    359.025     7.59697     359.025     
1 1 1 24 7  72 o 12 35.563  6.52765 22.3449     12.4593  31.2524     11.3548  22.0799    49.1235     4.29101     49.1235     
1 1 1 24 7  73 o 11 27.5797 6.74244 20.854      11.5482  9.20443     12.063   9.35065    81.1774     11.9211     261.177     
1 1 1 24 7  74 o 6  22.3443 6.49502 4.52625     11.5833  8.64446     11.8623  4.36789    273.388     14.2835     93.3881     
1 1 1 24 7  75 o 14 23.5162 6.69087 6.40736     12.4453  11.2453     11.9208  6.48427    24.1797     10.6257     204.18      
1 1 1 24 7  76 o 14 57.078  5.63904 62.1137     15.7924  73.4841     15.3946  34.049     154.907     0.919233    334.907     
1 1 1 24 7  77 o 16 37.2447 6.98359 23.0761     13.8386  42.2804     13.6962  23.0236    192.451     7.94297     192.451     
1 1 1 24 7  78 o 15 22.3423 6.65655 8.50466     12.8517  6.3713      12.59    2.10672    175.501     1.77426     355.501     
1 1 1 24 7  79 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 8  0  o 4  162.411 2.48397 468.225     20.1959  468.225     20.1959  155.205    180         70.539      180         
1 1 1 24 8  1  o 10 171.014 2.47153 508.66      22.0004  528.74      20.2887  138.193    263.316     37.061      263.316     
1 1 1 24 8  2  o 4  74.1921 2.56983 93.848      9.67989  101.954     9.34118  0.597079   340.576     95.6121     340.576     
1 1 1 24 8  3  o 10 89.7931 2.47233 150.253     11.3339  136.327     10.8719  46.1967    16.9228     16.4045     196.923     
1 1 1 24 8  4  o 10 37.8684 3.92076 22.3678     7.24868  29.9154     7.02637  31.1607    131.265     92.6309     131.265     
1 1 1 24 8  5  o 4  132.317 2.47323 304.518     16.647   316.959     16.1033  103.058    300.737     29.6933     300.737     
1 1 1 24 8  6  o 3  200.141 2.75099 724.417     27.5324  696.791     27.6416  121.938    135.399     43.6235     315.399     
1 1 1 24 8  7  o 8  346.579 3.57919 2146.26     62.1254  2118.61     62.2024  256.406    199.701     6.45709     199.701     
1 1 1 24 8  8  o 5  221.324 2.7825  908.746     30.1423  830.029     31.4602  148.384    312.355     22.0431     132.355     
1 1 1 24 8  9  o 16 324.219 3.40633 1879.27     55.2894  1852.45     55.3993  258.081    326.294     44.1077     326.294     
1 1 1 24 8  10 o 1  252.159 3.03824 1129.31     35.6928  1127.13     40.9106  170.863    251.825     23.2224     71.8249     
1 1 1 24 8  11 o 6  301.849 3.11105 1625.31     47.0176  1608.32     47.102   211.538    61.3009     15.8982     241.301     
1 1 1 24 8  12 o 6  458.122 4.31773 3781.85     97.0901  3677.84     101.056  376.457    266.815     82.8063     266.815     
1 1 1 24 8  13 o 3  280.667 3.02197 1412.12     41.6739  1383.51     43.3006  198.911    175.627     8.89121     355.627     
1 1 1 24 8  14 o 14 111.608 2.39607 221.458     13.7169  220.767     13.0477  67.721     4.24739     11.3545     184.247     
1 1 1 24 8  15 o 11 33.0644 4.19876 20.4497     6.703    19.5857     6.69908  7.24606    117.908     20.5531     117.908     
1 1 1 24 8  16 o 13 293.748 3.16371 1533.2      45.5523  1529.61     47.5688  242.216    278.413     60.3116     278.413     
1 1 1 24 8  17 o 7  256.956 2.93687 1152.3      38.4228  1190.98     37.1752  198.986    21.1068     28.5785     21.1068     
1 1 1 24 8  18 o 4  180.787 2.72505 567.093     24.6061  592.712     24.7661  129.619    35.1972     4.41819     35.1971     
1 1 1 24 8  19 o 3  201.23  2.87059 695.426     31.171   741.934     26.3438  156.199    275.046     27.4501     275.046     
1 1 1 24 8  20 o 15 352.053 3.46678 2178.95     61.0924  2222.48     61.2319  228.02     162.741     54.4445     342.741     
1 1 1 24 8  21 o 2  121.267 2.53752 257.748     15.9577  264.445     14.8117  101.831    134.479     52.6534     134.479     
1 1 1 24 8  22 o 2  101.21  2.68569 180.987     13.6765  183.004     13.5175  26.5967    230.627     83.6717     50.6267     
1 1 1 24 8  23 o 16 95.4249 2.61691 158.147     12.7482  165.48      12.2098  57.3968    330.347     4.49183     150.347     
1 1 1 24 8  24 o 2  117.261 2.51803 240.143     15.0431  248.202     14.4993  69.8742    218.491     17.9593     38.4915     
1 1 1 24 8  25 o 17 336.832 3.45949 2027.38     59.5463  2003.04     57.2358  252.215    278.388     19.5466     278.388     
1 1 1 24 8  26 o 19 382.495 3.76066 2562.85     73.4615  2637.73     70.6298  283.035    130.885     14.7964     130.885     
1 1 1 24 8  27 o 8  157.191 2.594   433.054     21.2083  443.923     19.6063  122.626    279.77      27.4691     279.77      
1 1 1 24 8  28 o 8  141.349 2.5638  354.45      18.4567  355.139     17.8288  79.761     54.0677     37.4523     234.068     
1 1 1 24 8  29 o 9  97.8771 2.59444 170.962     12.4256  169.576     12.9724  61.6672    24.8854     5.54259     204.885     
1 1 1 24 8  30 o 3  98.5685 2.76977 180.367     13.762   165.34      13.5362  54.323     278.332     23.7568     98.3321     
1 1 1 24 8  31 o 6  84.1389 2.66667 123.115     11.2509  128.793     11.1739  48.5435    257.572     12.3656     77.5722     
1 1 1 24 8  32 o 3  210.022 2.63705 763.654     28.0949  802.974     27.3797  156.491    21.1628     15.8406     21.1629     
1 1 1 24 8  33 o 2  86.3128 2.64807 134.659     11.1005  130.46      11.7319  61.6375    297.413     13.5568     297.413     
1 1 1 24 8  34 o 16 173.085 2.50137 544.736     21.1664  519.386     22.1817  84.5391    128.571     74.8837     308.571     
1 1 1 24 8  35 o 7  81.5868 2.77328 116.535     10.6766  120.587     11.9187  63.318     70.1724     29.889      70.1724     
1 1 1 24 8  36 o 14 53.878  3.66059 52.2288     8.84119  52.1306     10.5884  23.6501    282.121     0.539138    282.121     
1 1 1 24 8  37 o 14 192.854 2.70462 672.431     24.881   649.829     27.2939  160.965    14.7685     52.4795     14.7685     
1 1 1 24 8  38 o 5  50.2884 3.88036 47.3881     8.87626  43.9421     10.2293  18.19      186.9       2.24701     186.9       
1 1 1 24 8  39 o 11 31.5366 5.15922 22.614      7.49528  14.4346     8.65602  0.309164   355.882     10.8249     355.882     
1 1 1 24 8  40 o 15 110.206 2.57854 217.986     13.3709  214.459     15.0088  63.1887    118.547     24.0789     298.547     
1 1 1 24 8  41 o 13 85.2982 2.78975 116.83      11.1919  143.433     12.6026  74.9087    51.9375     47.2963     51.9375     
1 1 1 24 8  42 o 9  146.063 2.52179 371.013     17.4617  388.489     19.4252  125.843    2.98986     52.0694     2.98986     
1 1 1 24 8  43 o 17 53.8524 3.73817 40.3057     9.39059  66.0378     10.1888  23.8911    9.97946     15.6017     189.979     
1 1 1 24 8  44 o 14 155.119 2.57432 431.3       19.097   425.673     20.8741  108.001    123.452     2.68501     123.451     
1 1 1 24 8  45 o 17 67.9246 3.42416 80.7016     10.8526  85.1789     12.2917  31.3612    204.984     24.9203     24.9839     
1 1 1 24 8  46 f 0  161.877 2.87774 449.113     21.9367  486.782     24.732   82.541     62.3303     0           0           
1 1 1 24 8  47 o 17 95.1469 3.05171 143.603     13.2163  181.738     15.85    55.6115    144.139     17.3285     324.139     
1 1 1 24 8  48 o 18 24.1876 5.53775 3.54089     7.63831  16.3299     8.70296  1.73913    148.861     5.79846     328.861     
1 1 1 24 8  49 f 0  66.1656 3.33962 75.4757     10.0789  82.3732     11.9077  62.8251    78.9079     0           0           
1 1 1 24 8  50 o 7  127.461 2.58254 290.212     15.429   290.482     17.4647  108.126    176.984     43.1909     176.984     
1 1 1 24 8  51 o 10 54.6217 3.61556 60.6193     8.97322  48.0979     10.2457  29.4063    183.289     11.9514     3.28942     
1 1 1 24 8  52 o 10 36.8629 4.81391 19.7086     7.93308  32.105      9.19552  17.8863    337.353     7.14036     157.353     
1 1 1 24 8  53 o 16 40.5317 4.61803 31.4713     8.65938  29.95       9.42297  18.4021    136.628     13.0562     316.628     
1 1 1 24 8  54 o 7  93.2295 2.99283 157.855     12.9991  155.116     14.8118  71.6041    145.506     18.9919     145.506     
1 1 1 24 8  55 o 11 89.399  3.31146 141.457     12.861   147.678     16.5324  61.2074    50.2117     3.41562     50.2117     
1 1 1 24 8  56 o 10 78.4763 3.52343 117.096     12.42    106.765     14.8737  53.995     298.356     4.50661     298.356     
1 1 1 24 8  57 o 13 25.6886 6.23733 13.777      8.91805  9.03436     10.8689  6.66455    247.041     1.1821      67.041      
1 1 1 24 8  58 o 1  51.8261 5.11139 61.3145     12.3275  41.0419     12.869   35.6649    316.104     6.33846     316.104     
1 1 1 24 8  59 o 10 50.6037 4.53453 43.6385     11.3877  52.2814     10.9384  30.2545    154.213     3.7452      334.213     
1 1 1 24 8  60 o 15 46.9058 4.54403 38.8797     10.28    43.8745     10.4994  25.8475    20.5085     7.70057     200.509     
1 1 1 24 8  61 o 14 34.5439 5.31812 10.9929     9.08678  37.278      9.71159  11.5722    337.494     19.4989     157.494     
1 1 1 24 8  62 o 13 41.1867 4.95817 31.3058     9.21247  34.0286     10.5185  18.866     212.065     13.978      32.0654     
1 1 1 24 8  63 o 8  31.1193 5.46016 7.087       8.75457  32.1438     9.96126  19.3972    254.883     5.2036      254.883     
1 1 1 24 8  64 o 14 50.8839 4.11689 43.5007     9.72377  54.2748     10.8914  30.9312    251.263     2.64324     71.2627     
1 1 1 24 8  65 o 13 19.3787 5.67144 1.87326     9.14819  4.8267      8.90924  1.84906    44.8938     15.0247     224.894     
1 1 1 24 8  66 o 19 25.8009 5.98011 10.5561     8.99629  15.6557     9.03637  10.9276    12.4149     3.08569     12.4149     
1 1 1 24 8  67 o 16 28.9725 5.65128 7.38697     9.44443  26.0281     9.21022  6.01889    98.1258     21.9516     278.126     
1 1 1 24 8  68 o 1  42.8055 5.8197  29.0025     12.0594  46.3399     11.8585  16.1492    313.722     20.3535     133.722     
1 1 1 24 8  69 o 2  61.8389 4.46625 75.6829     13.7295  71.1375     13.5569  43.4915    125.144     10.0576     125.144     
1 1 1 24 8  70 o 9  35.129  6.64229 31.15       12.0112  21.6852     12.1248  13.3577    52.9447     14.7562     232.945     
1 1 1 24 8  71 o 14 43.4376 6.03203 33.3004     12.6781  44.6729     12.6028  19.8288    203.45      13.4592     23.4503     
1 1 1 24 8  72 o 7  25.2035 5.82063 26.7602     11.6026  -11.1332    10.598   12.0797    252.122     2.18404     252.122     
1 1 1 24 8  73 o 14 21.3266 6.34161 4.80334     11.5882  4.84166     11.4196  3.09169    1.60319     0.229997    1.60319     
1 1 1 24 8  74 o 11 43.8301 7.12626 41.5576     14.2427  44.8249     16.4133  30.5364    290.473     10.2586     290.473     
1 1 1 24 8  75 o 4  23.7442 7.03502 1.46066     12.5015  15.8809     15.8687  5.3338     271.737     12.5901     91.7371     
1 1 1 24 8  76 o 18 38.0741 7.62497 24.4441     14.3646  48.0984     16.9343  24.0664    339.263     9.22182     339.263     
1 1 1 24 8  77 o 6  20.0041 6.32408 7.72073     12.4551  -13.7064    15.7286  0.691001   180.719     1.73615     0.719097    
1 1 1 24 8  78 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 9  0  o 12 238.686 2.66178 1010.75     31.8212  1010.75     31.8212  240.908    360         128.466     360         
1 1 1 24 9  1  o 2  58.2887 2.93161 58.3238     8.51744  62.8925     8.48648  8.85273    198.59      83.7142     198.59      
1 1 1 24 9  2  o 8  32.773  4.23847 23.8227     6.82382  15.8898     6.53207  17.8175    201.724     49.3595     201.724     
1 1 1 24 9  3  o 12 146.645 2.37133 382.101     17.4028  380.65      17.4508  102.419    329.441     0.922982    329.441     
1 1 1 24 9  4  o 3  184.155 2.4338  611.14      22.4686  591.857     22.4494  150.757    152.973     41.0227     152.973     
1 1 1 24 9  5  o 17 145.68  2.39144 378.147     17.753   374.618     17.1626  70.705     328.331     64.3549     148.331     
1 1 1 24 9  6  o 19 152.018 2.44969 411.315     19.3199  408.41      17.9855  73.4402    33.0348     68.7154     213.035     
1 1 1 24 9  7  o 16 308.233 3.15031 1691.82     49.5603  1680.45     47.7532  233.663    35.3155     17.6147     35.3155     
1 1 1 24 9  8  o 4  81.7502 2.50712 115.924     10.486   121.627     9.98438  40.7607    341.225     8.41243     161.225     
1 1 1 24 9  9  o 15 231.079 2.72045 963.809     31.491   930.9       31.5092  193.468    174.237     54.9505     174.237     
1 1 1 24 9  10 o 6  194.772 2.64321 683.503     26.8206  662.478     24.7656  167.01     60.4477     58.4209     60.4477     
1 1 1 24 9  11 o 2  65.9185 3.00282 78.8579     10.0378  76.0077     9.69685  3.59528    228.854     70.6057     48.8536     
1 1 1 24 9  12 o 12 280.518 3.15139 1427.56     42.3223  1366.02     46.1007  195.954    120.604     15.8005     300.604     
1 1 1 24 9  13 o 5  158.905 2.48769 451.487     19.2865  444.277     20.3117  116.536    259.87      10.8624     259.87      
1 1 1 24 9  14 o 3  177.119 2.61587 554.514     22.5369  558.493     23.8857  155.449    162.743     63.6876     162.743     
1 1 1 24 9  15 o 16 116.592 2.48972 252.777     14.0747  230.161     14.9101  73.3185    4.29766     9.77664     184.298     
1 1 1 24 9  16 o 19 99.927  2.50202 179.491     12.341   175.209     12.6708  45.455     42.9114     41.6916     222.911     
1 1 1 24 9  17 o 17 30.6656 4.72329 17.8529     6.89323  16.8989     7.21243  32.6276    9.71703     85.7928     9.71703     
1 1 1 24 9  18 o 15 55.6648 3.22258 52.6331     8.87007  58.1872     8.93649  5.52606    226.092     72.6969     226.092     
1 1 1 24 9  19 o 5  182.921 2.6203  610.048     23.819   577.453     24.1959  132.061    226.372     4.93948     226.371     
1 1 1 24 9  20 o 2  129.551 2.4744  303.14      16.223   292.806     15.8774  93.218     156.462     10.505      156.462     
1 1 1 24 9  21 o 2  56.302  3.29308 63.6708     9.45172  50.0862     8.91505  6.5729     240.568     43.0191     60.5685     
1 1 1 24 9  22 o 4  134.446 2.52285 327.668     16.7411  314.254     17.2062  56.1587    231.536     76.2205     51.5361     
1 1 1 24 9  23 o 16 152.58  2.56282 428.164     19.0788  398.542     20.0315  84.3535    124.801     46.3765     304.801     
1 1 1 24 9  24 o 6  318.37  3.21882 1834.85     50.2855  1766.02     52.3514  248.013    302.72      36.4936     302.72      
1 1 1 24 9  25 o 18 132.497 2.49617 317.319     16.4951  306.224     16.6178  113.417    86.7808     47.5383     86.7808     
1 1 1 24 9  26 o 9  59.2627 3.17989 65.7466     9.92315  59.8164     8.82768  20.8812    344.84      22.4656     164.84      
1 1 1 24 9  27 o 5  133.903 2.50458 316.121     17.0077  320.781     16.5695  87.3786    128.348     11.9434     308.348     
1 1 1 24 9  28 f 0  95.5465 2.65258 161.662     12.759   162.987     12.5926  50.3776    158.614     0           0           
1 1 1 24 9  29 o 11 136.188 2.45669 340.454     16.5923  318.401     16.8993  115.136    273.875     42.5785     273.875     
1 1 1 24 9  30 o 17 182.033 2.64514 597.552     24.0087  579.404     24.243   120.642    319.658     16.8835     139.658     
1 1 1 24 9  31 o 10 162.219 2.52695 463.873     20.8627  470.724     20.2121  88.6628    303.64      52.0776     123.64      
1 1 1 24 9  32 o 12 193.912 2.80765 652.21      27.7113  684.349     26.8154  139.735    207.063     4.91634     207.063     
1 1 1 24 9  33 o 7  64.6369 3.13481 74.3505     10.2421  74.9629     9.93966  28.8311    269.194     22.9318     89.194      
1 1 1 24 9  34 o 8  77.0052 2.76024 106.134     10.5871  105.206     10.6467  59.2046    320.603     30.3471     320.604     
1 1 1 24 9  35 o 16 160.118 2.52739 458.568     20.4977  452.569     20.0626  140.939    185.054     59.4031     185.054     
1 1 1 24 9  36 o 18 198.505 2.64561 697.277     26.054   703.815     26.5821  134.686    281.896     10.6117     101.896     
1 1 1 24 9  37 o 10 102.051 2.61468 190.69      13.6742  180.236     13.028   78.4951    229.283     20.1317     229.283     
1 1 1 24 9  38 o 17 67.5048 3.12203 83.2386     10.0087  79.8313     10.9507  28.2525    350.655     31.3811     170.655     
1 1 1 24 9  39 o 16 84.4143 2.7638  123.421     11.2991  130.861     12.0236  63.4296    185.058     17.1656     185.058     
1 1 1 24 9  40 o 1  89.5612 2.81479 138.153     12.4558  148.228     12.7448  57.2136    188.663     5.16135     8.66284     
1 1 1 24 9  41 f 0  158.621 2.67139 440.035     20.5018  456.207     21.9647  103.906    144.177     0           0           
1 1 1 24 9  42 o 8  60.0908 3.53717 60.937      10.3108  69.2462     10.791   24.0446    312.107     27.9209     132.107     
1 1 1 24 9  43 o 12 136.927 2.71898 320.819     18.3867  348.358     18.885   99.9988    282.253     11.9735     282.253     
1 1 1 24 9  44 o 15 93.874  2.77978 149.651     12.5084  165.444     13.5955  46.3469    310.502     34.7591     130.502     
1 1 1 24 9  45 o 5  20.6574 5.28171 10.573      7.08368  -0.864501   8.35566  7.55716    109.363     28.2644     109.363     
1 1 1 24 9  46 o 15 103.969 2.88885 186.992     14.7851  199.912     15.2593  58.4352    183.035     25.617      3.03457     
1 1 1 24 9  47 o 18 83.8687 2.86807 115.275     11.3953  137.218     12.6502  65.3582    237.282     17.9711     237.282     
1 1 1 24 9  48 o 14 57.4855 3.47127 52.5947     9.67743  67.4261     10.046   47.2818    326.139     22.638      326.139     
1 1 1 24 9  49 o 18 61.7721 3.34412 61.4001     10.0333  76.9145     10.4504  23.4154    342.438     35.6919     162.438     
1 1 1 24 9  50 o 6  80.3646 3.0754  117.557     12.1436  114.896     12.5266  52.0216    14.0885     3.91014     194.089     
1 1 1 24 9  51 o 14 74.3195 3.32763 96.96       11.0323  102.732     13.5535  41.5579    274.617     16.4128     94.6169     
1 1 1 24 9  52 o 8  48.2179 4.38206 42.4755     9.16761  43.6247     11.3918  16.667     111.197     29.313      291.197     
1 1 1 24 9  53 o 4  119.336 2.94411 244.93      16.1836  267.75      18.9613  82.5311    278.92      3.48467     278.92      
1 1 1 24 9  54 o 13 38.6603 5.49432 24.0445     9.83759  33.7372     10.7387  17.0979    193.222     13.2745     13.2225     
1 1 1 24 9  55 o 5  25.431  5.948   11.9681     8.48454  11.696      9.16321  5.59485    72.9039     0.736898    252.904     
1 1 1 24 9  56 o 5  31.575  5.8598  21.4081     9.04487  17.421      9.83388  14.8907    318.086     4.73604     138.086     
1 1 1 24 9  57 o 13 15.1233 4.87742 -2.93861    7.63396  -6.61364    8.83504  5.52629    255.107     22.2451     255.107     
1 1 1 24 9  58 f 0  37.8194 5.01353 26.1711     9.28476  28.6322     9.0075   16.3111    293.964     0           0           
1 1 1 24 9  59 o 9  64.4085 3.36451 76.4126     10.5508  75.0804     11.0046  43.0069    205.329     1.91425     205.329     
1 1 1 24 9  60 o 3  93.3905 2.96694 157.501     13.9228  158.821     13.7766  53.8613    118.468     16.1122     298.468     
1 1 1 24 9  61 o 9  16.7739 5.11383 -2.39574    7.989    2.21023     7.81702  1.439      88.5278     6.07853     268.528     
1 1 1 24 9  62 o 2  63.7347 3.52052 75.4861     10.7511  74.4375     11.5354  51.5064    336.516     21.0661     336.516     
1 1 1 24 9  63 o 11 28.4689 5.82969 8.75737     8.79579  23.8307     9.77592  14.8754    16.5209     1.38153     196.521     
1 1 1 24 9  64 o 13 44.738  4.76924 38.8081     10.2708  38.7673     10.4492  34.9182    17.7664     15.7404     17.7664     
1 1 1 24 9  65 o 3  101.199 3.20556 190.859     16.7057  185.72      15.7209  80.9493    240.57      30.3488     240.57      
1 1 1 24 9  66 o 13 15.996  5.02242 2.73495     8.22657  -9.68597    8.77727  0.294554   300.903     6.05927     120.903     
1 1 1 24 9  67 o 3  22.0347 6.29131 1.00031     10.7768  10.9657     11.2286  2.91542    227.93      16.0577     47.9299     
1 1 1 24 9  68 o 3  35.9306 7.16675 22.2293     12.0338  35.0644     15.0498  20.2174    151.094     0.151457    331.094     
1 1 1 24 9  69 o 18 81.1892 4.75178 151.686     16.5123  104.381     20.0431  49.1674    307.848     5.31978     127.848     
1 1 1 24 9  70 o 8  52.8336 6.08812 67.9982     13.7964  46.8714     16.2821  29.0352    124.611     7.81976     304.611     
1 1 1 24 9  71 f 0  24.2706 6.87214 0.219757    11.6011  17.6182     14.5681  19.7278    43.4542     0           0           
1 1 1 24 9  72 o 5  27.4202 6.93097 22.8789     11.9574  3.50903     15.0972  10.9364    262.607     8.06128     82.6067     
1 1 1 24 9  73 o 18 36.3111 7.48136 35.003      13.1019  26.1186     16.8724  20.1979    39.4811     1.10924     219.481     
1 1 1 24 9  74 o 14 24.4743 6.86543 11.3999     12.4213  11.4215     12.6682  7.81834    148.246     7.17242     328.246     
1 1 1 24 9  75 o 15 38.844  7.16392 30.5642     14.2672  41.311      14.195   24.725     289.54      7.95792     289.54      
1 1 1 24 9  76 o 11 28.5058 7.3214  21.7124     13.6815  17.2477     13.4229  10.9907    116.951     1.81463     296.951     
1 1 1 24 9  77 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 10 0  o 3  140.808 2.35485 352.054     16.5959  352.054     16.5959  149.528    180         93.8714     180         
1 1 1 24 10 1  f 0  78.5861 2.57412 104.947     9.88418  114.732     10.3358  57.7753    351.683     0           0           
1 1 1 24 10 2  o 13 120.326 2.38124 256.797     14.6074  257.173     14.0768  45.1884    275.98      77.7433     95.9798     
1 1 1 24 10 3  f 0  323.548 3.19969 1836.33     51.8769  1880.09     51.8793  207.94     112.929     0           0           
1 1 1 24 10 4  o 8  292.868 3.03443 1521.69     44.5133  1522.69     44.5585  213.736    343.402     0.830501    163.403     
1 1 1 24 10 5  o 15 379.465 3.61886 2548.26     70.0733  2566.25     67.5301  317.387    306.248     77.6566     306.248     
1 1 1 24 10 6  o 1  55.4204 2.96352 53.3809     8.14699  56.2686     8.18885  21.9109    11.1258     110.399     11.1258     
1 1 1 24 10 7  o 3  171.287 2.51689 517.4       21.1734  523.462     22.0319  107.401    76.6105     29.9366     256.61      
1 1 1 24 10 8  o 7  186.353 2.54089 629.386     23.1891  602.798     24.227   137.714    182.098     9.0203      182.098     
1 1 1 24 10 9  o 19 81.683  2.56478 122.607     10.4223  114.644     10.5107  39.7035    195.283     18.2325     15.2827     
1 1 1 24 10 10 o 13 180.013 2.37818 600.484     21.8523  549.584     21.0522  142.949    227.964     30.3139     227.964     
1 1 1 24 10 11 o 6  150.64  2.67122 404.647     20.6743  400.83      19.6301  113.478    33.682      16.6399     33.682      
1 1 1 24 10 12 f 0  283.986 3.12438 1442.1      45.3657  1421.14     43.558   182.56     330.176     0           0           
1 1 1 24 10 13 o 18 195.093 2.6634  675.45      26.0043  675.152     26.0755  128.883    170.253     22.595      350.253     
1 1 1 24 10 14 o 18 136.189 2.48722 324.575     16.9301  333.948     16.9903  101.693    50.3629     15.9997     50.3629     
1 1 1 24 10 15 o 7  124.189 2.48102 273.228     15.3763  274.414     15.4746  93.8823    350.229     20.4021     350.229     
1 1 1 24 10 16 o 8  136.581 2.51347 330.06      17.0885  332.286     17.2897  71.9301    216.242     48.0208     36.242      
1 1 1 24 10 17 o 16 34.2286 4.46409 17.1818     7.2142   26.2295     7.4709   18.5259    244.861     58.9936     244.861     
1 1 1 24 10 18 o 2  79.1879 2.72579 118.019     10.9509  105.262     10.6082  40.9352    21.5771     13.8172     201.577     
1 1 1 24 10 19 o 2  192.982 2.71439 682.521     25.5342  639.754     26.8863  122.234    93.2745     32.5348     273.274     
1 1 1 24 10 20 o 8  210.018 2.74907 782.824     28.2075  782.98      29.6419  202.7      94.9778     107.187     94.9778     
1 1 1 24 10 21 o 3  169.87  2.58536 535.025     22.3231  489.709     21.686   116.162    29.6715     9.46833     209.672     
1 1 1 24 10 22 o 16 218.145 2.80185 848.51      31.7042  841.231     29.5262  145.494    41.8028     23.2442     221.803     
1 1 1 24 10 23 o 18 52.4826 3.7423  55.6724     8.9099   43.6612     10.1503  6.74593    267.151     46.2391     87.1509     
1 1 1 24 10 24 o 7  186.427 2.6924  631.717     23.9196  602.544     26.2671  139.562    95.2362     12.7905     95.2362     
1 1 1 24 10 25 o 11 255.314 2.97361 1141.06     36.1861  1174.98     39.8659  164.196    351.808     40.3519     171.808     
1 1 1 24 10 26 o 1  57.1257 3.49682 58.2977     9.61023  58.6392     10.2058  4.32188    311.678     64.0816     131.678     
1 1 1 24 10 27 o 3  110.377 2.65061 225.743     14.1212  207.665     15.0829  78.1231    99.5728     4.85013     99.5728     
1 1 1 24 10 28 o 9  148.951 2.59386 402.702     18.8225  385.717     19.8412  136.405    12.2897     65.6969     12.2897     
1 1 1 24 10 29 f 0  142.634 2.49813 363.584     17.0487  359.277     18.6033  101.447    139.89      0           0           
1 1 1 24 10 30 o 16 193.727 2.6544  661.675     26.1056  671.95      25.4235  119.522    104.542     37.3516     284.542     
1 1 1 24 10 31 o 16 24.7159 5.44504 8.69666     7.81014  12.8147     7.31173  5.66783    26.7642     17.9776     26.7642     
1 1 1 24 10 32 o 14 82.0192 2.78545 120.417     11.6491  119.336     11.1791  61.2745    21.1533     17.8174     21.1533     
1 1 1 24 10 33 o 11 97.1651 2.63861 165.03      13.0635  171.149     12.5679  77.3224    225.657     25.3616     225.657     
1 1 1 24 10 34 o 10 38.0635 4.40563 27.4774     8.37021  25.6941     7.85883  2.08888    0.0852341   44.6917     0.0852341   
1 1 1 24 10 35 f 0  67.4959 3.01639 82.1994     10.2536  80.6822     10.048   45.8456    137.476     0           0           
1 1 1 24 10 36 o 18 116.95  2.73069 241.029     16.0891  246.306     15.8706  86.4407    151.783     11.7731     151.783     
1 1 1 24 10 37 o 9  85.8201 2.89223 137.357     11.6465  125.731     13.0354  37.9715    254.027     40.7751     74.0275     
1 1 1 24 10 38 o 1  74.5716 3.12198 103.302     11.7436  95.8231     11.4819  27.4141    271.934     45.1691     91.9342     
1 1 1 24 10 39 o 14 98.2588 2.77353 177.923     13.3908  166.768     13.8389  66.0478    23.2598     1.0072      203.26      
1 1 1 24 10 40 o 18 99.5274 2.81525 177.432     13.4394  176.319     14.5601  72.0747    359.466     9.96521     359.466     
1 1 1 24 10 41 o 14 27.9696 5.26508 22.3821     7.79942  5.50453     8.79089  1.15543    228.339     14.946      228.339     
1 1 1 24 10 42 o 9  58.2775 3.33588 63.7957     9.33885  58.5507     9.92569  25.4617    140.656     24.1165     320.656     
1 1 1 24 10 43 o 11 51.1444 3.59821 41.0276     8.67537  54.1293     9.47459  20.3161    58.4162     24.6905     238.416     
1 1 1 24 10 44 o 19 37.3797 4.58293 27.0427     7.87521  24.8763     8.62626  7.82803    48.7689     30.2161     228.769     
1 1 1 24 10 45 o 12 30.0474 5.60264 16.4751     8.20259  17.7882     8.91035  8.42826    29.8876     0.194067    29.8876     
1 1 1 24 10 46 f 0  33.3022 5.21946 17.8428     8.14932  24.382      8.86139  17.5472    189.617     0           0           
1 1 1 24 10 47 o 16 29.7532 5.3231  25.5302     8.00305  6.9492      9.44472  4.16518    84.8249     26.3193     264.825     
1 1 1 24 10 48 o 11 18.6232 5.1218  -8.75251    7.4716   10.4588     8.43568  3.46006    178.744     20.3947     178.744     
1 1 1 24 10 49 o 14 48.2076 4.46817 52.4495     9.54231  34.4583     10.735   38.6346    343.553     21.3394     343.553     
1 1 1 24 10 50 o 15 21.6223 5.70457 0.0666411   8.47287  11.8646     9.09476  9.73582    191.354     43.7208     191.354     
1 1 1 24 10 51 o 11 51.9287 4.21139 48.4805     10.2782  51.0223     11.2403  38.141     180.045     10.5222     180.045     
1 1 1 24 10 52 o 10 116.908 2.83466 238.99      16.8634  252.628     16.2695  84.743     203.928     10.5972     203.928     
1 1 1 24 10 53 o 6  31.7222 5.39068 10.3984     8.68362  29.0316     9.12753  6.64175    87.6019     25.2267     267.602     
1 1 1 24 10 54 o 6  51.1275 4.44405 36.4418     10.868   62.4389     10.5267  30.2989    49.0221     5.30942     229.022     
1 1 1 24 10 55 o 18 16.1603 4.99859 0.663326    7.15749  -3.45859    8.40841  0.184885   356.742     1.89148     356.742     
1 1 1 24 10 56 o 6  83.1637 3.09733 126.428     13.1091  124.095     12.616   58.3325    164.163     5.86904     164.163     
1 1 1 24 10 57 o 7  87.933  2.9503  124.339     12.7505  156.319     13.0789  84.1185    46.3455     52.4633     46.3455     
1 1 1 24 10 58 o 18 48.5912 4.1844  35.5985     9.77687  53.4843     9.75875  34.2523    110.99      6.52958     110.99      
1 1 1 24 10 59 o 15 41.9123 4.63876 30.8567     9.18967  36.2171     9.64367  24.7186    311.561     3.45751     131.561     
1 1 1 24 10 60 o 18 32.7099 5.52816 21.3473     8.87042  21.2702     9.00653  14.7724    291.19      10.2709     111.19      
1 1 1 24 10 61 o 19 93.5296 3.16009 154.528     14.8695  165.606     14.6442  74.3082    73.0081     25.2317     73.0081     
1 1 1 24 10 62 o 3  53.6956 4.63533 59.5195     12.0885  51.1313     12.2454  29.1667    185.995     10.9486     5.99501     
1 1 1 24 10 63 o 1  18.8714 5.55135 6.33567     8.34813  -2.60175    9.77339  3.62434    176.209     6.14828     356.21      
1 1 1 24 10 64 o 7  24.8418 6.22126 15.3017     9.60388  7.26315     10.3939  4.32653    48.6974     1.5912      48.6974     
1 1 1 24 10 65 o 15 35.9922 6.20875 29.575      11.2413  24.6505     10.9961  24.4516    76.6222     14.7847     76.6222     
1 1 1 24 10 66 o 10 45.4526 5.87681 53.2548     12.6869  32.1849     12.7934  24.9892    299.245     6.06116     119.245     
1 1 1 24 10 67 o 19 37.8146 6.41667 30.411      12.0147  30.1325     11.9946  17.442     61.8795     10.5536     241.879     
1 1 1 24 10 68 f 0  26.627  6.66688 9.46792     11.5895  18.1216     11.2135  25.2207    35.8832     0           0           
1 1 1 24 10 69 o 4  39.3147 6.41779 32.9956     12.5352  32.4223     12.2421  19.5592    194.934     8.79237     14.9336     
1 1 1 24 10 70 o 10 28.9757 6.82408 13.9337     12.0215  21.5949     11.6005  9.74443    36.6115     13.9933     216.611     
1 1 1 24 10 71 o 8  27.8714 6.84301 11.207      12.1025  21.3569     11.9209  13.0118    209.516     4.02057     29.5156     
1 1 1 24 10 72 o 14 31.6704 6.98575 31.8998     12.5984  12.0503     14.4021  19.0537    151.305     6.17895     151.305     
1 1 1 24 10 73 o 11 28.4091 7.0235  6.40556     13.1466  28.591      13.6858  12.515     251.623     3.55905     71.6225     
1 1 1 24 10 74 o 13 21.3218 6.55195 7.30334     12.7315  1.34629     13.5861  2.59781    95.8621     2.21825     275.862     
1 1 1 24 10 75 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 10 76 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 11 0  o 4  211.769 2.72785 795.963     28.928   795.963     28.928   167.395    180         20.3372     180         
1 1 1 24 11 1  o 7  181.981 2.48752 597.741     22.6646  577.324     22.7011  142.787    257.116     25.0294     257.116     
1 1 1 24 11 2  f 0  72.7333 2.75857 98.1493     9.72714  90.2178     10.2639  168.614    146.804     0           0           
1 1 1 24 11 3  o 17 107.984 2.45989 209.492     13.5238  204.653     13.065   42.5557    281.035     64.3955     101.035     
1 1 1 24 11 4  o 6  355.602 3.37877 2249.27     60.2088  2241.98     60.2151  247.023    165.815     29.7182     345.815     
1 1 1 24 11 5  o 5  276.111 2.92779 1356.48     39.7307  1349.75     41.2746  219.171    126.308     34.6649     126.308     
1 1 1 24 11 6  o 1  294.772 3.0862  1556.92     46.425   1528.16     44.7522  241.977    266.413     52.5277     266.413     
1 1 1 24 11 7  o 4  141.045 2.38936 350.786     16.8787  355.001     16.8985  65.3342    130.289     70.2834     310.289     
1 1 1 24 11 8  o 12 129.445 2.41317 302.47      15.3793  292.468     15.8857  49.5323    59.9474     84.5606     239.947     
1 1 1 24 11 9  o 6  130.655 2.37033 307.328     15.4812  298.74      15.5303  90.3006    11.9836     0.807343    191.984     
1 1 1 24 11 10 o 15 128.758 2.42026 297.52      15.5941  291.128     15.6104  31.504     284.595     120.614     104.595     
1 1 1 24 11 11 o 12 80.763  2.75805 122.159     11.3386  110.058     10.916   47.5436    45.4267     18.2403     45.4268     
1 1 1 24 11 12 o 6  44.4149 3.72633 38.7122     7.76688  32.5248     8.36062  1.18691    252.966     31.5434     252.966     
1 1 1 24 11 13 o 5  42.6881 3.72168 31.8776     7.78849  33.8895     7.79106  5.34297    142.038     44.0506     142.038     
1 1 1 24 11 14 o 13 66.3918 3.04461 86.6911     10.0734  70.8997     10.0023  27.0077    123.561     21.0139     303.561     
1 1 1 24 11 15 f 0  71.6246 2.99087 92.237      11.5406  90.5816     9.77324  33.2928    304.789     0           0           
1 1 1 24 11 16 o 16 318.842 3.23054 1793.83     52.5369  1818.08     50.6702  277.548    13.2398     89.6578     13.2398     
1 1 1 24 11 17 o 1  140.708 2.43322 358.589     17.4205  344.151     16.8962  108.451    243.246     19.1888     243.246     
1 1 1 24 11 18 o 5  178.197 2.63657 560.442     23.6496  566.901     23.4381  131.022    239.696     6.24165     239.696     
1 1 1 24 11 19 o 3  127.535 2.61877 294.004     17.288   283.995     16.1478  86.2657    286.316     6.68765     106.316     
1 1 1 24 11 20 o 4  35.1811 4.65063 25.7817     7.82899  19.909      7.92522  0.494697   41.1663     7.17802     41.1663     
1 1 1 24 11 21 o 9  184.639 2.63178 624.734     23.7277  586.129     24.9054  79.125     215.688     109.003     35.6882     
1 1 1 24 11 22 o 3  134.23  2.53991 323.002     17.069   317.22      17.0702  121.127    15.784      55.9743     15.784      
1 1 1 24 11 23 o 2  93.6277 2.79597 163.655     12.7956  148.514     13.3271  77.8256    348.871     34.7207     348.871     
1 1 1 24 11 24 o 2  212.026 2.82077 805.398     29.8799  792.059     30.0609  170.837    161.946     36.5421     161.946     
1 1 1 24 11 25 o 10 227.424 2.83752 918.979     32.1793  919.233     32.4991  123.301    148.613     82.3059     328.613     
1 1 1 24 11 26 o 17 74.9499 2.92181 105.64      10.7545  94.8224     11.0643  34.9021    305.825     29.6355     125.825     
1 1 1 24 11 27 o 19 47.905  4.14949 46.7395     9.69499  36.6554     9.675    12.2943    234.778     27.6779     54.7777     
1 1 1 24 11 28 o 14 36.5546 4.94311 22.1823     8.16848  27.353      9.30003  7.31725    264.765     52.3678     264.765     
1 1 1 24 11 29 o 1  127.12  2.64368 294.064     16.3069  280.934     17.2951  106.433    310.488     36.4288     310.488     
1 1 1 24 11 30 o 16 59.7659 3.44572 68.5963     9.59116  59.6847     10.7068  28.7157    238.748     14.8908     238.748     
1 1 1 24 11 31 o 2  57.8036 3.39385 54.3191     9.04793  65.8598     10.4542  1.28159    60.5793     73.945      240.579     
1 1 1 24 11 32 o 10 135.478 2.61295 332.831     17.148   320.531     18.2556  116.572    60.2804     44.4034     60.2804     
1 1 1 24 11 33 o 4  94.1287 3.15154 153.711     12.6949  162.84      16.7697  46.5103    12.6273     36.9407     192.627     
1 1 1 24 11 34 o 6  125.439 2.73982 265.434     17.6291  295.688     16.6709  126.086    343.831     82.3206     343.831     
1 1 1 24 11 35 o 6  30.1032 5.59133 23.6988     9.54939  10.6783     8.02431  0.786392   257.818     17.8071     257.818     
1 1 1 24 11 36 o 11 156.704 2.8562  454.296     21.8605  421.584     22.9001  165.092    335.281     114.441     335.281     
1 1 1 24 11 37 o 2  144.598 2.5507  385.928     18.6769  359.155     18.2689  101.191    91.0289     0.100175    271.029     
1 1 1 24 11 38 o 11 103.986 2.64203 191.328     14.2054  194.495     13.2603  87.0679    295.056     33.9087     295.056     
1 1 1 24 11 39 f 0  86.8089 2.80242 138.959     12.282   130.47      12.034   39.7223    154.797     0           0           
1 1 1 24 11 40 o 5  57.1492 3.44569 61.5164     9.47106  56.3285     10.0239  40.9029    69.5606     15.048      69.5606     
1 1 1 24 11 41 o 16 75.4286 2.95028 102.009     10.944   101.886     11.2707  55.5123    87.2139     10.4175     87.2139     
1 1 1 24 11 42 o 6  28.9072 5.31709 19.6926     7.9015   11.8703     7.91071  7.39516    266.452     6.27115     86.4516     
1 1 1 24 11 43 o 7  63.9623 3.48189 79.8247     10.8506  68.1248     11.2052  30.9992    210.848     24.7445     30.8485     
1 1 1 24 11 44 o 19 162.245 2.99464 489.473     22.203   453.867     26.1183  130.659    215.303     34.8807     215.303     
1 1 1 24 11 45 o 5  49.8901 4.231   50.9741     9.58759  40.6896     10.7937  26.138     77.3061     12.9339     257.306     
1 1 1 24 11 46 o 13 85.6716 3.03502 140.127     12.4749  124.086     13.3878  62.1041    358.139     7.39988     358.139     
1 1 1 24 11 47 o 8  94.3711 3.03153 161.428     13.82    159.035     14.7547  97.4891    94.8625     69.1102     94.8625     
1 1 1 24 11 48 f 0  25.3476 5.86313 8.90662     8.33307  14.4353     8.98827  5.12532    183.782     0           0           
1 1 1 24 11 49 o 7  16.9845 5.16388 -0.327877   7.50564  0.332173    8.3328   2.64964    51.4809     15.0732     51.4809     
1 1 1 24 11 50 o 2  62.6777 3.42989 69.3816     10.4897  73.4621     10.8907  31.6879    183.34      20.6179     3.33958     
1 1 1 24 11 51 o 1  42.8644 4.58105 34.631      9.26745  34.2509     9.78771  31.3616    337.629     11.5584     337.629     
1 1 1 24 11 52 o 19 17.07   5.15409 -1.24987    7.4651   2.05569     8.17315  2.55327    16.3123     17.0847     16.3123     
1 1 1 24 11 53 o 16 46.1144 4.32837 46.6663     9.0162   33.12       9.97602  28.456     185.022     1.80918     5.02233     
1 1 1 24 11 54 o 18 24.9356 5.53246 16.3317     8.00225  6.20329     8.20638  4.07604    351.128     19.7584     171.128     
1 1 1 24 11 55 o 10 24.5589 5.65022 14.2789     8.02934  7.71893     8.30632  7.52932    81.1183     10.6863     261.118     
1 1 1 24 11 56 o 19 57.9794 3.87643 65.1297     10.7925  59.1803     11.3954  26.2242    290.24      24.4529     110.24      
1 1 1 24 11 57 o 14 51.5406 4.29315 49.7454     10.0506  49.8962     11.6216  28.5888    210.938     10.2427     30.9379     
1 1 1 24 11 58 o 3  88.9677 3.08635 137.87      12.9955  150.727     14.4467  61.8871    49.6036     4.97304     49.6037     
1 1 1 24 11 59 o 13 16.1868 5.09032 -6.53913    7.72101  1.8927      9.07501  1.27408    31.3065     6.2792      211.307     
1 1 1 24 11 60 o 17 24.8738 6.06585 12.012      8.56862  11.4392     9.82542  11.4355    6.40713     1.87859     186.407     
1 1 1 24 11 61 o 5  36.1434 5.69942 32.5968     9.3259   20.4979     10.9882  23.5564    278.4       3.9464      278.4       
1 1 1 24 11 62 o 13 18.067  5.42965 -1.62819    8.94222  4.23488     8.51448  2.7335     251.599     4.91793     71.599      
1 1 1 24 11 63 o 19 38.8785 5.54289 31.3747     10.3646  29.7472     10.4863  22.4396    182.62      2.62107     2.61956     
1 1 1 24 11 64 o 10 40.3364 5.51115 31.6058     10.4439  34.2231     11.0338  25.6533    50.8894     2.70957     50.8893     
1 1 1 24 11 65 o 4  24.8872 6.28045 19.3758     11.4137  3.78095     9.40462  5.47195    10.9511     15.7375     190.951     
1 1 1 24 11 66 o 6  21.0859 6.10806 4.86491     10.9045  5.94412     9.70437  5.30106    250.415     6.38523     70.4151     
1 1 1 24 11 67 o 6  22.9015 6.37464 12.8853     10.9525  1.75948     11.3966  7.64118    328.25      0.609128    328.25      
1 1 1 24 11 68 o 18 25.4819 6.79619 8.99347     11.6012  15.2483     12.2502  5.63761    208.972     17.8996     28.9721     
1 1 1 24 11 69 o 8  18.3589 5.8325  -2.52151    10.9278  -0.974825   11.4486  3.73028    45.0084     5.86319     225.008     
1 1 1 24 11 70 o 7  17.8391 5.6949  -10.0487    11.1656  2.85606     11.1224  0.115076   107.958     17.7074     107.958     
1 1 1 24 11 71 o 15 23.803  6.6751  10.7864     12.1109  9.87098     11.5978  2.74917    86.5347     20.5885     266.535     
1 1 1 24 11 72 o 9  23.1849 6.71528 11.9139     12.4449  6.19491     12.6227  6.57534    119.246     6.79623     299.246     
1 1 1 24 11 73 o 9  20.5048 6.31867 8.66168     12.4203  -3.02112    12.6078  2.69716    81.5788     8.92773     261.579     
1 1 1 24 11 74 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 12 0  o 1  242.751 2.76546 1045.85     33.623   1045.85     33.623   208.436    8.45526e-06 55.8311     8.45525e-06 
1 1 1 24 12 1  o 17 202.44  2.63571 733.746     26.7643  720.906     26.7136  162.834    60.4781     31.9041     60.4781     
1 1 1 24 12 2  o 18 122.658 2.37055 267.962     14.5865  266.279     14.5291  28.0682    337.918     119.783     157.918     
1 1 1 24 12 3  o 1  155.532 2.48646 422.749     19.719   435.776     19.0215  130.844    24.2961     41.1156     24.2961     
1 1 1 24 12 4  o 2  258.077 2.8192  1204.61     36.4589  1160.29     36.4546  179.804    17.9996     19.3627     198         
1 1 1 24 12 5  o 2  183.507 2.56864 606.795     24.0605  588.502     23.1848  118.885    269.46      28.6751     89.4596     
1 1 1 24 12 6  o 17 139.197 2.4537  350.261     17.098   337.641     17.1159  113.045    84.6614     30.5704     84.6614     
1 1 1 24 12 7  o 13 158.881 2.46029 456.317     19.1952  439.634     19.9566  89.8567    299.659     49.8051     119.659     
1 1 1 24 12 8  o 2  122.377 2.43025 267.595     14.8793  264.322     14.8994  69.3833    76.0074     34.2872     256.007     
1 1 1 24 12 9  o 4  30.6751 4.89864 15.7301     7.29397  19.1901     7.42854  3.93894    160.882     13.669      160.882     
1 1 1 24 12 10 o 11 214.772 2.617   829.828     28.155   807.755     28.1751  151.032    33.8536     11.3125     213.854     
1 1 1 24 12 11 o 16 187.856 2.53801 644.155     24.3313  608.791     23.458   148.315    250.08      24.7898     250.08      
1 1 1 24 12 12 f 0  146.068 2.54629 384.509     18.182   373.18      19.0528  97.9913    107.519     0           0           
1 1 1 24 12 13 o 19 96.7567 2.60524 168.314     12.3234  164.554     12.8815  50.1275    139.893     33.6534     319.893     
1 1 1 24 12 14 o 10 107.918 2.44761 207.758     13.1757  206.074     13.2639  56.7161    148.351     38.4038     328.351     
1 1 1 24 12 15 o 18 119.039 2.54293 249.644     15.3932  253.916     14.9028  81.1073    271.809     5.56472     91.809      
1 1 1 24 12 16 o 3  106.31  2.48909 200.8       13.1996  200.882     13.2856  65.8856    271.747     16.9059     91.7469     
1 1 1 24 12 17 o 11 72.8947 2.87925 88.4061     10.7077  101.178     10.1607  30.4206    172.476     36.214      352.476     
1 1 1 24 12 18 o 9  180.288 2.59502 599.077     23.8365  555.669     23.0535  165.171    173.175     71.6239     173.175     
1 1 1 24 12 19 o 14 140.899 2.63824 347.28      18.7655  358.428     18.4493  94.5705    176.084     12.2789     356.084     
1 1 1 24 12 20 o 5  188.604 2.55552 642.985     25.047   620.58      23.254   158.98     188.791     46.135      188.791     
1 1 1 24 12 21 o 13 229.521 2.78044 943.705     31.882   928.493     32.0772  127.436    33.9899     79.377      213.99      
1 1 1 24 12 22 o 15 62.8198 3.33119 77.0759     10.4048  64.4338     10.352   4.83623    278.369     74.5458     98.3693     
1 1 1 24 12 23 o 6  151.065 2.63927 410.614     20.6635  400.63      19.2708  117.199    39.1314     19.0412     39.1314     
1 1 1 24 12 24 o 15 186.623 2.77221 623.845     25.7933  614.357     26.0568  157.107    314.51      46.2513     314.51      
1 1 1 24 12 25 o 18 46.3522 3.90904 48.582      8.40929  30.2377     8.80601  13.3366    311.774     22.154      131.774     
1 1 1 24 12 26 o 4  134.807 2.52548 321.71      17.041   324.649     17.0518  125.531    187.89      63.0873     187.89      
1 1 1 24 12 27 o 3  85.8798 2.75721 129.932     11.5482  132.946     12.1212  27.4666    292.396     64.4535     112.396     
1 1 1 24 12 28 f 0  33.5651 5.02326 23.3385     8.22978  18.6823     8.1529   22.0831    355.397     0           0           
1 1 1 24 12 29 f 0  51.6771 3.91553 44.3017     9.8097   52.3711     10.1168  21.0203    33.8654     0           0           
1 1 1 24 12 30 o 3  63.6048 3.4626  73.5374     11.5565  71.6783     10.3248  20.0384    110.586     44.7054     290.586     
1 1 1 24 12 31 o 3  90.8723 2.89204 152.986     13.5272  141.866     12.7497  70.2987    160.507     17.8631     160.507     
1 1 1 24 12 32 o 10 171.866 2.73018 535.311     24.3888  516.722     22.6333  130.868    157.766     17.1728     157.766     
1 1 1 24 12 33 o 10 67.0264 3.35912 80.4048     10.5226  80.8654     11.8574  32.1533    129.421     24.2875     309.421     
1 1 1 24 12 34 o 10 43.6498 4.575   38.7925     9.18135  31.3865     10.0155  15.8777    117.521     12.7325     297.521     
1 1 1 24 12 35 o 7  87.4338 3.14403 143.616     12.746   130.273     14.5352  69.9623    277.287     23.8095     277.287     
1 1 1 24 12 36 o 2  89.9734 3.1099  144.395     12.866   145.473     15.0138  73.9479    237.198     27.9441     237.198     
1 1 1 24 12 37 o 18 37.8512 5.08714 29.6335     8.42509  23.9452     10.023   1.25573    278.918     42.2507     98.9182     
1 1 1 24 12 38 o 10 46.7489 4.17448 36.9966     9.52897  42.9998     9.54264  19.2741    245.102     19.5619     65.1022     
1 1 1 24 12 39 o 8  103.009 2.81576 205.191     14.3995  174.923     14.5334  63.6525    253.514     16.3599     73.5136     
1 1 1 24 12 40 o 6  29.9867 5.60294 22.8067     9.03317  11.3427     8.54076  1.4497     121.28      32.6803     301.28      
1 1 1 24 12 41 o 9  19.013  5.46091 0.0538954   8.24518  5.2158      8.25786  5.64132    180.139     27.0703     180.139     
1 1 1 24 12 42 o 4  65.6283 3.32819 79.4169     11.2333  76.0394     10.5131  63.2059    9.65032     43.243      9.65032     
1 1 1 24 12 43 o 13 67.7858 3.33978 88.6209     11.6118  77.5168     10.9333  53.1122    11.2006     15.2543     11.2006     
1 1 1 24 12 44 o 16 97.1812 2.72979 171.259     13.77    167.4       12.7563  72.8855    21.442      11.5666     21.442      
1 1 1 24 12 45 o 1  20.4483 5.36814 10.3207     8.1902   1.13976     7.05449  1.13177    60.929      19.4953     60.9291     
1 1 1 24 12 46 o 7  64.6438 3.37515 68.8377     10.6936  83.0147     10.9657  14.9006    119.566     58.6814     299.566     
1 1 1 24 12 47 o 8  94.3286 2.89531 145.841     13.3514  175.104     13.9145  79.4251    252.643     29.9817     252.643     
1 1 1 24 12 48 o 7  62.3993 3.52005 69.0404     9.92132  72.763      11.8604  52.7349    104.074     23.6441     104.074     
1 1 1 24 12 49 o 4  104.975 2.82653 197.9       14.506   198.806     15.1724  78.0929    182.84      12.2347     182.84      
1 1 1 24 12 50 o 12 24.9255 5.79228 12.0972     7.93656  10.6289     8.86117  6.60049    32.255      11.6559     212.255     
1 1 1 24 12 51 o 14 73.4032 3.40383 94.5685     11.3083  101.493     13.554   46.2472    46.3796     6.56584     226.38      
1 1 1 24 12 52 o 8  79.5787 3.32575 125.857     11.744   104.756     14.1936  47.0407    340.275     13.683      160.275     
1 1 1 24 12 53 o 8  73.3203 3.4512  94.6114     11.3458  101.607     13.8155  50.8814    235.554     3.29403     235.554     
1 1 1 24 12 54 o 15 27.7649 6.03963 14.1313     8.36496  15.909      10.0901  7.12492    139.916     19.0868     319.916     
1 1 1 24 12 55 o 18 82.3214 3.28335 118.765     12.2816  128.682     14.6656  64.8248    34.3691     19.1167     34.3691     
1 1 1 24 12 56 o 5  95.081  3.04969 150.56      13.22    179.103     15.793   73.2288    160.817     18.4432     160.817     
1 1 1 24 12 57 o 15 59.2123 3.83826 66.8688     10.7383  63.6716     11.7218  43.5285    329.883     9.20338     329.883     
1 1 1 24 12 58 o 16 54.7517 3.9496  57.3388     10.3289  55.069      11.0042  21.4552    279.522     29.5624     99.5219     
1 1 1 24 12 59 o 2  19.0413 5.49382 7.54204     8.6734   -1.43803    8.48136  3.00653    311.946     12.1194     131.946     
1 1 1 24 12 60 o 9  25.7084 5.93899 10.1992     8.64551  16.0487     9.14966  11.6243    275.162     4.10277     95.1618     
1 1 1 24 12 61 o 12 55.6654 4.10837 55.8295     11.491   61.8168     11.0227  36.4731    48.9423     0.904295    48.9421     
1 1 1 24 12 62 o 15 37.5164 5.61664 32.3699     10.3748  25.1626     10.11    21.8401    320.252     1.83512     140.252     
1 1 1 24 12 63 o 9  24.8578 6.12338 12.2873     9.63043  11.9688     9.08757  8.30242    195.209     8.84605     15.2085     
1 1 1 24 12 64 o 11 35.1147 6.05113 39.9828     11.7934  12.9895     10.8403  17.7815    267.071     6.2259      87.0713     
1 1 1 24 12 65 o 5  36.348  6.22737 35.4112     12.5325  21.1122     10.1237  25.0372    38.2843     8.58572     38.2843     
1 1 1 24 12 66 o 1  49.7564 5.78229 47.1591     15.1826  53.5964     12.1604  37.6913    285.124     13.4483     285.124     
1 1 1 24 12 67 o 19 69.6459 4.29215 93.7384     15.0585  92.4489     14.602   57.8004    298.433     26.6484     298.433     
1 1 1 24 12 68 o 19 21.0382 6.24981 8.25672     11.5307  0.742801    11.0491  6.90184    4.68869     3.94305     184.689     
1 1 1 24 12 69 o 16 22.321  6.45145 6.12232     11.4689  8.82595     11.4629  3.41667    202.69      17.3609     22.6895     
1 1 1 24 12 70 f 0  21.3193 6.15868 15.0271     11.7401  -7.23888    11.2947  13.0409    125.819     0           0           
1 1 1 24 12 71 o 16 16.6476 5.49029 -10.1374    11.8915  -2.44608    10.8724  0.299376   330.575     4.94826     150.575     
1 1 1 24 12 72 o 15 26.8977 6.91491 3.69933     13.5084  26.551      13.2434  10.1442    228.683     2.47538     48.6832     
1 1 1 24 12 73 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 13 0  o 13 167.136 2.51127 496.069     21.0127  496.069     21.0127  117.688    1.12384e-08 13.6239     180         
1 1 1 24 13 1  o 14 205.677 2.57187 761.517     26.5181  740.507     26.4967  177.198    291.836     53.8828     291.836     
1 1 1 24 13 2  o 3  217.929 2.68798 839.126     28.8098  847.407     29.8975  160.01     225.378     0.104003    45.3745     
1 1 1 24 13 3  o 12 96.9405 2.61066 162.194     12.3912  172.036     12.93    59.1394    270.654     16.3237     90.6545     
1 1 1 24 13 4  o 7  191.375 2.58675 671.349     25.2677  629.383     24.351   162.113    138.708     45.3309     138.708     
1 1 1 24 13 5  o 16 104.169 2.52779 187.235     13.0619  198.557     13.2879  46.2915    105.967     55.531      285.967     
1 1 1 24 13 6  o 18 120.386 2.49734 256.457     14.9947  258.515     15.1058  70.5825    171.47      31.1849     351.47      
1 1 1 24 13 7  o 9  292.485 3.13415 1506.88     45.0579  1533.71     46.8165  224.648    149.77      17.4091     149.77      
1 1 1 24 13 8  o 11 249.597 2.7701  1110.72     34.6227  1102.16     34.6754  210.985    227.579     55.092      227.579     
1 1 1 24 13 9  f 0  88.2992 2.6584  133.097     11.6908  144.418     11.7704  54.7279    320.814     0           0           
1 1 1 24 13 10 o 8  188.714 2.53146 635.526     23.9322  629.061     23.9486  118.956    198.194     38.2483     18.1937     
1 1 1 24 13 11 o 7  241.407 2.81669 1062.18     34.7151  1008.68     33.4411  205.749    337.71      57.4681     337.71      
1 1 1 24 13 12 o 8  266.684 3.00614 1274.84     38.6808  1253.15     41.5906  217.682    279.723     43.3505     279.723     
1 1 1 24 13 13 o 2  86.3231 2.72775 122.541     12.0221  143.127     11.4058  49.4887    90.3679     19.397      270.368     
1 1 1 24 13 14 o 8  115.179 2.52334 232.814     14.2555  238.836     14.8391  93.1919    209.9       25.2267     209.9       
1 1 1 24 13 15 o 17 81.8748 2.67458 119.729     10.9203  118.953     10.9682  56.7429    166.088     41.5391     166.088     
1 1 1 24 13 16 o 11 29.7093 5.18583 19.4344     7.65267  13.418      7.82193  14.5234    85.5029     54.1805     85.5029     
1 1 1 24 13 17 o 6  84.7189 2.69737 135.36      11.3564  120.438     11.4525  31.2916    350.633     55.5066     170.633     
1 1 1 24 13 18 o 19 116.871 2.5079  243.631     14.5228  242.074     14.8177  82.0353    359.83      1.27431     179.83      
1 1 1 24 13 19 o 5  155.152 2.54484 431.969     19.8445  423.405     19.7288  103.6      18.6811     16.8055     198.681     
1 1 1 24 13 20 o 10 71.6465 2.91197 96.7222     10.5611  86.5921     10.2519  20.2943    54.6803     57.3981     234.68      
1 1 1 24 13 21 o 3  102.799 2.45268 182.628     12.5496  193.376     12.6806  43.1328    203.452     59.5701     23.4521     
1 1 1 24 13 22 o 7  119.846 2.53795 254.661     14.8303  256.332     15.6132  52.6921    90.2735     66.2274     270.273     
1 1 1 24 13 23 o 15 40.6793 4.37703 35.9965     9.05068  25.0104     8.1571   9.41945    268.542     11.019      88.5425     
1 1 1 24 13 24 f 0  115.455 2.83644 248.174     16.1788  226.979     16.5499  79.0136    69.493      0           0           
1 1 1 24 13 25 o 17 48.5224 4.22888 44.0914     10.6272  41.4196     9.49853  21.8152    28.6076     6.04262     208.608     
1 1 1 24 13 26 o 19 43.1548 4.57834 25.4473     9.55959  43.9799     8.91071  11.5469    323.327     24.1906     143.327     
1 1 1 24 13 27 o 4  74.6628 3.24387 103.974     11.9252  95.6665     12.2015  45.9664    214.274     8.34557     34.2735     
1 1 1 24 13 28 o 5  109.933 2.98389 222.616     16.3341  208.858     16.4651  99.5463    251.934     47.7052     251.934     
1 1 1 24 13 29 o 14 96.3785 2.92985 172.931     13.6433  158.927     14.5201  89.3413    247.046     50.2355     247.046     
1 1 1 24 13 30 o 19 23.5411 5.56269 8.36042     7.69118  10.6283     7.76773  8.72697    149.46      30.6773     149.46      
1 1 1 24 13 31 o 19 115.048 2.70427 234.677     14.8057  237.523     16.3053  74.7375    342.541     12.4295     162.541     
1 1 1 24 13 32 o 6  38.5944 4.70251 28.3782     8.51     26.8014     9.00294  7.21851    336.938     25.765      156.938     
1 1 1 24 13 33 o 7  46.3876 4.00832 37.9247     9.06957  40.4826     9.17405  21.525     0.605312    6.08        180.605     
1 1 1 24 13 34 o 4  128.895 2.58565 302.686     16.8055  290.071     16.5633  74.51      314.806     33.561      134.806     
1 1 1 24 13 35 o 6  107.022 2.69118 213.878     14.7174  195.458     14.1032  94.8204    197.115     41.6468     197.115     
1 1 1 24 13 36 o 8  107.729 2.81651 206.111     13.9015  208.916     16.3685  79.4586    298.111     7.94362     298.111     
1 1 1 24 13 37 o 15 32.3575 5.44402 21.4932     8.13192  18.1378     9.31988  12.3629    197.472     5.85226     17.4722     
1 1 1 24 13 38 o 16 64.8801 3.59587 79.055      11.6176  73.1818     11.5663  30.4759    81.7555     28.5947     261.755     
1 1 1 24 13 39 o 2  33.2904 5.55648 21.2834     9.02195  20.9698     9.21882  10.2163    312.712     19.8895     132.712     
1 1 1 24 13 40 o 3  37.7767 5.16044 28.6369     9.19137  25.2786     9.6191   19.404     150.507     7.22293     330.507     
1 1 1 24 13 41 o 16 96.7286 2.91557 160.838     14.5816  175.26      13.5306  67.5906    90.3197     0.232273    90.3197     
1 1 1 24 13 42 o 8  34.926  5.55862 23.4771     9.70183  23.3051     9.28564  6.94577    56.0613     30.5592     236.061     
1 1 1 24 13 43 f 0  23.4565 5.85882 15.4374     9.53506  0.257973    9.18531  4.08214    177.755     0           0           
1 1 1 24 13 44 o 4  66.2242 3.51287 69.8427     11.4363  90.1446     11.5674  55.8687    264.859     23.2403     264.859     
1 1 1 24 13 45 o 9  23.6108 5.79233 12.9066     8.45017  5.59392     8.78883  0.564891   50.2822     27.2785     50.2822     
1 1 1 24 13 46 o 5  14.7439 4.74358 -5.58079    7.10934  -2.64732    8.21325  4.59123    321.78      17.4907     321.78      
1 1 1 24 13 47 o 15 78.9622 3.25741 116.55      12.2516  109.484     13.3422  63.5392    100.154     19.6916     100.154     
1 1 1 24 13 48 o 12 61.1906 3.91928 62.9423     10.3046  74.8907     13.4566  45.215     200.872     8.81336     200.872     
1 1 1 24 13 49 o 3  131.93  2.78263 306.219     17.3724  320.563     19.3638  113.152    3.96957     44.2826     3.96957     
1 1 1 24 13 50 o 11 83.8459 3.16329 122.8       11.9769  132.219     14.4641  56.1826    185.916     2.04819     5.91585     
1 1 1 24 13 51 o 6  58.6475 3.52256 63.5535     10.1054  62.4192     10.3984  24.7165    186.295     29.7247     6.29528     
1 1 1 24 13 52 o 15 52.3966 3.87226 44.3411     9.84431  57.6912     10.0542  39.1895    352.372     9.65465     352.372     
1 1 1 24 13 53 o 6  57.5274 3.65978 61.4902     10.3147  60.5775     10.5571  41.1217    245.651     5.70676     245.651     
1 1 1 24 13 54 o 1  43.3672 4.70436 39.3329     9.42248  32.6879     10.1973  37.4648    201.534     22.0887     201.534     
1 1 1 24 13 55 o 12 49.3345 4.3553  45.3089     10.8222  46.8601     10.2145  42.3443    217.43      21.7349     217.43      
1 1 1 24 13 56 o 4  85.6234 3.09056 142.54      12.7448  125.902     13.5754  66.8967    31.7555     18.5849     31.7555     
1 1 1 24 13 57 o 14 29.2655 5.97743 23.0914     9.10868  10.9741     10.4883  17.8509    216.311     3.86148     216.311     
1 1 1 24 13 58 o 16 20.3939 5.49329 -1.81834    8.43187  11.7893     8.52564  4.56483    68.567      11.3633     248.567     
1 1 1 24 13 59 o 19 16.1315 5.04502 -5.7389     8.12308  2.09293     8.31125  1.10899    158.049     5.98587     338.049     
1 1 1 24 13 60 o 9  40.4723 5.07053 31.7149     9.94148  33.3191     9.86942  13.1777    148.331     25.578      328.331     
1 1 1 24 13 61 o 16 45.9343 4.7046  34.4649     10.3312  48.4605     10.4216  27.7306    191.677     2.78539     11.677      
1 1 1 24 13 62 f 0  23.0934 6.08505 6.15014     10.2138  12.1937     9.10451  24.3279    85.8199     0           0           
1 1 1 24 13 63 f 0  18.5491 5.72545 4.63206     11.2869  -3.16784    8.78495  4.31721    2.31099     0           0           
1 1 1 24 13 64 o 12 38.5742 6.09899 34.0445     12.5969  28.3677     10.4056  26.8637    131.487     7.53707     131.487     
1 1 1 24 13 65 o 7  21.5433 6.36564 4.17454     12.4153  5.94214     10.6246  7.07485    189.607     0.080694    189.607     
1 1 1 24 13 66 o 14 30.2473 6.70085 36.6412     14.6142  2.58378     11.2665  17.4305    99.0746     0.928487    99.0746     
1 1 1 24 13 67 o 5  26.0074 6.83722 7.05766     12.2678  19.3779     12.3892  13.2494    237.495     1.64262     237.495     
1 1 1 24 13 68 o 10 23.4666 6.52742 4.01739     12.0549  14.4568     11.2876  8.88319    217.771     4.07248     37.771      
1 1 1 24 13 69 o 7  24.3138 6.62445 2.01218     12.5139  18.8744     12.0114  8.98635    290.079     1.81511     110.079     
1 1 1 24 13 70 o 13 28.5246 7.22508 18.0517     13.4001  21.0062     12.8961  11.9002    61.9747     5.1527      241.975     
1 1 1 24 13 71 o 19 21.7692 6.50625 -13.576     15.5971  15.5422     12.6615  3.01881    260.853     2.94427     80.8531     
1 1 1 24 13 72 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 14 0  o 14 43.1494 4.00941 34.7472     8.25469  34.7472     8.25469  7.9156     180         36.9472     3.59435e-05 
1 1 1 24 14 1  o 1  76.6602 2.78161 99.7154     10.6461  109.798     10.6349  8.66963    76.8825     90.577      256.883     
1 1 1 24 14 2  o 5  199.418 2.64005 714.919     26.9175  697.989     25.849   181.34     43.5347     70.7914     43.5347     
1 1 1 24 14 3  f 0  174.367 2.54851 523.089     22.666   557.193     21.8216  160.814    120.763     0           0           
1 1 1 24 14 4  o 19 114.056 2.64354 240.676     15.2896  222.194     14.8848  77.2696    295.991     8.18445     115.991     
1 1 1 24 14 5  o 9  132.576 2.48645 311.436     16.4918  313.302     16.5185  110.609    356.461     31.449      356.461     
1 1 1 24 14 6  o 14 379.263 3.69573 2550.43     71.5188  2573.52     68.9292  276.513    320.739     10.2739     140.739     
1 1 1 24 14 7  o 9  84.5378 2.77458 123.106     11.5078  131.514     11.938   68.9782    0.522656    28.1792     0.522656    
1 1 1 24 14 8  o 16 194.943 2.4789  674.37      24.179   675.571     24.2557  127.119    78.3499     32.368      258.35      
1 1 1 24 14 9  o 1  101.548 2.60603 187.185     13.0597  179.748     13.4068  90.2304    102.042     42.4396     102.042     
1 1 1 24 14 10 o 19 127.029 2.43368 287.534     15.4313  286.079     15.5252  106.469    8.31254     32.0383     8.31253     
1 1 1 24 14 11 o 1  101.008 2.70951 187.942     13.7373  175.331     13.6345  59.5374    18.4705     23.9435     198.471     
1 1 1 24 14 12 o 3  136.558 2.49877 343.191     17.0442  319.813     17.121   98.6489    23.1791     0.297747    23.1791     
1 1 1 24 14 13 o 8  165.555 2.56581 482.464     20.6042  491.59      21.9607  133.754    293.764     27.0112     293.764     
1 1 1 24 14 14 o 11 119.349 2.59084 255.074     15.3261  251.678     15.6253  66.659     57.6613     38.3811     237.661     
1 1 1 24 14 15 o 15 105.865 2.55735 197.176     13.4859  201.64      13.6094  88.9447    140.713     30.7183     140.713     
1 1 1 24 14 16 o 1  131.359 2.60632 312.912     16.2639  301.049     17.937   108.283    6.87469     28.8773     6.87469     
1 1 1 24 14 17 o 6  75.854  2.90171 95.3351     10.6542  110.264     11.3186  56.923     51.3778     15.3948     51.3778     
1 1 1 24 14 18 o 11 29.4471 5.33424 16.3603     7.61616  15.9737     8.20332  10.9873    23.4028     48.2095     23.4028     
1 1 1 24 14 19 o 18 174.46  2.80857 557.849     24.5782  525.432     24.5171  146.18     157.154     39.3747     157.154     
1 1 1 24 14 20 o 8  251.215 3.10358 1133.2      38.9225  1115.05     39.2171  200.016    253.686     32.198      253.686     
1 1 1 24 14 21 o 1  64.3482 3.71292 77.8028     11.3238  71.1227     12.3198  41.5091    76.5486     1.28331     76.5487     
1 1 1 24 14 22 o 14 98.4386 3.01494 176.065     14.6389  169.857     15.0235  86.6593    235.439     38.3897     235.439     
1 1 1 24 14 23 o 9  51.5514 4.82469 39.706      11.5052  58.3236     12.6156  18.8034    132.043     27.2501     312.043     
1 1 1 24 14 24 o 19 44.459  4.93019 35.1574     10.5377  37.6531     10.7054  18.1948    331.835     5.93789     151.835     
1 1 1 24 14 25 o 8  44.5037 4.39367 38.6916     8.81023  33.8198     10.0607  6.6196     110.701     1.68196     110.701     
1 1 1 24 14 26 o 7  53.9262 3.74091 59.7685     9.52766  45.7695     10.1569  26.7043    29.2866     13.433      209.287     
1 1 1 24 14 27 o 9  54.5756 3.60179 57.616      9.45869  50.0121     9.92605  19.257     197.338     11.3779     197.338     
1 1 1 24 14 28 o 16 149.516 2.72359 412.536     21.1115  385.123     19.6755  116.943    151.724     19.9736     151.724     
1 1 1 24 14 29 o 14 44.1051 4.28682 33.5665     9.28016  37.7306     9.12699  18.5777    169.736     2.34173     349.736     
1 1 1 24 14 30 o 7  112.436 2.75957 211.925     14.5597  239.996     16.5065  63.3855    128.727     32.7037     308.727     
1 1 1 24 14 31 o 4  164.075 2.63672 481.01      21.0414  478.971     22.298   132.88     53.226      30.8423     53.226      
1 1 1 24 14 32 o 7  28.6844 5.87438 16.916      8.40528  13.6593     9.59779  4.98568    71.8719     40.4402     71.8719     
1 1 1 24 14 33 o 19 54.0234 4.0483  49.508      9.71767  56.8491     11.8677  27.7075    115.14      16.1502     295.14      
1 1 1 24 14 34 o 7  79.6961 3.35423 115.118     12.3275  113.402     14.2514  44.3893    128.735     22.9161     308.735     
1 1 1 24 14 35 o 8  48.0208 4.48852 40.8653     9.90399  44.0435     11.1665  38.0673    46.1207     17.5147     46.1207     
1 1 1 24 14 36 o 14 54.1902 3.84624 55.8537     10.1744  51.082      10.4004  46.6305    146.959     35.4358     146.959     
1 1 1 24 14 37 o 16 26.2858 5.74371 14.1185     8.44354  11.4623     8.25522  5.46679    101.611     15.8475     281.611     
1 1 1 24 14 38 o 11 35.4904 5.04034 30.4766     8.81884  17.7911     8.49616  16.1115    346.718     11.1977     166.718     
1 1 1 24 14 39 o 11 72.5648 3.08362 102.347     11.0016  87.6949     11.2457  51.3745    356.025     2.49108     356.025     
1 1 1 24 14 40 f 0  20.9804 5.50726 0.710185    7.39224  11.2894     8.75045  15.3518    247.029     0           0           
1 1 1 24 14 41 o 1  26.6762 5.71516 14.864      8.00811  11.8577     8.70336  7.89977    144.415     11.5005     324.415     
1 1 1 24 14 42 o 16 94.0755 3.01797 151.813     13.6226  167.431     14.7673  74.2995    349.642     17.653      349.642     
1 1 1 24 14 43 o 12 18.7605 5.12811 9.5292      7.44077  -7.54001    8.52582  0.447676   103.155     4.22635     283.155     
1 1 1 24 14 44 o 6  57.7233 3.60085 63.4052     9.68025  58.3561     10.8268  43.7492    308.938     10.3591     308.938     
1 1 1 24 14 45 o 4  82.2194 3.06976 112.269     12.7144  132.583     12.3906  57.7155    314.807     1.94583     314.807     
1 1 1 24 14 46 o 16 21.546  5.62705 10.1738     8.54412  3.97798     7.7757   3.92806    34.0788     8.21998     214.079     
1 1 1 24 14 47 o 18 43.9107 4.62489 29.0221     10.0303  44.2532     9.09248  31.4764    130.36      7.28717     130.36      
1 1 1 24 14 48 o 6  23.4667 5.83825 10.0508     9.11818  9.14723     7.92387  7.21847    76.7591     4.79986     256.759     
1 1 1 24 14 49 o 17 15.6244 4.8239  -6.35942    7.69223  2.27007     7.17209  0.0143492  149.839     1.09347     149.839     
1 1 1 24 14 50 o 3  73.542  3.39654 97.0192     12.4051  100.595     12.4919  37.608     278.724     25.5355     98.7244     
1 1 1 24 14 51 o 8  90.4699 3.02476 130.728     13.2     167.781     14.0806  53.6754    72.7717     16.9608     252.772     
1 1 1 24 14 52 o 18 35.9233 5.46837 35.4294     9.19872  16.2647     10.2243  25.9228    86.4246     8.29724     86.4246     
1 1 1 24 14 53 o 5  90.6476 3.02582 152.133     13.0774  147.526     14.2825  79.0013    26.7083     34.8329     26.7083     
1 1 1 24 14 54 o 18 39.7144 5.5726  25.7958     10.7543  37.5696     10.6013  32.4863    275.887     16.8488     275.887     
1 1 1 24 14 55 o 3  51.7359 4.49118 54.3616     11.2542  48.1306     11.4781  34.2713    329.571     0.229142    329.571     
1 1 1 24 14 56 o 15 48.1686 4.52511 43.6066     11.1008  45.7601     10.1299  32.857     131.405     2.93757     131.405     
1 1 1 24 14 57 o 8  44.3198 5.01818 40.4479     10.4248  36.988      11.0521  27.8325    114.886     1.45093     294.886     
1 1 1 24 14 58 o 14 41.8257 5.11841 32.2432     10.1783  37.3788     10.4878  34.9168    106.4       20.3677     106.4       
1 1 1 24 14 59 o 11 39.8853 5.30244 36.6419     10.2155  27.636      10.1499  25.3521    321.585     1.2023      321.585     
1 1 1 24 14 60 o 10 36.4345 5.75322 27.7225     10.1607  27.1747     10.3176  18.0111    327.683     8.79641     147.683     
1 1 1 24 14 61 o 18 19.4125 5.72304 3.7312      9.45893  3.62069     9.03569  3.41997    45.6137     8.88054     225.614     
1 1 1 24 14 62 o 7  40.1302 6.33392 33.6876     13.9414  34.4        10.8942  31.9908    358.947     17.696      358.947     
1 1 1 24 14 63 o 7  27.5838 6.61385 17.3197     11.7826  14.5194     10.0074  9.95875    35.4197     12.7066     215.42      
1 1 1 24 14 64 o 5  32.6112 6.11633 10.0003     12.321   34.1337     10.5699  13.8151    261.193     12.3594     81.1932     
1 1 1 24 14 65 o 15 27.3395 6.56113 7.59449     11.9222  22.5704     11.0985  15.2346    107.956     2.04179     107.956     
1 1 1 24 14 66 o 15 30.4756 7.45555 29.5705     15.8631  14.4708     12.1277  18.6276    270.688     5.72181     270.688     
1 1 1 24 14 67 o 1  45.0942 7.10205 56.3949     17.174   38.643      14.2257  36.054     102.778     19.4006     102.778     
1 1 1 24 14 68 o 19 20.8131 6.48793 -0.914223   15.5476  5.83786     11.474   4.30677    84.2376     5.44314     264.238     
1 1 1 24 14 69 o 4  24.8309 6.83933 -13.1419    17.0343  24.6156     13.556   3.17561    0.146947    0.345241    0.146947    
1 1 1 24 14 70 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 15 0  o 2  193.132 2.56527 662.584     24.8086  662.584     24.8086  122.724    180         43.3123     8.64507e-06 
1 1 1 24 15 1  o 4  65.0173 3.05119 74.2149     9.91733  76.8921     9.84951  9.64247    252.645     70.6655     72.6448     
1 1 1 24 15 2  o 9  65.0701 3.04241 65.0554     9.76194  87.0834     9.80527  14.1037    247.808     61.3363     67.8084     
1 1 1 24 15 3  o 9  69.9306 2.90635 83.143      10.1337  91.5264     10.1281  34.1966    288.221     26.4724     108.221     
1 1 1 24 15 4  o 15 102.582 2.60181 199.676     12.9802  175.277     13.6319  50.21      63.0645     47.0973     243.064     
1 1 1 24 15 5  o 7  119.19  2.58042 254.381     15.9297  251.094     14.8473  62.2852    111.832     48.4816     291.832     
1 1 1 24 15 6  o 14 248.059 2.81333 1122.96     34.9778  1066.18     34.9516  151.059    152.106     65.8706     332.106     
1 1 1 24 15 7  f 0  256.431 2.9062  1206.71     38.0703  1133.6      36.6275  179.476    257.444     0           0           
1 1 1 24 15 8  o 11 226.855 2.73187 917.796     30.4212  912.582     31.6774  156.282    130.632     23.0137     310.632     
1 1 1 24 15 9  o 16 221.483 2.7912  886.45      30.3148  858.769     31.6065  207.148    202.906     88.3823     202.906     
1 1 1 24 15 10 o 6  60.2382 3.35928 59.509      9.98083  70.8559     10.0815  36.8429    194.394     0.00809752  194.403     
1 1 1 24 15 11 o 14 54.0711 3.66173 54.5566     9.49825  50.7414     10.0589  14.5512    202.655     41.4405     22.6553     
1 1 1 24 15 12 o 9  158.116 2.60151 441.127     20.15    448.026     21.0737  110.05     220.765     11.1372     40.7646     
1 1 1 24 15 13 f 0  67.139  3.49053 88.1511     11.2722  73.8188     11.9045  61.2019    81.9103     0           0           
1 1 1 24 15 14 o 16 62.4553 3.51116 78.3769     11.1238  62.1433     10.6093  44.4762    133.299     19.6469     133.299     
1 1 1 24 15 15 o 14 46.4012 4.4468  42.3785     9.95319  36.27       10.1202  14.5934    314.34      25.958      134.34      
1 1 1 24 15 16 o 12 25.0839 6.06109 10.442      8.60258  10.6179     9.71237  17.2674    359.61      56.9047     359.61      
1 1 1 24 15 17 o 14 83.1581 3.26666 125.472     12.851   121.964     14.2097  64.4506    280.851     15.3689     280.851     
1 1 1 24 15 18 o 6  103.863 3.10935 185.943     15.6598  199.504     16.64    85.3912    229.172     24.4827     229.172     
1 1 1 24 15 19 o 9  17.3726 5.45121 -2.14682    9.09464  -4.20326    9.86006  10.1523    311.617     25.8218     311.617     
1 1 1 24 15 20 o 16 144.025 2.74608 365.795     18.9477  373.679     20.6362  118.464    27.5936     28.9664     27.5937     
1 1 1 24 15 21 o 9  100.415 2.90162 180.109     13.862   179.978     15.2446  70.1881    155.293     1.68954     335.294     
1 1 1 24 15 22 o 3  106.507 2.90558 210.201     14.7964  195.081     16.0691  106.428    272.092     67.3316     272.092     
1 1 1 24 15 23 o 15 61.1372 3.63975 67.8009     10.0392  66.9499     11.9469  41.7068    350.398     7.311       350.398     
1 1 1 24 15 24 o 8  111.489 2.6851  223.618     14.4625  219.964     15.4709  78.7892    93.8122     1.0529      273.812     
1 1 1 24 15 25 o 3  39.4764 4.84057 30.1353     8.77291  27.7173     9.63236  4.85983    109.711     36.181      289.711     
1 1 1 24 15 26 o 8  181.481 2.70748 588.885     23.1201  585.729     26.0311  146.267    335.746     29.7171     335.746     
1 1 1 24 15 27 o 10 42.1052 4.56391 40.4739     8.26827  25.6748     9.65496  4.95933    85.9618     43.2127     265.962     
1 1 1 24 15 28 o 6  95.0318 3.03586 155.162     14.1739  168.435     14.6652  89.1845    289.934     47.6525     289.934     
1 1 1 24 15 29 o 6  142.893 2.89044 364.485     20.1179  365.627     21.2226  118.693    264.251     32.1048     264.251     
1 1 1 24 15 30 o 17 22.7706 5.57814 13.6049     8.2537   1.42544     8.51383  8.11423    113.47      38.7191     113.47      
1 1 1 24 15 31 o 7  74.8209 3.39227 95.8884     12.2147  105.885     13.0955  39.5237    132.674     26.5016     312.674     
1 1 1 24 15 32 o 8  181.02  3.2022  596.448     28.8737  578.74      29.1894  137.825    2.59907     14.1075     2.59907     
1 1 1 24 15 33 o 3  54.7055 3.8327  55.9166     10.6221  53.0328     10.1185  27.3547    176.084     20.592      356.084     
1 1 1 24 15 34 o 16 38.4177 4.87634 25.8878     8.71247  29.5541     9.37936  7.14961    273.689     36.814      93.6889     
1 1 1 24 15 35 o 10 88.5628 3.11737 139.956     13.2869  142.318     14.286   74.2417    258.257     24.0709     258.257     
1 1 1 24 15 36 o 18 44.788  4.57326 43.4346     9.37701  31.5587     10.1655  12.7256    299.394     35.3158     119.394     
1 1 1 24 15 37 o 13 47.8304 4.25778 47.885      9.32405  36.9218     10.2765  24.0762    5.65913     16.2846     185.659     
1 1 1 24 15 38 o 14 44.1793 4.35735 33.8539     8.64251  38.7232     10.1352  18.2542    171.832     22.7161     351.832     
1 1 1 24 15 39 o 17 18.1665 5.13765 7.49674     7.25706  -5.94676    8.49814  6.70357    260.726     31.2274     260.726     
1 1 1 24 15 40 f 0  16.1463 4.97349 1.93688     7.15831  -5.84314    8.485    11.3706    192.912     0           0           
1 1 1 24 15 41 o 8  68.5003 3.41172 93.1351     11.1945  77.7603     11.9129  51.1338    200.658     7.99846     200.658     
1 1 1 24 15 42 o 2  61.3212 3.52918 70.8892     10.1842  66.3462     11.2367  34.1399    142.408     16.1229     322.408     
1 1 1 24 15 43 o 7  39.0008 4.84702 28.2119     8.6915   29.5682     9.56016  11.2313    23.878      29.2132     203.878     
1 1 1 24 15 44 o 4  36.0588 5.32678 25.0219     9.03341  25.2194     9.59502  17.8317    328.048     9.92672     148.048     
1 1 1 24 15 45 o 16 99.3551 2.89451 168.226     14.2279  188.509     14.513   72.0291    155.112     5.54659     155.112     
1 1 1 24 15 46 o 10 15.8024 4.87424 -4.80957    7.75813  1.75112     7.1618   1.2702     224.563     11.843      224.563     
1 1 1 24 15 47 o 12 45.8421 4.25489 37.747      9.63338  40.9367     9.41474  34.8369    218.283     10.0778     218.283     
1 1 1 24 15 48 o 1  100.687 2.84626 191.47      15.1423  175.553     13.5268  64.425     152.227     11.0523     332.227     
1 1 1 24 15 49 o 17 47.6847 4.35792 47.5655     10.8622  38.41       9.49117  36.3377    81.1001     9.79564     81.1001     
1 1 1 24 15 50 o 4  33.4157 5.69154 28.4319     10.8026  16.9021     8.17906  16.6943    101.995     9.0555      281.995     
1 1 1 24 15 51 o 14 112.317 2.77844 215.12      16.5267  243.168     14.4413  81.2875    238.556     7.47929     238.556     
1 1 1 24 15 52 o 3  39.1923 5.4411  31.6876     10.5106  29.4819     10.102   23.2772    99.8217     4.26042     279.822     
1 1 1 24 15 53 o 6  37.6265 5.35931 29.2226     9.94783  27.3376     9.56593  31.2111    253.453     19.1615     253.453     
1 1 1 24 15 54 o 3  49.4378 4.55754 44.8754     11.5262  49.4008     10.3606  34.8997    304.45      4.72695     304.45      
1 1 1 24 15 55 o 15 24.2152 6.09769 10.8052     9.63031  11.4623     9.02462  10.8576    134.264     1.49253     134.264     
1 1 1 24 15 56 o 7  75.4836 3.4284  97.48       13.122   114.632     12.5404  45.7743    281.862     10.2837     101.862     
1 1 1 24 15 57 o 17 72.8144 3.84728 81.1276     12.9374  120.61      14.81    56.8959    277.027     16.7534     277.027     
1 1 1 24 15 58 o 10 36.0733 6.4416  24.7092     10.4414  31.2676     12.8721  20.3145    157.855     3.31071     337.855     
1 1 1 24 15 59 o 12 37.5127 5.93842 25.8628     10.531   33.1032     11.2825  28.3695    149.065     17.1402     149.065     
1 1 1 24 15 60 o 17 21.0899 5.88397 -5.55303    9.76993  14.0557     10.5434  5.56935    101.863     0.885413    281.863     
1 1 1 24 15 61 o 19 31.8044 6.7862  17.677      12.2771  26.1432     11.6144  21.8539    251.865     10.5564     251.865     
1 1 1 24 15 62 o 9  23.8799 6.6587  3.3221      13.8067  13.3834     10.8491  6.93929    207.418     13.2882     27.4178     
1 1 1 24 15 63 o 7  41.3238 6.53258 41.0357     14.7378  33.5296     11.6551  26.6235    235.255     1.59271     235.255     
1 1 1 24 15 64 o 19 55.7581 5.51861 75.7246     17.0499  53.5372     13.0374  46.4741    342.326     22.0385     342.326     
1 1 1 24 15 65 o 9  39.1395 7.35577 25.1625     16.5527  48.0592     14.6683  30.1868    204         19.4605     204         
1 1 1 24 15 66 f 0  21.0349 6.69795 5.0123      16.6631  -0.820042   12.7689  3.8386     187.372     0           0           
1 1 1 24 15 67 o 1  42.2255 7.65788 31.1553     18.2704  60.0839     16.5051  30.9415    352.54      14.2964     352.54      
1 1 1 24 15 68 o 13 21.4945 6.76289 -2.53401    15.9372  8.53864     14.124   3.63989    167.991     5.62795     347.991     
1 1 1 24 15 69 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 16 0  o 18 121.013 2.57443 260.678     15.5806  260.678     15.5806  88.4018    360         4.47142     180         
1 1 1 24 16 1  o 18 113.503 2.69478 228.442     15.6429  230.555     14.9586  75.9024    14.9246     12.6929     194.925     
1 1 1 24 16 2  o 9  33.0275 5.23864 22.7651     8.72942  18.1243     8.20997  2.36142    0.174886    16.0328     180.175     
1 1 1 24 16 3  o 6  47.5334 4.15897 43.3824     9.55699  38.7658     9.78609  20.6174    83.698      13.0202     263.698     
1 1 1 24 16 4  f 0  28.3905 5.74145 13.8732     8.52185  15.9662     8.65834  61.2203    297.49      0           0           
1 1 1 24 16 5  o 14 72.7746 3.33583 94.1424     11.8994  95.5783     12.3004  58.9701    79.3785     23.67       79.3785     
1 1 1 24 16 6  o 16 162.873 2.89168 470.574     23.4879  474.879     23.6803  113.618    0.640391    12.7547     180.64      
1 1 1 24 16 7  o 7  36.3162 5.42252 29.8381     9.59239  19.7794     9.56838  3.49875    199.208     3.24312     19.2081     
1 1 1 24 16 8  o 10 218.358 3.02904 855.291     33.0908  844.128     33.2     150.713    250.404     22.4195     70.4038     
1 1 1 24 16 9  o 17 64.0336 3.65388 81.7956     11.4182  66.0932     11.6863  46.5817    0.851333    12.173      0.851333    
1 1 1 24 16 10 o 16 54.9012 4.27353 50.5668     11.2515  58.9334     11.8577  28.5747    47.7528     12.6606     227.753     
1 1 1 24 16 11 o 13 131.529 3.07429 303.285     19.5364  314.342     20.9318  102.723    348.78      14.2233     348.78      
1 1 1 24 16 12 o 9  130.485 3.00063 297.018     19.2832  310.759     19.9094  112.755    32.1974     36.8005     32.1974     
1 1 1 24 16 13 o 14 37.9031 5.5925  23.1185     10.4546  30.9001     10.1072  9.42854    274.296     8.65802     94.2958     
1 1 1 24 16 14 f 0  131.8   2.77162 306.74      17.1317  312.801     19.39    73.7254    110.866     0           0           
1 1 1 24 16 15 o 10 56.2156 3.95524 67.5554     10.049   47.6692     11.3245  31.3081    20.7546     8.99954     200.755     
1 1 1 24 16 16 o 19 124.154 2.79881 274.033     16.2976  276.019     18.4254  102.831    348.171     26.8192     348.171     
1 1 1 24 16 17 o 5  104.019 2.73081 205.644     13.4168  180.943     14.8293  78.1777    31.076      8.07691     31.076      
1 1 1 24 16 18 o 15 68.3955 3.12726 94.2563     10.2518  74.1116     10.8575  56.1721    62.8993     27.7476     62.8993     
1 1 1 24 16 19 o 2  39.0745 4.68568 30.0537     8.79823  26.5322     8.87398  11.829     230.479     13.2396     50.4785     
1 1 1 24 16 20 o 6  49.3351 3.78264 46.6709     9.04179  41.6947     9.31352  23.8888    348.626     9.49663     348.626     
1 1 1 24 16 21 o 3  147.728 2.68991 395.585     19.2772  383.041     20.4882  110.581    298.898     6.56488     298.898     
1 1 1 24 16 22 o 14 44.8882 4.3699  42.0852     9.13313  32.1627     9.73418  22.6513    326.004     1.66787     326.004     
1 1 1 24 16 23 o 18 114.41  2.75983 234.839     15.7266  232.865     15.8732  103.824    231.918     44.9003     231.918     
1 1 1 24 16 24 o 3  72.3353 3.62789 87.9342     12.9874  100.985     13.1001  63.3715    246.275     30.7457     246.275     
1 1 1 24 16 25 o 4  76.8789 3.52431 110.37      14.451   102.628     12.5449  70.2952    357.229     36.5466     357.229     
1 1 1 24 16 26 f 0  223.52  3.27597 916.082     37.8088  874.587     35.5855  140.397    144.425     0           0           
1 1 1 24 16 27 o 4  168.843 3.12762 524.583     26.8002  497.332     26.0825  126.207    263.984     6.42646     263.984     
1 1 1 24 16 28 o 4  72.1918 3.44632 88.6328     12.7531  99.5171     11.9351  56.7631    179.411     12.1498     179.411     
1 1 1 24 16 29 o 19 70.3646 3.28415 93.0458     11.1659  85.4958     11.8089  67.9698    70.5985     59.4729     70.5985     
1 1 1 24 16 30 o 14 70.3217 3.2569  92.4156     11.2369  85.9585     11.564   50.4266    196.745     2.00536     196.744     
1 1 1 24 16 31 o 8  44.7916 4.46677 38.267      9.5161   36.0392     9.94975  28.8029    294.019     1.13279     114.019     
1 1 1 24 16 32 o 6  191.724 2.71739 678.258     25.383   638.079     26.7544  167.111    188.068     56.6278     188.068     
1 1 1 24 16 33 o 14 68.7538 3.25177 83.2846     10.8452  87.5798     11.4358  59.2371    310.683     23.4868     310.683     
1 1 1 24 16 34 o 6  62.1116 3.50539 71.828      10.6676  68.3308     10.9571  49.4048    103.8       13.5354     103.8       
1 1 1 24 16 35 o 15 18.3706 5.45935 2.91038     7.90422  -0.454222   9.27719  3.19614    224.873     21.7261     224.873     
1 1 1 24 16 36 o 7  28.2329 5.82868 17.8669     8.96399  12.6883     8.68568  3.4225     94.1469     27.9743     274.147     
1 1 1 24 16 37 o 17 56.1651 3.93524 58.0938     11.517   57.7768     10.305   40.6567    221.86      4.78911     221.86      
1 1 1 24 16 38 o 13 25.7599 5.922   8.24054     8.87052  15.9659     9.05586  6.34395    344.642     15.896      164.642     
1 1 1 24 16 39 f 0  22.5489 5.83188 9.95339     8.74844  6.2322      8.54422  17.0452    232.775     0           0           
1 1 1 24 16 40 o 6  92.7426 3.14643 162.68      14.4458  148.831     14.6806  78.0369    19.5414     25.8686     19.5414     
1 1 1 24 16 41 f 0  52.2874 4.09566 46.582      10.2819  54.7949     10.7987  34.325     323.773     0           0           
1 1 1 24 16 42 o 11 132.859 2.76152 311.089     18.1031  324.861     18.6312  101.364    141.148     14.6904     141.148     
1 1 1 24 16 43 o 13 54.3654 4.18192 59.4083     10.6355  50.5264     11.5815  39.6698    121.246     5.9006      121.246     
1 1 1 24 16 44 f 0  20.4794 5.6602  4.11043     8.43336  6.70997     8.45815  13.7978    100.997     0           0           
1 1 1 24 16 45 o 17 56.5897 3.75915 56.0282     10.8185  62.2163     10.1707  32.9723    257.665     11.7024     77.6647     
1 1 1 24 16 46 o 12 29.736  5.65236 22.5361     9.01473  12.5928     8.57128  17.1028    312.311     1.04145     132.311     
1 1 1 24 16 47 o 1  80.5656 3.09508 115.579     12.6918  121.052     12.1824  73.2068    109.234     35.3697     109.234     
1 1 1 24 16 48 o 10 86.6584 3.20831 128.56      13.3165  146.442     14.4593  59.7136    272.786     0.86887     92.7858     
1 1 1 24 16 49 o 9  41.1024 5.2297  28.5366     10.0362  38.1998     10.6828  29.8449    285.899     6.34008     285.899     
1 1 1 24 16 50 f 0  42.1633 4.87998 41.0148     10.33    28.7537     9.49289  35.5562    339.484     0           0           
1 1 1 24 16 51 o 5  47.8222 4.55145 42.3962     11.6103  45.6193     9.32768  33.2019    343.869     2.80335     343.869     
1 1 1 24 16 52 o 7  25.6627 6.04237 14.2877     10.2098  12.0766     8.00024  11.5092    169.499     6.35266     349.5       
1 1 1 24 16 53 o 19 42.8521 5.16514 33.8973     11.864   39.1067     9.09546  20.5082    67.9786     15.6544     247.979     
1 1 1 24 16 54 o 19 37.7912 5.92864 27.0428     12.0924  32.1241     9.80693  27.4312    137.283     8.47958     137.283     
1 1 1 24 16 55 o 3  19.3612 5.63662 -0.536869   9.33759  7.26243     8.82064  2.03149    163.322     15.2211     343.322     
1 1 1 24 16 56 o 10 46.6853 4.8303  44.2529     11.3115  41.6995     10.6233  28.8891    32.2969     2.88387     212.297     
1 1 1 24 16 57 f 0  29.2253 6.47931 15.0312     10.1189  21.5651     11.1222  9.13355    118.576     0           0           
1 1 1 24 16 58 o 2  18.9436 5.69289 4.4688      9.02877  0.0255513   10.0524  1.37076    24.1218     16.5174     204.122     
1 1 1 24 16 59 o 10 21.8579 6.03227 10.4269     9.88331  4.65511     9.4123   7.24239    63.7216     8.3905      243.722     
1 1 1 24 16 60 o 1  62.0092 4.6674  85.5596     16.2207  65.5242     12.3929  45.2381    110.081     8.60238     110.081     
1 1 1 24 16 61 o 14 23.8875 6.78425 12.9701     14.1112  6.81231     10.6137  10.6849    67.1728     3.09312     247.173     
1 1 1 24 16 62 o 17 25.589  7.26502 10.6235     18.1088  12.9174     11.1887  11.6151    81.3        4.43817     81.3        
1 1 1 24 16 63 o 8  18.1064 5.94155 -7.2124     13.6621  -3.4881     12.239   1.95681    101.198     12.75       281.198     
1 1 1 24 16 64 o 19 37.7113 7.64605 34.0989     15.7275  36.7663     14.7577  26.2606    309.449     9.36972     309.449     
1 1 1 24 16 65 o 1  32.0213 7.77036 31.2057     15.6877  22.183      14.5964  16.2239    55.6122     8.34552     55.6122     
1 1 1 24 16 66 o 16 24.1124 7.30586 7.47062     19.0295  12.2486     13.3945  5.78502    141.683     1.12466     321.683     
1 1 1 24 16 67 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 17 0  o 10 124.189 3.01737 275.175     18.7287  275.175     18.7287  81.4874    180         23.4229     8.68554e-06 
1 1 1 24 17 1  o 1  38.6766 5.31277 26.3535     10.1474  29.5639     9.68594  6.65302    292.245     30.3894     112.245     
1 1 1 24 17 2  o 1  67.3571 3.55996 77.0989     11.5064  86.2387     12.3576  0.125096   272.335     96.1469     92.3349     
1 1 1 24 17 3  o 13 21.4333 5.54576 10.705      7.63397  -0.231905   9.18157  19.7526    308.132     57.3536     308.132     
1 1 1 24 17 4  o 1  96.8909 2.91078 169.985     13.423   165.472     14.7277  69.3167    93.7643     0.302747    273.764     
1 1 1 24 17 5  o 8  111.572 3.16176 233.156     15.6631  212.327     19.2282  66.3738    208.622     29.9982     28.6222     
1 1 1 24 17 6  o 9  67.692  3.61343 82.0102     12.1244  82.9401     12.2105  38.7531    118.499     15.5419     298.499     
1 1 1 24 17 7  o 3  154.243 2.90932 417.15      22.1504  432.255     22.7876  113.164    301.755     1.0324      121.756     
1 1 1 24 17 8  o 16 100.921 2.9704  188.08      14.4023  176.121     15.5061  39.8292    39.6196     67.4592     219.62      
1 1 1 24 17 9  o 18 117.336 2.89688 242.449     16.4175  249.393     17.592   101.175    172.639     33.0809     172.639     
1 1 1 24 17 10 o 14 16.6508 5.21799 -1.1344     8.3782   -4.64471    9.00268  4.16936    102.068     10.6022     102.068     
1 1 1 24 17 11 o 5  72.1348 3.22962 86.8843     10.9587  100.094     12.2838  44.7037    175.041     10.396      355.041     
1 1 1 24 17 12 o 15 74.9411 3.09636 97.5415     11.105   103.834     12.0526  65.9993    234.295     34.8126     234.295     
1 1 1 24 17 13 o 19 86.8812 2.97041 139.299     12.4605  130.933     13.2787  72.4081    254.492     24.1249     254.492     
1 1 1 24 17 14 o 1  33.157  5.32757 24.6161     8.26995  16.867      9.13735  3.70418    195.472     6.49647     15.4723     
1 1 1 24 17 15 o 18 116.515 2.79931 247.692     15.7196  237.401     16.8713  93.9193    114.866     19.5781     114.866     
1 1 1 24 17 16 o 16 191.294 2.90809 637.125     26.7391  669.985     29.0151  152.596    235.266     23.0823     235.266     
1 1 1 24 17 17 o 10 16.8743 5.21731 -2.29646    8.3528   -0.79005    8.40897  6.77001    265.891     18.3509     265.891     
1 1 1 24 17 18 o 15 77.8659 3.20176 104.041     12.7392  113.774     12.0793  50.7461    296.8       8.42496     116.8       
1 1 1 24 17 19 o 13 181.449 3.13198 602.949     28.5352  575.37      28.4149  155.793    136.772     44.8098     136.772     
1 1 1 24 17 20 o 12 97.8913 3.35254 187.906     17.3008  157.08      15.5074  79.2457    149.984     18.0138     149.984     
1 1 1 24 17 21 o 14 134.32  3.13957 315.891     20.3444  330.937     21.8636  103.91     38.15       11.5292     38.15       
1 1 1 24 17 22 o 8  131.732 2.99986 300.704     19.8911  321.13      19.6393  134.056    247.049     77.1957     247.049     
1 1 1 24 17 23 o 4  47.6504 4.72366 44.7541     11.3514  39.3051     10.5902  21.1394    120.033     23.2102     300.033     
1 1 1 24 17 24 o 7  89.9977 2.99984 153.723     13.5943  137.205     13.367   71.9731    184.422     14.3599     184.422     
1 1 1 24 17 25 o 9  58.4627 3.7758  65.2729     10.3744  59.0187     11.3914  43.641     173.727     6.31343     173.727     
1 1 1 24 17 26 o 19 73.4181 3.47525 92.2673     13.1928  102.682     12.1124  57.2117    339.118     10.3076     339.118     
1 1 1 24 17 27 o 15 173.1   2.86945 535.135     24.6387  538.516     25.1436  116.445    52.7905     20.4178     232.79      
1 1 1 24 17 28 o 6  82.1189 3.02545 122.164     12.4816  120.525     12.334   69.613     6.26861     22.4221     6.26861     
1 1 1 24 17 29 o 14 55.4439 3.71541 52.8173     10.1557  59.3571     10.2166  43.4099    84.1452     11.1682     84.1452     
1 1 1 24 17 30 o 6  59.4106 3.64909 64.047      10.9946  64.4972     10.5101  28.7749    35.3973     26.261      215.397     
1 1 1 24 17 31 o 18 51.5617 4.05514 50.9382     9.94595  46.8963     10.5906  46.7216    331.694     27.6823     331.694     
1 1 1 24 17 32 o 1  104.584 2.78035 200.039     14.6785  193.193     14.4143  84.1377    19.835      18.1237     19.835      
1 1 1 24 17 33 o 5  32.1905 5.55888 20.3315     8.73937  19.8203     9.04098  17.2801    24.8774     6.43562     24.8774     
1 1 1 24 17 34 o 3  52.7167 3.83723 54.2456     9.83722  47.9291     10.0892  42.2135    217.299     13.3814     217.299     
1 1 1 24 17 35 o 2  36.2625 5.23101 22.7073     8.57157  27.9653     9.81629  21.6004    173.239     2.22725     353.239     
1 1 1 24 17 36 o 1  22.1891 5.69941 7.02297     7.74735  9.03601     8.63157  2.59801    231.13      17.7151     51.1304     
1 1 1 24 17 37 o 10 61.9777 3.49711 80.737      10.1609  60.2098     11.0143  32.4313    15.3697     22.0742     195.37      
1 1 1 24 17 38 o 15 38.0028 5.10237 30.356      8.95708  25.1057     9.70081  27.1101    301.501     7.59276     301.501     
1 1 1 24 17 39 o 15 74.9552 3.41936 103.92      12.1474  100.816     13.3479  54.1565    258.899     3.08727     258.899     
1 1 1 24 17 40 o 12 25.5151 5.89268 8.16095     8.51934  16.0149     9.17255  8.89213    73.6508     10.2145     253.651     
1 1 1 24 17 41 o 15 23.4977 6.06991 11.6196     9.76364  6.68587     8.96825  3.46311    340.66      20.3614     160.66      
1 1 1 24 17 42 o 17 81.4701 3.00459 123.466     12.4399  117.377     12.0108  51.7365    278.365     11.2139     98.3648     
1 1 1 24 17 43 o 17 71.3026 3.24783 93.0729     11.6987  92.531      11.387   44.6824    117.581     10.4323     297.581     
1 1 1 24 17 44 o 9  46.9014 4.45271 47.0361     10.1628  36.5303     10.086   29.8952    9.68139     3.91108     189.681     
1 1 1 24 17 45 o 18 23.1807 5.57114 16.537      8.3485   -2.15145    9.86062  9.71669    280.33      5.49175     100.33      
1 1 1 24 17 46 o 17 19.9038 5.35319 -3.47178    8.2638   11.3655     8.18167  4.23722    60.5731     12.9101     240.573     
1 1 1 24 17 47 o 10 96.7221 2.91745 171.902     13.813   169.299     14.3923  72.5811    357.41      9.96737     357.41      
1 1 1 24 17 48 o 14 59.1093 3.8264  68.4847     11.2123  62.4961     11.1846  36.9592    102.303     7.32884     282.303     
1 1 1 24 17 49 o 1  26.6054 6.04945 11.645      9.27921  16.8212     9.2248   14.2254    197.415     1.91718     17.4154     
1 1 1 24 17 50 o 13 38.2069 5.39246 22.1732     10.2213  37.3384     9.62456  31.6767    188.019     17.0378     188.019     
1 1 1 24 17 51 o 14 18.0172 5.43449 -4.02994    8.47719  5.92709     9.33195  2.5782     19.4563     11.6031     199.456     
1 1 1 24 17 52 o 8  35.1658 5.86931 28.8134     9.61566  22.6314     10.8579  21.8916    116.561     0.181861    296.561     
1 1 1 24 17 53 o 12 17.4044 5.31644 -2.72784    8.63517  3.65599     8.60563  1.12061    179.059     12.5549     359.059     
1 1 1 24 17 54 o 6  17.2386 5.23886 -10.6351    10.4732  5.56485     7.77101  0.775147   276.032     12.0532     96.0323     
1 1 1 24 17 55 o 8  24.2474 6.02657 6.44746     10.9662  14.7348     8.32267  10.1473    291.33      3.05961     111.33      
1 1 1 24 17 56 o 8  40.0248 6.01418 38.7585     12.951   28.8396     10.4809  21.2462    222.247     9.14736     42.2468     
1 1 1 24 17 57 o 5  39.2593 6.0431  33.9688     11.6201  30.84       11.4887  32.1318    233.343     16.9252     233.343     
1 1 1 24 17 58 o 18 36.5169 6.72748 28.5349     11.707   30.1071     13.1707  22.1373    5.85295     1.65339     185.853     
1 1 1 24 17 59 o 10 23.7277 6.72978 14.667      13.7484  4.63548     10.719   6.39427    207.724     14.8156     27.7238     
1 1 1 24 17 60 o 10 48.3137 6.20195 55.9129     15.3791  44.5366     13.5725  37.1653    292.429     12.3507     292.429     
1 1 1 24 17 61 o 15 20.6395 6.264   -1.68221    13.8305  7.39342     10.3638  6.62705    263.422     3.93337     83.4222     
1 1 1 24 17 62 o 10 33.3355 7.23681 32.4618     14.9276  22.1483     11.6057  22.3921    113.132     10.3662     113.132     
1 1 1 24 17 63 o 11 34.7322 7.48069 32.7678     15.9494  28.3932     12.5336  21.5601    206.984     3.86632     206.984     
1 1 1 24 17 64 o 18 24.5304 7.17059 16.2092     14.9493  8.59631     13.8657  7.99871    48.0242     5.94622     228.024     
1 1 1 24 17 65 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 17 66 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 18 0  o 3  54.7681 4.52179 55.7554     11.9691  55.7554     11.9691  33.221     360         14.8028     180         
1 1 1 24 18 1  o 8  62.7488 3.75581 65.8833     11.4327  76.6499     11.946   40.9297    126.099     2.82416     306.099     
1 1 1 24 18 2  o 14 37.9874 5.37949 26.7468     9.6232   27.5129     10.1438  8.18285    19.0095     0.698424    199.009     
1 1 1 24 18 3  f 0  136.194 2.85597 318.793     19.0488  344.349     19.8953  64.947     101.148     0           0           
1 1 1 24 18 4  o 15 22.9025 5.98901 5.08076     9.41196  9.87215     9.01981  12.5845    59.3961     44.5506     59.3961     
1 1 1 24 18 5  o 4  117.072 2.92826 241.467     17.1918  248.79      17.1099  65.7544    23.4824     40.8438     203.482     
1 1 1 24 18 6  o 8  60.0127 3.5295  63.6517     9.82475  66.3624     11.19    29.7806    326.88      23.1999     146.88      
1 1 1 24 18 7  o 7  37.4907 5.02709 35.1987     8.82601  18.3629     9.16343  4.33797    158.771     37.5704     338.771     
1 1 1 24 18 8  o 17 70.9122 3.30173 91.0727     11.2575  89.7689     12.0567  48.7942    249.201     1.54501     69.2012     
1 1 1 24 18 9  o 15 64.6719 3.54891 73.2748     11.0608  77.6784     11.7655  56.3121    148.503     30.0903     148.503     
1 1 1 24 18 10 o 9  148.06  3.02831 410.661     24.2026  374.382     20.6759  138.752    171.45      59.6586     171.45      
1 1 1 24 18 11 o 2  106.061 2.95494 208.744     16.3686  194.163     14.9857  89.0566    75.6805     24.0803     75.6805     
1 1 1 24 18 12 o 9  26.8446 5.90904 9.60314     9.15877  16.4161     8.79974  2.29207    289.995     8.84961     109.994     
1 1 1 24 18 13 o 9  74.0068 3.59826 88.4851     13.4077  109.698     12.9311  63.3234    267.289     23.3081     267.289     
1 1 1 24 18 14 o 4  35.235  5.86194 24.7714     10.2194  22.5924     10.1419  12.0592    108.804     2.3667      108.804     
1 1 1 24 18 15 o 19 21.9023 5.84628 9.95333     8.89205  2.16189     9.17276  14.8202    148.441     54.6227     148.441     
1 1 1 24 18 16 o 6  162.071 3.00952 466.338     24.185   474.661     24.6601  130.822    86.4841     21.7145     86.4841     
1 1 1 24 18 17 o 11 100.219 3.28117 177.912     15.9576  183.203     16.9086  85.6069    149.214     25.165      149.214     
1 1 1 24 18 18 o 11 140.097 2.80244 347.943     18.9545  354.633     20.3436  123.532    24.8436     40.5617     24.8436     
1 1 1 24 18 19 o 11 150.714 2.80455 409.739     21.0414  403.533     21.2831  137.481    319.779     52.7844     319.779     
1 1 1 24 18 20 o 7  52.7045 4.72507 59.8063     9.573    43.4255     13.3814  27.0433    45.9166     20.0643     225.917     
1 1 1 24 18 21 o 15 113.991 2.82318 236.528     15.7541  229.358     16.43    85.787     243.098     4.48278     243.098     
1 1 1 24 18 22 o 10 114.466 2.76735 236.719     15.2268  232.996     16.4402  99.5537    348.006     31.929      348.006     
1 1 1 24 18 23 o 17 95.2901 2.99696 167.305     12.9996  159.227     15.3758  62.32      289.304     14.25       109.304     
1 1 1 24 18 24 o 8  28.2666 5.58525 9.11907     7.86971  21.5571     9.15633  6.89202    280.677     1.31142     280.677     
1 1 1 24 18 25 o 4  20.9146 5.59024 5.38757     7.47993  7.06916     8.55647  1.06941    85.2394     15.3699     265.239     
1 1 1 24 18 26 o 2  36.055  5.66096 21.9855     9.46837  28.3038     10.4915  23.6032    215.026     9.93617     215.026     
1 1 1 24 18 27 o 4  97.0563 2.92685 171.238     12.8789  167.885     15.3805  62.0923    217.467     16.7769     37.4673     
1 1 1 24 18 28 o 4  18.9397 5.37624 5.94761     7.30971  -0.185244   8.74424  12.0738    147.277     46.2229     147.277     
1 1 1 24 18 29 o 15 36.264  5.46527 25.0343     9.46262  25.6888     9.79443  8.74307    169.16      31.4129     349.16      
1 1 1 24 18 30 o 14 68.6528 3.3976  94.5393     10.7586  77.1948     12.162   49.7055    94.8111     1.98566     94.8111     
1 1 1 24 18 31 o 3  63.8824 3.46669 75.6583     10.2579  73.0375     11.6822  60.214     142.888     32.4775     142.888     
1 1 1 24 18 32 o 1  112.489 2.7821  232.791     14.7112  222.906     16.5052  85.1882    229.754     7.79471     229.754     
1 1 1 24 18 33 f 0  61.7557 3.59379 69.9442     10.2932  69.5368     11.6949  55.3454    255.79      0           0           
1 1 1 24 18 34 o 9  80.7729 3.18242 125.777     11.9048  111.071     13.5454  75.3754    9.84397     36.7487     9.84397     
1 1 1 24 18 35 f 0  29.2997 5.89679 13.4899     8.62199  20.2052     9.65689  23.8331    49.0645     0           0           
1 1 1 24 18 36 o 10 28.4126 5.84887 18.9138     8.36047  11.9928     9.78577  4.60896    7.20269     27.0995     187.203     
1 1 1 24 18 37 o 7  57.498  3.86813 65.1877     10.1403  56.9232     11.6414  44.984     111.413     10.5645     111.413     
1 1 1 24 18 38 o 15 34.7117 5.67236 24.3296     8.72164  23.0289     10.6401  25.3093    127.279     12.1188     127.279     
1 1 1 24 18 39 o 8  47.9773 4.33843 41.001      10.1706  45.4502     10.1873  35.3122    252.046     5.46612     252.046     
1 1 1 24 18 40 o 3  59.5564 3.70336 70.8379     10.6425  60.268      11.119   44.6955    235.275     6.5194      235.275     
1 1 1 24 18 41 o 6  29.9318 5.71954 13.8468     8.78145  21.9204     9.04198  9.02056    17.1095     21.1781     197.11      
1 1 1 24 18 42 o 6  26.6725 5.83778 10.6528     8.58745  17.2551     8.87342  14.3414    171.598     2.33202     351.598     
1 1 1 24 18 43 f 0  94.2121 3.03515 172.695     13.9511  151.519     14.5348  59.1515    124.459     0           0           
1 1 1 24 18 44 f 0  94.772  3.12049 171.445     13.7423  157.551     15.6361  55.3953    148.058     0           0           
1 1 1 24 18 45 o 8  64.2617 3.91906 78.4952     12.7968  76.4548     12.197   36.4368    126.04      16.8499     306.04      
1 1 1 24 18 46 o 6  52.6351 4.28756 59.9418     10.9233  46.1259     11.0531  35.826     267.538     0.491352    87.5383     
1 1 1 24 18 47 o 13 25.5464 6.31851 13.8691     9.31139  11.5251     10.7924  10.7109    199.787     8.96781     19.7873     
1 1 1 24 18 48 o 4  18.7725 5.59861 1.69751     9.12352  3.59406     8.92721  6.4012     187.161     35.5999     187.161     
1 1 1 24 18 49 o 6  17.2255 5.30106 0.605594    8.37201  0.191131    8.74688  2.16389    242.32      2.99286     62.3198     
1 1 1 24 18 50 o 18 29.4572 6.18078 19.8686     9.62348  16.7592     10.0238  18.6616    255.011     6.85715     255.011     
1 1 1 24 18 51 o 6  21.2802 5.88216 10.259      9.08553  2.98837     9.59054  6.64186    148.639     5.08954     328.639     
1 1 1 24 18 52 o 19 24.9152 5.23637 24.7326     9.25079  -6.00134    9.22103  10.2092    304.166     6.75873     124.166     
1 1 1 24 18 53 o 7  51.4072 5.2651  52.885      13.0377  53.3771     13.3008  44.6908    39.0149     22.8247     39.0149     
1 1 1 24 18 54 o 12 31.2801 7.02136 18.5928     11.2545  25.0002     13.4918  20.9576    174.617     8.89524     174.617     
1 1 1 24 18 55 o 4  49.8169 5.87139 40.738      13.0442  62.9826     15.1647  39.9637    309.566     14.6844     309.566     
1 1 1 24 18 56 o 6  41.6044 6.25583 39.9384     11.8908  33.9459     13.3818  33.2095    62.2487     13.8495     62.2487     
1 1 1 24 18 57 o 12 29.332  7.13448 17.4638     13.8078  20.6848     11.8503  14.5457    313.602     6.37088     133.602     
1 1 1 24 18 58 o 12 35.7971 7.59642 24.2985     14.8256  37.2556     15.1523  27.8155    226.291     16.2278     226.291     
1 1 1 24 18 59 o 14 27.2241 7.27982 19.1049     14.8877  14.2        12.3001  8.02155    19.9649     16.8151     199.965     
1 1 1 24 18 60 o 15 29.3284 7.30963 29.3112     14.9202  12.6433     12.4676  16.8129    235.893     2.67625     235.893     
1 1 1 24 18 61 o 10 23.4549 7.34359 28.2169     21.7798  -8.03089    11.2118  5.39675    86.8472     0.165273    86.8472     
1 1 1 24 18 62 o 13 23.6658 7.09207 10.4567     16.1732  10.3933     13.0808  4.7608     39.4293     0.189379    219.429     
1 1 1 24 18 63 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 18 64 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 19 0  o 5  29.6898 7.45493 20.9822     10.0974  20.9822     10.0974  12.2867    180         6.18059     8.6509e-06  
1 1 1 24 19 1  o 1  72.4399 3.69337 109.48      13.0737  81.3294     13.2793  31.7199    172.044     42.4983     352.044     
1 1 1 24 19 2  o 12 65.3094 4.00903 76.6982     13.1811  78.3277     12.792   58.6529    222.132     26.5689     222.132     
1 1 1 24 19 3  o 2  94.3047 3.38367 168.08      16.3535  152.212     15.5252  82.577     286.182     27.2843     286.182     
1 1 1 24 19 4  o 10 109.771 3.30633 213.73      18.0678  219.442     18.2249  91.7334    87.4308     21.3315     87.4308     
1 1 1 24 19 5  f 0  54.763  4.58697 60.1292     12.6003  50.356      12.0457  26.9432    145.763     0           0           
1 1 1 24 19 6  o 4  77.1739 3.6924  115.741     14.3162  99.9038     14.0335  72.5907    1.45054     34.7933     1.45054     
1 1 1 24 19 7  o 11 127.61  3.05454 293.901     19.5928  290.188     19.419   120.33     293.573     51.5691     293.573     
1 1 1 24 19 8  o 18 48.0146 4.51874 39.4658     10.2913  45.6901     10.9049  28.5237    179.919     9.75041     359.919     
1 1 1 24 19 9  o 13 49.9303 4.45499 48.1351     10.5814  43.701      11.1461  14.4956    332.43      42.5299     152.43      
1 1 1 24 19 10 o 12 29.9626 5.88319 21.1796     8.95623  12.6199     9.79697  10.9544    108.062     13.2839     288.063     
1 1 1 24 19 11 o 6  67.1282 3.71666 86.4324     10.9145  77.0813     13.5255  28.408     15.8908     41.2219     195.891     
1 1 1 24 19 12 o 18 113.702 2.98717 233.714     15.9966  230.297     17.9133  106.662    10.549      45.7476     10.549      
1 1 1 24 19 13 o 9  102.127 3.04809 186.743     14.6855  188.019     16.3997  79.0417    44.3372     7.50519     44.3372     
1 1 1 24 19 14 o 17 88.1564 3.07299 141.308     12.4116  138.245     14.5396  60.9493    195.48      7.52827     15.4803     
1 1 1 24 19 15 o 2  58.7512 3.56983 62.8296     9.83936  62.5012     10.9396  44.534     129.954     5.9934      129.954     
1 1 1 24 19 16 o 8  56.1822 3.85806 56.626      9.78264  58.5916     11.6061  39.3837    303.563     0.586797    123.563     
1 1 1 24 19 17 f 0  20.5399 5.65372 4.45345     7.72324  6.10303     9.00387  47.3385    62.135      0           0           
1 1 1 24 19 18 o 19 102.239 2.86322 182.335     13.8434  193.261     15.4313  86.0957    339.389     22.2392     339.389     
1 1 1 24 19 19 o 9  78.8613 3.38225 120.53      12.0797  104.748     14.2136  72.7247    8.73745     32.1478     8.73745     
1 1 1 24 19 20 o 7  76.1119 3.28175 104.712     12.2983  104.804     12.6156  61.8835    219.91      13.9442     219.91      
1 1 1 24 19 21 o 7  95.3729 2.953   170.774     13.7897  156.882     14.3203  66.1433    97.7026     7.42149     277.703     
1 1 1 24 19 22 o 5  71.5787 3.22875 94.7054     11.1082  90.7674     11.8965  57.625     152.227     12.5353     152.227     
1 1 1 24 19 23 o 14 31.2794 5.37218 27.6504     8.4095   9.89675     9.31299  10.8094    152.074     5.20184     152.074     
1 1 1 24 19 24 o 15 65.269  3.49462 79.6477     10.5696  75.457      12.015   43.5958    304.832     6.36496     124.832     
1 1 1 24 19 25 o 11 39.0167 4.94727 30.4153     8.61415  27.4375     9.92589  23.785     239.552     3.9274      59.5517     
1 1 1 24 19 26 o 3  37.378  5.44188 34.4728     8.93926  19.8055     10.6936  24.5827    188.791     1.65764     188.791     
1 1 1 24 19 27 o 2  84.8471 3.15556 142.495     13.3875  118.716     13.2736  63.7673    18.1248     4.75415     18.1248     
1 1 1 24 19 28 o 15 34.1172 5.57555 19.2329     8.73863  26.3526     10.002   19.1004    158.561     4.96291     338.561     
1 1 1 24 19 29 o 5  58.6017 3.82316 72.2045     10.0301  54.6011     11.6273  45.5635    295.172     8.89119     295.172     
1 1 1 24 19 30 o 9  31.6924 5.67456 23.2225     8.51322  15.9213     9.8108   12.247     183.584     16.3832     3.58422     
1 1 1 24 19 31 o 4  90.183  3.28303 169.45      12.9896  127.357     15.7639  65.1051    98.3997     0.0261135   278.404     
1 1 1 24 19 32 o 17 23.2916 5.81305 11.123      8.01317  7.21579     9.14109  4.94453    169.199     39.387      169.199     
1 1 1 24 19 33 o 1  57.8668 3.76556 64.6532     10.2529  58.7287     11.2323  49.2897    304.819     18.3477     304.819     
1 1 1 24 19 34 o 16 45.6035 4.47539 37.4803     9.38231  40.8694     10.5235  24.2883    331.54      14.5772     151.54      
1 1 1 24 19 35 o 15 18.3799 5.47982 2.4798      7.81483  0.752208    9.49038  1.97213    133.531     3.71881     313.531     
1 1 1 24 19 36 o 16 16.2789 5.11341 -1.277      7.75592  -2.74692    8.95206  0.0290955  267.934     12.6146     267.934     
1 1 1 24 19 37 o 3  21.3997 5.66397 6.47945     8.04181  7.96784     8.34716  7.47765    326.685     4.26213     146.686     
1 1 1 24 19 38 o 16 14.9916 4.78247 -7.29271    7.96339  -0.295795   7.58955  0.475447   57.0894     3.04418     237.089     
1 1 1 24 19 39 o 12 24.1792 5.85933 14.0732     8.47916  6.95856     9.15877  9.6103     327.76      9.45421     147.76      
1 1 1 24 19 40 o 7  41.5297 4.88237 30.1088     9.74066  36.9718     9.80558  32.9398    68.5887     10.5536     68.5887     
1 1 1 24 19 41 o 1  23.5324 5.76613 6.24983     8.51894  13.8461     8.54685  11.0108    148.691     2.76308     148.691     
1 1 1 24 19 42 o 19 32.7809 5.5354  38.6477     11.0728  6.71129     9.07622  14.8487    321.278     13.8611     141.278     
1 1 1 24 19 43 o 5  62.8504 3.6093  79.2217     11.1764  68.3132     11.2958  45.5125    299.543     3.09987     299.543     
1 1 1 24 19 44 o 19 27.5114 6.0057  14.715      9.06334  16.4173     9.16874  15.0176    68.3508     3.18186     248.351     
1 1 1 24 19 45 o 19 19.9686 5.71111 5.52381     8.80407  4.5825      8.91858  5.14761    308.72      10.7212     128.72      
1 1 1 24 19 46 o 17 43.3969 4.81982 36.1889     10.0883  38.0591     10.1829  29.1183    153.252     0.0906778   333.252     
1 1 1 24 19 47 f 0  25.8628 6.05267 10.3099     9.2241   16.7987     9.3317   27.6328    268.018     0           0           
1 1 1 24 19 48 o 8  20.9954 5.92961 7.16015     9.9019   5.74807     8.92985  1.8875     198.039     20.3634     18.0386     
1 1 1 24 19 49 o 5  50.8678 5.01664 60.2136     12.4371  43.3306     12.1504  45.6046    94.0361     24.8861     94.0361     
1 1 1 24 19 50 o 18 41.4898 6.06522 39.5963     12.385   33.1111     12.0137  27.0222    343.33      0.1464      343.33      
1 1 1 24 19 51 o 16 28.9309 6.41534 8.4611      11.1391  26.4306     11.2428  17.7543    300.742     6.30721     300.742     
1 1 1 24 19 52 o 14 57.8379 4.60004 66.8425     12.8563  63.8879     13.3179  53.8367    252.218     30.7982     252.218     
1 1 1 24 19 53 o 19 26.7015 6.56666 21.0136     11.5662  7.99648     10.8206  15.9726    40.7922     2.97404     40.7922     
1 1 1 24 19 54 o 17 73.5064 4.18774 101.293     15.596   106.798     14.9526  62.1832    179.155     24.2564     179.155     
1 1 1 24 19 55 o 3  15.7511 5.19797 -4.16839    10.2802  -8.70423    9.95965  1.35991    111.706     10.7392     291.706     
1 1 1 24 19 56 o 16 40.5322 6.98398 27.2149     12.5187  49.639      15.9678  22.9791    14.0712     6.80497     194.071     
1 1 1 24 19 57 o 1  67.1109 5.46022 85.8786     17.86    102.112     18.0525  61.497     179.95      33.8784     179.95      
1 1 1 24 19 58 o 17 39.3347 8.95273 49.6702     22.1151  39.0991     17.9918  26.976     6.33549     6.30761     6.33549     
1 1 1 24 19 59 o 13 27.2653 7.62685 11.4966     16.024   23.6658     15.6367  9.45545    103.672     12.1903     283.672     
1 1 1 24 19 60 o 14 25.4316 7.22717 12.4276     16.4102  16.2888     12.4681  2.09048    159.253     0.574993    159.253     
1 1 1 24 19 61 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 19 62 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 20 0  o 16 21.9234 7.82311 13.0785     10.6378  13.0785     10.6378  20.3933    180         73.2047     180         
1 1 1 24 20 1  o 4  77.5463 3.38389 118.273     13.644   99.5285     12.5271  63.0376    297.375     12.6072     297.375     
1 1 1 24 20 2  o 8  83.5071 3.10682 126.713     12.7026  124.516     13.1986  93.1545    72.6581     67.4105     72.6581     
1 1 1 24 20 3  o 9  21.0044 5.76793 7.87579     9.08236  2.98246     8.45905  5.2769     38.0521     34.4309     38.052      
1 1 1 24 20 4  o 9  126.038 2.94807 294.886     18.5202  275.939     18.6494  105.671    274.869     23.2402     274.869     
1 1 1 24 20 5  o 5  52.7383 4.20939 45.9704     10.5725  56.6005     11.2478  28.4241    243.678     18.7633     63.6781     
1 1 1 24 20 6  o 12 90.4084 3.3673  141.407     14.8291  154.018     15.5778  68.9587    255.828     4.29582     255.828     
1 1 1 24 20 7  o 9  50.4853 4.95032 49.5544     11.4     45.6588     12.8231  34.9767    271.199     0.805115    91.1985     
1 1 1 24 20 8  o 8  47.273  5.00622 37.7745     11.6379  46.1903     11.1941  36.4645    323.288     8.71192     323.288     
1 1 1 24 20 9  o 5  19.5829 5.61098 -4.05457    9.15864  7.88376     9.00265  0.130641   96.5617     15.49       96.5617     
1 1 1 24 20 10 o 1  69.8778 3.74495 82.6184     13.5238  95.3437     12.3199  66.2632    120.418     32.6582     120.418     
1 1 1 24 20 11 o 9  108.377 2.93098 219.582     15.6352  203.041     16.1015  83.8312    152.297     6.75706     152.297     
1 1 1 24 20 12 o 4  119.354 2.73537 259.026     16.0606  252.397     16.604   118.198    246.17      59.7615     246.17      
1 1 1 24 20 13 o 2  65.3286 3.31796 73.6165     10.6216  81.1905     10.9523  27.2675    226.202     41.1657     46.2015     
1 1 1 24 20 14 f 0  36.3347 5.27134 32.6797     9.25809  18.4936     9.32583  8.51927    234.138     0           0           
1 1 1 24 20 15 o 15 105.893 2.82057 210.077     14.532   193.405     15.2874  76.8551    251.056     3.1752      71.0562     
1 1 1 24 20 16 o 16 29.2179 5.69918 14.8506     8.28571  18.2014     8.97199  10.0257    145.522     16.2443     325.522     
1 1 1 24 20 17 o 8  80.4296 3.06497 109.243     11.8456  124.751     12.774   37.7594    242.311     42.9889     62.3108     
1 1 1 24 20 18 f 0  115.2   3.08948 231.387     16.9465  247.908     18.662   74.7412    145.891     0           0           
1 1 1 24 20 19 o 14 16.8771 5.10029 3.5063      7.35913  -5.52484    8.67385  6.67344    106.159     29.9477     106.159     
1 1 1 24 20 20 o 11 32.1066 5.76552 18.1545     9.21418  22.145      9.41375  11.9187    337.854     18.1249     157.854     
1 1 1 24 20 21 o 2  46.1878 4.42952 42.4546     9.5803   37.3236     10.2793  23.5726    249.01      17.885      69.0096     
1 1 1 24 20 22 o 15 22.2474 5.67267 11.2794     7.95339  3.74238     8.87761  3.40826    243.672     16.7648     63.6716     
1 1 1 24 20 23 o 19 50.0579 4.12502 50.1972     9.624    42.8603     10.5008  38.6909    146.392     7.91249     146.392     
1 1 1 24 20 24 o 15 37.9075 5.16191 19.3755     8.96883  37.0349     9.91166  20.8818    231.36      9.24128     51.3603     
1 1 1 24 20 25 o 3  83.8572 3.20638 124.328     12.7099  130.973     14.1296  73.5639    74.5279     25.6123     74.5279     
1 1 1 24 20 26 o 14 53.3549 3.98709 55.4326     10.1802  49.9427     10.7425  25.9243    80.218      24.3839     260.218     
1 1 1 24 20 27 o 12 98.1551 3.03039 172.766     14.3631  176.042     15.3681  78.0219    143.404     12.8331     143.404     
1 1 1 24 20 28 o 13 24.677  6.24125 10.0096     9.77     11.1639     9.78383  9.37821    145.074     5.98773     325.074     
1 1 1 24 20 29 o 18 105.396 2.94633 205.374     15.5215  196.663     15.5352  83.2114    258.925     12.7318     258.925     
1 1 1 24 20 30 o 18 31.1793 5.83864 17.2877     8.98594  21.271      9.58172  19.7078    190.4       2.84029     190.4       
1 1 1 24 20 31 o 16 37.7655 5.34283 30.281      9.49112  25.3503     10.0017  26.1988    91.5844     2.62924     91.5844     
1 1 1 24 20 32 f 0  162.149 2.81274 479.333     22.9035  470.684     22.8082  119.994    100.328     0           0           
1 1 1 24 20 33 o 16 43.1083 4.88678 34.5813     9.83     36.7529     10.5724  21.8309    63.015      16.5024     243.015     
1 1 1 24 20 34 o 8  21.1971 5.66865 4.37222     8.45578  9.07623     8.26496  6.32077    165.113     0.133645    345.113     
1 1 1 24 20 35 o 15 60.7733 3.70155 60.5476     11.1737  76.8135     10.9777  38.303     258.091     10.1186     78.0911     
1 1 1 24 20 36 o 11 26.1706 5.94678 12.884      9.11782  13.9818     8.6027   14.6539    249.324     1.14108     69.3237     
1 1 1 24 20 37 o 10 61.4354 3.76779 70.3378     11.8163  70.3568     11.1416  46.5912    243.044     6.14513     243.044     
1 1 1 24 20 38 o 6  18.475  5.43784 3.96339     8.45992  1.6015      8.23495  5.01056    244.234     4.03542     64.234      
1 1 1 24 20 39 o 4  23.1532 5.89176 9.90744     8.76297  9.69611     8.68263  7.85424    218.887     12.4147     38.8868     
1 1 1 24 20 40 o 3  21.7116 5.71948 11.7738     8.68222  3.38207     8.55428  5.38177    254.253     15.3268     74.2533     
1 1 1 24 20 41 o 14 26.2545 5.97194 9.48284     9.43999  17.9648     8.99836  13.1724    89.8859     5.59287     269.886     
1 1 1 24 20 42 o 15 20.8676 5.77167 9.54645     8.99069  3.13893     8.84062  7.97449    184.761     2.54394     4.76135     
1 1 1 24 20 43 o 16 22.3444 5.94088 8.56823     9.21313  9.00307     8.85586  6.01725    231.317     14.4335     51.3166     
1 1 1 24 20 44 o 4  60.5829 3.82499 68.2159     11.6784  70.7376     11.2855  57.2181    231.031     31.4157     231.031     
1 1 1 24 20 45 o 13 68.4487 3.96043 79.6105     13.5046  98.9842     13.2354  71.1103    274.875     49.008      274.875     
1 1 1 24 20 46 o 17 43.7235 5.44078 38.5505     11.7249  39.428      11.2365  35.482     52.0785     13.9946     52.0785     
1 1 1 24 20 47 o 4  43.6317 5.46912 35.3285     11.5872  42.7078     11.3813  34.713     74.0385     12.8552     74.0385     
1 1 1 24 20 48 f 0  34.8522 6.48008 26.3547     12.0048  26.6222     10.9493  7.06501    342.937     0           0           
1 1 1 24 20 49 o 19 25.5862 6.51376 13.6726     11.1222  12.8801     10.2068  10.1175    151.135     10.1771     331.135     
1 1 1 24 20 50 o 10 27.1807 6.49892 6.43878     11.1872  23.2618     11.4261  13.9609    75.3944     7.62763     75.3944     
1 1 1 24 20 51 o 3  16.2586 5.36439 -6.78458    11.8222  -6.06447    9.56012  1.26071    299.003     13.3584     119.003     
1 1 1 24 20 52 o 6  28.643  7.03577 18.8622     13.703   17.4927     11.0773  17.2835    79.6147     0.8017      79.6147     
1 1 1 24 20 53 o 18 68.9031 4.3963  90.4231     15.1884  95.6405     14.8151  74.7993    358.19      58.2697     358.19      
1 1 1 24 20 54 o 10 22.6245 6.26627 18.603      11.9901  -5.82541    11.3058  8.72605    282.622     2.64489     282.622     
1 1 1 24 20 55 o 15 44.2952 7.21287 36.4401     14.6801  57.6032     16.9465  37.9741    247.155     20.8683     247.155     
1 1 1 24 20 56 o 5  32.908  8.28787 36.9075     16.411   20.5339     20.9771  21.0265    152.251     4.88032     152.251     
1 1 1 24 20 57 f 0  35.4517 8.18562 31.328      17.5801  38.2095     16.3022  15.6851    345.812     0           0           
1 1 1 24 20 58 o 13 27.0382 8.16466 15.7416     16.3976  21.9194     22.8653  11.1102    247.065     5.09087     67.0652     
1 1 1 24 20 59 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 20 60 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 21 0  o 2  18.6203 7.20891 9.13593     9.62594  9.13593     9.62594  2.16704    360         24.9914     360         
1 1 1 24 21 1  o 1  66.137  3.80662 66.3655     12.338   94.8446     12.3221  44.1877    90.5536     8.55026     270.554     
1 1 1 24 21 2  o 11 21.2467 5.8587  3.08345     8.85399  8.16548     9.31752  1.05439    356.73      25.7294     356.73      
1 1 1 24 21 3  o 11 86.8997 3.22721 125.486     14.177   148.305     13.7062  62.1431    103.839     4.77649     283.839     
1 1 1 24 21 4  o 13 88.8508 2.9824  142.923     13.3067  141.95      13.1768  61.5126    104.308     9.11374     284.308     
1 1 1 24 21 5  o 7  60.6109 3.62902 66.3084     10.9814  67.8856     10.854   44.2421    84.3092     0.616173    84.3092     
1 1 1 24 21 6  o 10 24.115  5.95599 10.5461     8.8631   9.69096     8.85597  10.4198    308.703     52.8574     308.703     
1 1 1 24 21 7  o 17 80.1255 3.18806 115.95      12.7247  116.527     12.7748  64.4258    98.675      10.7363     98.675      
1 1 1 24 21 8  o 13 34.3041 5.75841 20.6064     9.56275  25.3656     9.97343  13.9084    92.4233     8.61564     92.4233     
1 1 1 24 21 9  o 7  46.1059 4.50578 41.0618     10.168   38.4577     10.09    23.5263    16.9766     18.5833     196.977     
1 1 1 24 21 10 o 9  24.776  6.18428 8.27102     9.4714   12.8873     9.79647  0.966776   262.694     33.4395     262.694     
1 1 1 24 21 11 o 18 66.403  3.69584 83.665      11.6552  77.6526     12.6603  55.705     94.3605     15.1791     94.3605     
1 1 1 24 21 12 o 19 91.1205 3.25796 142.913     14.735   158.304     14.9     75.8565    120.66      16.9589     120.66      
1 1 1 24 21 13 o 7  36.3506 5.8907  17.2369     10.8897  35.0558     10.6014  6.3068     70.6367     38.294      250.637     
1 1 1 24 21 14 o 14 51.9899 4.34638 52.0953     10.2309  48.5049     11.8092  45.5474    311.984     18.8888     311.984     
1 1 1 24 21 15 o 7  67.7955 3.59295 86.4952     11.327   81.5027     12.7962  51.3429    99.992      3.90013     99.992      
1 1 1 24 21 16 o 8  84.1573 3.28697 125.195     13.0302  132.104     14.5757  50.3853    27.4898     23.7321     207.49      
1 1 1 24 21 17 o 14 36.5099 5.77237 39.1181     9.91113  13.4213     11.7298  26.7125    215.812     15.2841     215.812     
1 1 1 24 21 18 o 17 18.0289 5.26243 -4.11983    7.60793  6.72099     8.54769  0.133227   101.766     14.1035     281.766     
1 1 1 24 21 19 o 3  52.8574 4.136   54.5907     9.98092  49.1757     11.3752  28.8672    31.6324     18.3538     211.632     
1 1 1 24 21 20 o 19 28.3638 6.04167 13.904      9.19643  17.4163     9.44812  14.226     69.8184     3.83505     69.8184     
1 1 1 24 21 21 o 1  44.877  4.49204 38.2236     9.48089  37.5376     10.1361  29.5879    351.56      3.46264     171.56      
1 1 1 24 21 22 o 15 51.2382 3.97835 49.6618     9.64528  47.655      10.4049  34.6331    35.1842     3.56209     215.184     
1 1 1 24 21 23 o 8  25.7379 5.85303 6.73274     8.6157   17.81       9.2585   2.73225    350.069     27.6991     170.069     
1 1 1 24 21 24 o 3  70.572  3.44999 86.6915     11.173   95.5614     13.0722  66.5487    104.603     31.7988     104.603     
1 1 1 24 21 25 o 16 56.1825 3.84148 62.9444     10.3161  53.9118     10.9149  43.9043    297.639     7.85044     297.639     
1 1 1 24 21 26 o 14 131.824 2.81294 321.842     18.25    306.374     18.8438  116.469    293.844     38.6138     293.844     
1 1 1 24 21 27 o 5  48.908  4.36236 42.855      9.80414  47.1452     11.1061  18.7364    350.237     32.7146     170.237     
1 1 1 24 21 28 o 5  16.99   5.38289 -6.84755    8.90685  0.550446    10.1366  0.843038   5.29612     13.0443     185.296     
1 1 1 24 21 29 o 6  40.8734 5.31186 36.563      9.49517  28.7538     11.2199  34.6356    88.3626     14.971      88.3626     
1 1 1 24 21 30 o 18 56.8722 3.94629 57.0821     10.487   63.6098     11.7257  47.8576    303.051     14.8643     303.051     
1 1 1 24 21 31 o 17 15.924  5.0782  -5.193      9.27044  -1.50565    7.9947   1.68631    61.0389     7.32887     241.039     
1 1 1 24 21 32 o 15 83.6685 3.11184 127.914     12.7924  128.128     13.208   67.2694    231.509     13.1355     231.509     
1 1 1 24 21 33 o 9  36.6033 5.44119 31.3935     9.81392  22.3868     9.54784  31.1598    263.565     15.6432     263.565     
1 1 1 24 21 34 o 4  17.5441 5.37837 2.72127     9.02136  -2.45463    8.60093  3.29571    121.571     27.7588     121.571     
1 1 1 24 21 35 o 2  57.3689 4.07936 62.8701     12.0954  61.5918     11.0199  44.3784    313.898     7.2674      313.898     
1 1 1 24 21 36 o 11 36.7789 5.70689 27.5691     10.2153  27.6763     10.243   25.8838    348.852     2.39278     348.852     
1 1 1 24 21 37 o 9  33.1282 5.79958 25.0722     9.64728  20.3575     9.56142  20.0821    86.5347     3.75604     266.535     
1 1 1 24 21 38 o 12 26.7307 6.00876 10.5968     9.30164  18.4724     9.23798  10.6347    65.7981     13.0248     245.798     
1 1 1 24 21 39 o 3  26.0917 5.98566 18.0841     9.32347  9.531       9.04227  9.93594    31.7575     13.2628     211.758     
1 1 1 24 21 40 o 1  25.6779 6.10304 19.5455     10.219   6.80337     9.18229  14.6337    63.1962     0.974422    63.1962     
1 1 1 24 21 41 o 17 66.6608 3.99416 76.7346     13.3473  92.7701     12.9132  58.7977    100.666     24.0374     100.666     
1 1 1 24 21 42 o 1  33.7283 6.34193 23.852      10.9294  25.2527     10.8862  17.2955    142.857     9.71163     322.857     
1 1 1 24 21 43 o 8  24.0718 6.29755 7.16654     10.6353  14.2755     9.98284  10.9069    34.1902     0.38864     34.1902     
1 1 1 24 21 44 o 3  17.2951 5.4315  3.85739     10.0321  -7.45598    9.29318  1.95104    14.0362     8.11359     194.036     
1 1 1 24 21 45 o 8  18.2635 5.63598 -5.03141    10.3437  4.68044     9.72551  2.37993    26.68       12.3333     206.68      
1 1 1 24 21 46 o 16 36.5542 6.41207 27.741      11.8838  30.3843     11.52    25.6961    119.963     4.55844     119.963     
1 1 1 24 21 47 o 16 21.3065 6.19187 1.96307     10.728   9.29367     10.83    6.73928    154.46      10.1384     334.46      
1 1 1 24 21 48 o 9  34.1476 6.48288 20.0724     11.6872  31.1687     11.4235  19.9472    35.2303     4.73397     215.23      
1 1 1 24 21 49 o 10 49.8251 5.53191 43.3813     12.9112  59.4252     13.6407  42.3056    116.409     17.5836     116.409     
1 1 1 24 21 50 o 14 48.3888 5.90127 53.2611     13.0334  45.849      14.3538  35.4559    278.35      5.55542     278.35      
1 1 1 24 21 51 o 14 24.2722 6.75935 12.4353     12.4088  10.2649     11.7534  12.8925    77.481      0.83976     77.481      
1 1 1 24 21 52 o 6  29.7891 7.14392 21.8219     13.1309  20.4092     12.2922  15.8669    258.615     4.94199     78.6153     
1 1 1 24 21 53 o 18 26.2309 7.13396 11.1164     12.0092  20.4301     14.4827  12.5966    355.919     4.28403     175.919     
1 1 1 24 21 54 o 13 26.0156 7.13796 21.2229     13.3688  8.70379     14.3454  10.8312    58.2578     7.52301     238.258     
1 1 1 24 21 55 o 15 30.3288 8.76632 31.7094     27.1365  24.6954     16.5439  8.84431    267.386     4.73031     267.386     
1 1 1 24 21 56 o 5  22.2111 7.22326 -13.0591    26.4298  8.80093     14.5913  5.74756    349.062     5.62834     169.062     
1 1 1 24 21 57 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 22 0  o 13 44.3324 4.80874 37.9246     9.93742  37.9246     9.93742  9.36571    180         85.996      180         
1 1 1 24 22 1  o 2  38.1402 5.20531 29.3422     9.49429  26.7137     9.67484  17.3004    203.612     18.7665     23.6119     
1 1 1 24 22 2  o 12 59.3985 3.80964 70.3796     11.5325  59.6336     10.8837  29.9324    25.4086     27.6402     205.409     
1 1 1 24 22 3  o 7  104.13  3.01771 210.687     15.7745  182.054     15.5998  76.9913    256.098     2.13339     76.0976     
1 1 1 24 22 4  o 5  26.2437 5.8485  20.2046     9.39333  4.09892     9.4372   11.9953    118.158     1.64157     298.158     
1 1 1 24 22 5  o 18 86.0127 3.23465 137.058     13.9848  131.665     13.7994  73.4729    191.95      19.2239     191.95      
1 1 1 24 22 6  o 16 118.101 2.9352  249.253     17.3526  254.702     17.3358  102.769    327.771     28.4576     327.771     
1 1 1 24 22 7  o 3  59.3677 3.97123 71.0612     11.595   59.3339     11.657   42.7239    299.256     1.1001      119.256     
1 1 1 24 22 8  o 5  81.7683 3.33599 123.81      12.8117  119.573     14.3307  73.8615    241.358     26.9647     241.358     
1 1 1 24 22 9  o 7  39.7299 5.21693 27.1173     9.94757  33.8472     10.0284  20.2185    354.308     15.266      174.308     
1 1 1 24 22 10 o 11 99.0467 3.04478 178.174     15.2114  177.14      14.9422  76.9069    259.505     5.93389     259.505     
1 1 1 24 22 11 o 10 29.3409 5.90959 21.1544     9.31015  12.5089     9.29055  16.377     90.6462     1.69127     270.646     
1 1 1 24 22 12 o 3  33.4728 5.74302 20.5588     9.59966  23.5938     9.49303  20.9905    86.5666     1.00567     266.567     
1 1 1 24 22 13 o 7  100.428 2.92821 178.781     14.7068  186.067     14.6998  74.8713    320.337     0.0974698   140.339     
1 1 1 24 22 14 o 10 29.4817 5.44313 4.41205     9.19087  28.5986     9.37407  10.8678    234.089     17.0541     54.0891     
1 1 1 24 22 15 o 11 24.9851 6.07197 12.0715     9.19943  10.6583     9.19325  3.08871    348.293     25.7707     168.293     
1 1 1 24 22 16 o 12 83.8876 3.38802 133.888     13.2131  122.921     14.9844  58.0373    226.162     8.2803      46.1623     
1 1 1 24 22 17 o 1  34.9489 5.93476 22.0944     9.54596  26.5238     10.9964  15.5481    43.1898     16.7765     223.19      
1 1 1 24 22 18 o 10 96.5758 3.23686 173.027     15.0137  166.442     16.1747  80.3462    224.578     17.5319     224.578     
1 1 1 24 22 19 o 16 141.166 3.04811 376.145     21.1796  346.785     21.8348  110.425    206.721     10.0317     206.721     
1 1 1 24 22 20 o 17 47.2925 5.46948 41.8958     12.0269  44.9056     13.0059  25.9317    350.425     15.8644     170.425     
1 1 1 24 22 21 o 9  117.762 3.10723 261.905     17.9736  242.262     18.5832  101.344    159.167     27.7667     159.167     
1 1 1 24 22 22 o 5  39.667  5.72955 37.8406     10.2751  24.6746     11.6563  34.1385    139.148     16.716      139.148     
1 1 1 24 22 23 o 17 20.9977 5.78857 6.79381     8.34572  5.28366     9.27586  0.922849   105.986     24.0956     285.986     
1 1 1 24 22 24 o 7  16.3351 5.13678 -0.445594   7.91528  -3.91815    9.09418  2.63602    47.7548     23.0804     47.7548     
1 1 1 24 22 25 o 11 36.3863 5.51714 32.2329     9.30218  20.5831     10.2819  30.1941    159.716     13.1121     159.716     
1 1 1 24 22 26 o 15 49.7563 4.43382 51.6316     10.0351  42.5192     11.2594  36.0265    164.896     0.870242    164.896     
1 1 1 24 22 27 o 5  48.805  4.31689 52.3501     10.0359  38.4559     10.3021  29.0308    159.446     12.0824     339.446     
1 1 1 24 22 28 o 15 61.502  3.77278 65.7409     10.9712  75.4348     12.0635  38.4932    57.4386     12.4638     237.439     
1 1 1 24 22 29 o 6  79.1949 3.44324 113.339     14.0654  118.472     13.0805  79.9382    151.473     45.121      151.473     
1 1 1 24 22 30 o 16 21.7093 5.50408 14.74       8.59538  -1.59921    8.54613  7.28378    127.164     11.5726     307.164     
1 1 1 24 22 31 o 3  35.9154 5.47013 21.828      9.68916  30.5123     9.46679  22.4435    279.393     4.41028     99.3927     
1 1 1 24 22 32 o 11 20.143  5.64164 3.0628      8.57527  7.80908     8.54107  7.93042    171.85      3.16117     351.85      
1 1 1 24 22 33 o 3  24.4045 5.99027 10.9252     8.96696  12.2734     8.9516   1.54385    192.762     35.96       192.762     
1 1 1 24 22 34 o 2  35.9905 5.66751 26.0649     9.81195  27.3065     10.1086  29.7504    303.299     12.9583     303.299     
1 1 1 24 22 35 o 14 71.4501 3.60154 97.3135     13.0393  94.1685     12.584   56.3428    86.7609     9.82479     86.7609     
1 1 1 24 22 36 o 1  40.56   5.59326 33.6608     11.0063  33.8787     10.9144  27.4384    62.4401     0.841036    242.44      
1 1 1 24 22 37 o 12 27.5622 6.02549 5.2685      10.1873  24.9924     10.2658  12.3566    84.2008     10.6764     264.201     
1 1 1 24 22 38 o 5  31.4373 6.14465 12.4649     10.8263  29.6257     10.4948  8.17463    192.459     26.2146     12.4587     
1 1 1 24 22 39 o 2  30.507  6.54286 17.7174     11.1911  22.8325     10.7443  19.4029    172.553     1.50491     172.553     
1 1 1 24 22 40 o 13 59.8634 4.76833 69.4464     14.6574  71.9956     13.361   39.3112    256.869     5.88721     76.8687     
1 1 1 24 22 41 f 0  70.8932 4.03699 94.508      13.9558  98.1373     14.4877  34.5834    303.794     0           0           
1 1 1 24 22 42 o 4  68.0029 4.21536 81.4699     13.9457  97.4004     14.4336  53.1346    24.596      10.407      24.596      
1 1 1 24 22 43 o 9  44.3278 5.73263 48.5397     11.9581  33.7357     12.3555  40.0598    170.272     22.3114     170.272     
1 1 1 24 22 44 o 1  38.2847 6.26561 32.585      11.6066  30.6009     11.9684  32.6762    271.01      17.1426     271.01      
1 1 1 24 22 45 o 2  19.1869 5.88309 2.49987     10.5766  1.33435     10.3483  4.24484    249.783     13.1006     69.7825     
1 1 1 24 22 46 f 0  17.6486 5.64146 -4.90389    10.9202  0.101705    10.5326  10.1724    307.526     0           0           
1 1 1 24 22 47 o 13 40.0411 6.76191 37.3662     13.6138  34.806      13.1533  32.4753    282.232     12.7981     282.232     
1 1 1 24 22 48 o 11 56.328  5.6079  69.0765     15.9671  63.8447     14.8222  40.5465    176.52      3.25356     176.52      
1 1 1 24 22 49 o 9  18.6553 5.92311 -2.91798    12.2487  1.75409     10.9782  5.39338    274.517     2.49515     94.5171     
1 1 1 24 22 50 o 11 52.8272 6.1395  58.0595     15.9053  64.9352     15.3791  49.0961    83.1019     28.2749     83.1019     
1 1 1 24 22 51 o 1  28.3284 7.80058 8.72939     17.6531  29.3481     16.4171  16.2705    232.862     3.37882     232.862     
1 1 1 24 22 52 o 5  34.9464 8.60527 36.9065     18.2805  35.4289     18.7098  24.322     334.925     10.1164     334.925     
1 1 1 24 22 53 o 12 26.0176 8.12995 3.53456     16.5982  30.6253     24.413   7.38767    59.3592     1.82591     59.3592     
1 1 1 24 22 54 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 22 55 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 23 0  o 19 20.66   7.36365 11.8491     9.41909  11.8491     9.41909  15.1623    8.83219e-06 61.3774     8.83219e-06 
1 1 1 24 23 1  o 10 41.702  5.177   22.5426     10.2057  46.2424     10.1092  25.8457    340.546     7.30178     160.546     
1 1 1 24 23 2  o 7  166.853 2.7492  499.039     23.0052  505.277     22.9697  160.03     166.033     67.7354     166.033     
1 1 1 24 23 3  f 0  27.2749 5.88514 22.0908     9.70898  5.67393     9.34139  21.8183    330.827     0           0           
1 1 1 24 23 4  o 1  88.6904 3.11566 150.299     13.8591  135.757     13.7279  100.144    353.577     69.8437     353.577     
1 1 1 24 23 5  o 9  41.6037 5.11273 28.0542     10.2299  39.0255     10.1636  22.904     60.8825     13.4469     240.882     
1 1 1 24 23 6  o 14 51.5473 4.25974 46.9717     10.752   52.5252     10.8102  46.0341    326.642     18.8738     326.642     
1 1 1 24 23 7  o 6  27.9543 5.78596 6.04493     9.42081  23.4209     9.45783  11.4808    106.188     13.1372     286.188     
1 1 1 24 23 8  o 1  20.9042 5.82811 -0.410694   9.42077  9.71856     9.3349   5.66052    41.6402     7.34197     221.64      
1 1 1 24 23 9  o 12 33.8653 6.40463 22.1244     11.4573  24.1535     10.7426  12.4642    168.493     22.1259     348.493     
1 1 1 24 23 10 o 8  45.6082 5.25747 54.1997     10.9756  27.937      11.3597  11.533     23.67       43.6461     203.67      
1 1 1 24 23 11 o 17 62.8547 3.8882  70.1917     12.0758  76.1531     12.1579  40.4611    270.229     11.9568     90.2291     
1 1 1 24 23 12 o 11 28.9184 6.40904 17.6354     10.5996  15.4778     10.0708  6.37944    40.7676     26.6615     220.768     
1 1 1 24 23 13 o 9  73.871  3.61208 102.355     13.5621  98.3797     13.0181  62.7226    121.072     16.1858     121.072     
1 1 1 24 23 14 o 14 39.5168 5.35528 23.9488     10.1194  37.7042     10.2333  13.9647    65.2519     28.8662     245.252     
1 1 1 24 23 15 o 2  37.8927 6.32664 31.1265     11.8787  27.092      11.7856  22.7095    207.69      7.42167     27.6905     
1 1 1 24 23 16 o 12 59.6752 3.8783  61.831      11.4404  70.5938     11.4498  38.3142    82.2337     11.231      262.234     
1 1 1 24 23 17 o 17 72.8095 3.54784 89.2593     12.9636  106.32      12.6486  61.2729    260.673     15.0049     260.673     
1 1 1 24 23 18 o 9  55.9925 3.96618 56.0113     10.526   61.1279     11.438   35.2611    103.229     11.6236     283.229     
1 1 1 24 23 19 o 13 41.7626 5.09922 36.2799     9.72831  31.7221     10.7333  22.1512    35.9793     15.7037     215.979     
1 1 1 24 23 20 o 3  27.5282 6.15349 20.7019     10.0137  8.89915     9.82115  17.8654    185.276     2.79153     185.276     
1 1 1 24 23 21 o 12 106.561 3.07778 206.443     15.9713  208.437     16.8231  88.3317    17.5255     17.8918     17.5255     
1 1 1 24 23 22 o 18 84.6331 3.15846 129.549     12.8393  133.038     13.8486  83.4117    359.419     42.0736     359.419     
1 1 1 24 23 23 o 17 19.1274 5.78824 -1.56154    8.91396  4.9626      10.8733  3.1657     330.79      15.9926     150.79      
1 1 1 24 23 24 o 6  19.9084 5.70931 8.9228      9.38525  -1.57958    9.11283  4.30764    98.2124     15.1181     278.212     
1 1 1 24 23 25 o 13 21.8193 5.96117 7.49206     9.24899  7.49364     9.25316  9.73589    231.269     4.69152     51.2689     
1 1 1 24 23 26 o 1  20.4072 5.86962 3.24066     9.55646  6.5762      9.37343  0.536526   80.9704     27.4823     80.9704     
1 1 1 24 23 27 o 14 36.7239 5.89836 30.4018     10.6882  25.4041     10.5543  19.2394    336.098     13.0953     156.098     
1 1 1 24 23 28 o 2  38.4379 5.75825 36.1482     10.7226  24.9061     10.8207  23.2322    287.676     7.41257     107.676     
1 1 1 24 23 29 o 10 17.811  5.53108 1.24833     9.83104  -1.38762    9.18395  2.95033    143.889     13.3824     323.889     
1 1 1 24 23 30 o 14 22.1729 5.99709 8.24908     9.21491  8.51877     9.38009  10.184     340.676     3.98998     160.676     
1 1 1 24 23 31 o 14 23.1177 5.9603  17.0627     9.97793  -0.575284   9.94372  10.8797    220.872     5.00624     40.8716     
1 1 1 24 23 32 o 15 39.9259 5.77136 24.7274     11.1681  42.3316     11.1845  27.6993    150.555     0.195631    150.555     
1 1 1 24 23 33 o 10 38.185  5.98289 35.1016     11.1373  26.587      11.2214  27.4431    194.18      2.99142     194.18      
1 1 1 24 23 34 o 17 39.7666 6.23742 32.9775     11.9149  34.6093     12.2962  29.004     40.8032     3.96365     40.8032     
1 1 1 24 23 35 o 9  63.1601 4.40686 78.5788     14.1344  76.4537     13.3957  38.9059    220.321     13.0857     40.3209     
1 1 1 24 23 36 o 17 17.7683 5.55983 -5.7957     9.83434  3.68125     10.13    2.69633    308.787     3.22151     128.787     
1 1 1 24 23 37 o 15 21.9605 6.35207 -0.552012   11.5968  12.1803     11.5405  7.34898    256.79      8.54568     76.7899     
1 1 1 24 23 38 o 7  20.8936 6.12577 6.54047     10.3459  4.3622      10.7271  6.09185    223.16      1.59266     43.1603     
1 1 1 24 23 39 o 17 59.7255 5.03524 60.692      15.0304  82.6669     13.7443  58.1399    3.52135     33.4609     3.52135     
1 1 1 24 23 40 o 13 51.2486 5.10414 53.1948     12.8269  52.7002     12.6654  39.1087    337.202     6.69162     337.202     
1 1 1 24 23 41 o 5  48.4646 5.62407 60.9338     13.3853  37.3417     12.6069  40.6621    244.668     14.6306     244.668     
1 1 1 24 23 42 o 13 29.8313 7.0472  12.3308     12.9604  26.9495     12.9145  21.0651    343.314     6.10362     343.314     
1 1 1 24 23 43 o 2  27.4628 7.05366 17.6459     12.5703  15.2278     12.5422  15.0081    85.0318     4.19933     265.032     
1 1 1 24 23 44 o 18 25.6302 6.87379 17.5658     12.3717  9.11464     12.3627  13.8635    113.871     6.69913     113.871     
1 1 1 24 23 45 o 4  41.7786 6.76416 14.7634     17.2214  67.0424     15.13    32.2235    168.676     8.4843      168.676     
1 1 1 24 23 46 o 17 41.6056 8.27418 42.417      18.5012  47.432      17.5897  37.1143    200.313     22.5225     200.313     
1 1 1 24 23 47 o 4  62.3912 6.64261 102.902     19.8105  74.2245     19.8013  53.4155    56.2815     20.7041     56.2815     
1 1 1 24 23 48 o 9  19.8889 6.52808 -5.50608    15.7137  0.194168    15.5657  5.55465    274.174     6.42498     94.1745     
1 1 1 24 23 49 o 15 35.8042 8.2428  46.6776     17.8123  26.4143     17.5037  23.0505    317.448     15.5231     317.448     
1 1 1 24 23 50 o 6  16.3385 5.63196 -11.0657    15.4748  -20.2311    14.1964  0.61128    359.121     3.72713     179.121     
1 1 1 24 23 51 o 7  19.1857 6.3538  5.19132     15.7652  -15.7093    15.6022  2.81299    292.435     6.96311     112.435     
1 1 1 24 23 52 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 24 0  o 3  13.4337 6.39241 -4.62469    12.2998  -4.62469    12.2998  12.9951    180         36.6646     180         
1 1 1 24 24 1  o 16 52.025  4.46876 51.293      11.1934  51.293      11.1934  64.8599    210         56.2529     210         
1 1 1 24 24 2  f 0  96.8517 3.0498  169.365     14.7356  169.365     14.7356  75.4113    60          0           0           
1 1 1 24 24 3  f 0  18.4712 7.12343 9.3389      9.36103  9.3389      9.36103  15.6283    270         0           0           
1 1 1 24 24 4  o 2  12.259  5.72452 -1.27319    9.09478  -1.27319    9.09478  0.202289   120         1.30147     120         
1 1 1 24 24 5  f 0  26.3147 7.4725  17.9496     9.58015  17.9496     9.58015  8.65381    150         0           0           
1 1 1 24 24 6  o 6  49.7423 4.53108 47.1716     10.7806  47.1716     10.7806  25.9468    180         23.8683     360         
1 1 1 24 24 7  o 11 14.0963 6.26012 2.58714     9.22936  2.58714     9.22936  0.079373   30.0003     0.790116    210         
1 1 1 24 24 8  o 1  65.7949 3.84101 79.8914     12.4593  79.8914     12.4593  55.7213    240         11.3085     240         
1 1 1 24 24 9  o 4  43.075  5.87838 37.684      11.3272  37.684      11.3272  32.7944    270         0.0664291   270         
1 1 1 24 24 10 o 13 16.0571 6.81245 5.62945     9.83536  5.62945     9.83536  2.45808    300         4.07137     120         
1 1 1 24 24 11 o 12 55.1303 4.34892 57.3192     11.6325  57.3192     11.6325  62.2136    150         40.6678     150         
1 1 1 24 24 12 o 5  114.127 2.93972 234.826     16.7627  234.826     16.7627  91.8154    180         10.3231     180         
1 1 1 24 24 13 o 11 59.8899 4.15027 67.0406     12.1626  67.0406     12.1626  43.8408    30          3.20147     210         
1 1 1 24 24 14 o 10 58.8697 4.82514 66.0133     13.7375  66.0133     13.7375  35.4155    240         18.4371     60          
1 1 1 24 24 15 o 9  17.1373 7.06883 7.35385     10.0673  7.35385     10.0673  3.95646    90          12.5904     270         
1 1 1 24 24 16 o 5  15.3284 6.67341 4.34652     9.97707  4.34652     9.97707  4.10178    120         29.143      120         
1 1 1 24 24 17 o 10 32.6102 7.55272 25.5177     10.9402  25.5177     10.9402  23.1711    150         2.8134      330         
1 1 1 24 24 18 o 5  33.5077 7.42161 26.474      10.9342  26.474      10.9342  28.5975    360         21.8622     360         
1 1 1 24 24 19 o 1  14.095  6.13131 3.60999     8.40556  3.60999     8.40556  5.34962    30          29.4614     30          
1 1 1 24 24 20 o 9  19.8915 7.4532  11.4106     9.97888  11.4106     9.97888  9.75619    240         4.86052     60          
1 1 1 24 24 21 o 8  59.1633 4.03727 65.6028     11.6974  65.6028     11.6974  48.8114    270         8.51495     270         
1 1 1 24 24 22 o 5  12.8717 5.83114 1.31538     8.48297  1.31538     8.48297  14.4852    300         47.2245     300         
1 1 1 24 24 23 o 16 33.7313 6.69846 25.7457     9.80025  25.7457     9.80025  4.16019    150         3.44831     150         
1 1 1 24 24 24 o 16 57.0331 3.91124 60.995      10.9214  60.995      10.9214  56.6534    5.47994e-09 27.7272     5.47994e-09 
1 1 1 24 24 25 o 12 13.9341 6.1279  3.28079     8.6213   3.28079     8.6213   0.599479   30          9.88969     210         
1 1 1 24 24 26 o 5  21.1108 7.57087 13.1206     9.9902   13.1206     9.9902   11.5813    240         1.28486     60          
1 1 1 24 24 27 o 17 10.9073 5.29187 -5.11628    9.31699  -5.11628    9.31699  2.41465    270         10.4486     270         
1 1 1 24 24 28 o 7  12.4366 5.82721 -1.09403    9.55341  -1.09403    9.55341  0.589702   120         6.32009     120         
1 1 1 24 24 29 o 16 12.7585 6.04475 -2.29297    10.7805  -2.29297    10.7805  3.91729    150         20.7517     150         
1 1 1 24 24 30 o 18 33.0678 8.68819 28.9268     13.3758  28.9268     13.3758  31.1007    180         17.2917     180         
1 1 1 24 24 31 f 0  46.2285 6.51118 45.0602     13.3938  45.0602     13.3938  27.8459    30          0           0           
1 1 1 24 24 32 o 9  16.9722 7.30614 6.77364     11.6578  6.77364     11.6578  1.00305    60          1.24522     240         
1 1 1 24 24 33 o 12 13.6813 6.44621 -1.43525    11.9662  -1.43525    11.9662  2.88375    270         18.2176     270         
1 1 1 24 24 34 f 0  16.7415 7.25213 6.37894     11.6469  6.37894     11.6469  26.9965    300         0           0           
1 1 1 24 24 35 o 13 18.9038 7.61324 10.3423     11.2641  10.3423     11.2641  1.86315    330         0.408744    150         
1 1 1 24 24 36 o 12 26.0133 8.34675 19.7879     11.7499  19.7879     11.7499  9.96833    180         17.8958     8.64914e-06 
1 1 1 24 24 37 o 1  54.4047 5.37656 58.7209     13.8393  58.7209     13.8393  53.0201    30          26.1747     30          
1 1 1 24 24 38 o 18 15.9658 7.08836 4.62346     11.8239  4.62346     11.8239  1.32408    60.0001     0.940453    240         
1 1 1 24 24 39 o 5  20.7278 8.20848 13.117      12.808   13.117      12.808   1.53227    90.0002     0.574496    90.0002     
1 1 1 24 24 40 o 17 57.7766 7.10279 70.7163     18.705   70.7163     18.705   50.7375    120         17.1988     120         
1 1 1 24 24 41 o 19 18.4549 8.19397 7.79287     15.8029  7.79287     15.8029  5.87627    330         11.6029     150         
1 1 1 24 24 42 o 15 22.5998 9.19305 16.9345     16.6614  16.9345     16.6614  6.87469    180         18.311      8.65974e-06 
1 1 1 24 24 43 o 5  60.1397 7.17484 77.6955     19.7759  77.6955     19.7759  64.7658    210         42.4124     210         
1 1 1 24 24 44 o 6  33.0467 10.2569 34.9526     17.7419  34.9526     17.7419  16.7837    60          14.095      240         
1 1 1 24 24 45 o 9  26.6717 10.007  26.014      18.0086  26.014      18.0086  7.81594    270         4.27771     270         
1 1 1 24 24 46 f 0  15.9504 7.50266 1.69575     16.0938  1.69575     16.0938  0.569384   300         0           0           
1 1 1 24 24 47 o 4  17.6239 8.02178 7.0833      16.2964  7.0833      16.2964  2.25973    330         4.8288      150         
1 1 1 24 24 48 o 6  23.1125 9.39634 20.1469     17.3919  20.1469     17.3919  0.0165599  179.994     0.00194026  179.994     
1 1 1 24 24 49 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 24 24 50 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 0  0  o 8  423.183 6.36165 3180.05     134.777  3180.05     134.777  193.561    180         234.03      360         
1 1 1 25 0  1  o 7  106.645 2.6893  202.34      14.3313  202.34      14.3313  27.2679    240         96.2373     60          
1 1 1 25 0  2  o 2  440.278 5.17029 3441.33     114.007  3441.33     114.007  428.56     120         210.946     120         
1 1 1 25 0  3  o 19 86.2926 2.79324 132.808     12.0215  132.808     12.0215  21.4682    180         21.7603     8.65047e-06 
1 1 1 25 0  4  o 7  27.2927 6.12452 16.6537     7.36927  16.6537     7.36927  1.59236    59.9995     3.4991      59.9995     
1 1 1 25 0  5  o 13 282.34  3.24548 1414.17     45.8936  1414.17     45.8936  194.295    300         25.5446     120         
1 1 1 25 0  6  f 0  73.5438 2.6399  96.5994     9.67207  96.5994     9.67207  139.542    360         0           0           
1 1 1 25 0  7  o 5  65.1476 2.89167 76.1117     9.3545   76.1117     9.3545   9.88076    240         72.3758     240         
1 1 1 25 0  8  o 6  456.884 4.54706 3704.14     104.065  3704.14     104.065  426.9      120         184.366     120         
1 1 1 25 0  9  o 17 280.493 3.14439 1395.66     44.1747  1395.66     44.1747  181.923    180         46.9429     8.6518e-06  
1 1 1 25 0  10 o 5  179.127 2.59618 569.399     23.2832  569.399     23.2832  185.235    60          120.63      60          
1 1 1 25 0  11 o 15 310.89  3.47488 1714.74     54.1082  1714.74     54.1082  213.257    300         28.2909     120         
1 1 1 25 0  12 o 9  143.69  2.55649 366.627     18.3827  366.627     18.3827  71.8554    180         65.8833     360         
1 1 1 25 0  13 o 5  377.856 3.91792 2533.18     74.1536  2533.18     74.1536  393.871    240         235.706     240         
1 1 1 25 0  14 o 17 453.214 4.76221 3645.75     108.108  3645.75     108.108  389.352    300         117.064     300         
1 1 1 25 0  15 o 7  21.2991 5.9345  11.0701     6.08205  11.0701     6.08205  17.0794    180         36.6557     180         
1 1 1 25 0  16 o 8  134.911 2.70035 323.379     18.2239  323.379     18.2239  122.294    240         60.809      240         
1 1 1 25 0  17 o 16 25.4192 6.17846 14.8993     7.0785   14.8993     7.0785   26.9183    300         60.5808     300         
1 1 1 25 0  18 o 17 352.548 3.95852 2205.65     69.8979  2205.65     69.8979  201.873    180         109.114     8.65149e-06 
1 1 1 25 0  19 o 19 112.172 2.73963 223.825     15.3589  223.825     15.3589  69.5905    240         46.4075     240         
1 1 1 25 0  20 f 0  36.4423 4.28506 25.4154     7.17585  25.4154     7.17585  94.3268    120         0           0           
1 1 1 25 0  21 o 3  149.027 2.65653 394.409     19.8114  394.409     19.8114  155.923    180         100.443     180         
1 1 1 25 0  22 o 5  452.646 4.4765  3636.62     101.5    3636.62     101.5    369.738    240         83.9054     240         
1 1 1 25 0  23 o 7  113.008 2.52107 227.033     14.2453  227.033     14.2453  93.7499    300         59.3464     300         
1 1 1 25 0  24 o 14 79.7714 2.72352 113.586     10.8297  113.586     10.8297  6.56426    360         2.13206     360         
1 1 1 25 0  25 o 6  357.365 3.70861 2266.19     66.3855  2266.19     66.3855  276.479    60          37.3972     60          
1 1 1 25 0  26 o 9  201.525 2.81302 720.787     28.3845  720.787     28.3845  217.571    120         145.039     120         
1 1 1 25 0  27 f 0  201.845 2.84039 723.102     28.7056  723.102     28.7056  159.741    180         0           0           
1 1 1 25 0  28 o 7  117.929 2.59891 247.24      15.3255  247.24      15.3255  56.6113    240         55.8969     60          
1 1 1 25 0  29 o 1  478.154 4.67827 4059.5      112.054  4059.5      112.054  341.174    120         3.36755     300         
1 1 1 25 0  30 o 13 84.6309 2.67897 127.73      11.3101  127.73      11.3101  46.4033    360         14.9545     180         
1 1 1 25 0  31 o 5  83.0275 2.80822 123.048     11.6234  123.048     11.6234  45.1286    240         12.599      60          
1 1 1 25 0  32 o 19 14.9965 6.05511 5.11783     7.15088  5.11783     7.15088  45.0249    300         94.3597     300         
1 1 1 25 0  33 o 1  68.6053 2.90199 84.3394     9.89477  84.3394     9.89477  16.0792    1.83482e-06 52.4324     180         
1 1 1 25 0  34 o 10 38.3484 4.32365 27.9974     7.67701  27.9974     7.67701  4.43026    60          15.4388     60          
1 1 1 25 0  35 o 6  430.268 4.79693 3288.83     103.376  3288.83     103.376  369.254    120         127.98      120         
1 1 1 25 0  36 o 14 68.0853 2.71757 82.968      9.20435  82.968      9.20435  11.371     360         0.248251    180         
1 1 1 25 0  37 o 8  44.6559 3.51388 36.6628     7.6147   36.6628     7.6147   20.86      60          88.8554     60          
1 1 1 25 0  38 o 17 41.8129 3.81232 32.5275     7.62375  32.5275     7.62375  44.3262    120         139.758     120         
1 1 1 25 0  39 o 10 389.129 3.64398 2687.96     71.0327  2687.96     71.0327  329.495    180         111.335     180         
1 1 1 25 0  40 o 17 267.013 2.90387 1265.31     38.8364  1265.31     38.8364  269.525    240         164.079     240         
1 1 1 25 0  41 f 0  119.93  2.46908 255.676     14.8111  255.676     14.8111  44.4102    120         0           0           
1 1 1 25 0  42 o 18 148.437 2.68747 391.525     19.9619  391.525     19.9619  144.464    1.90932e-08 81.4537     1.90932e-08 
1 1 1 25 0  43 o 8  212.434 2.72419 801.214     28.9802  801.214     28.9802  161.172    240         26.0652     240         
1 1 1 25 0  44 o 1  119.304 2.67211 253.228     15.9396  253.228     15.9396  110.924    120         56.0894     120         
1 1 1 25 0  45 o 16 94.0318 2.83242 157.729     13.2921  157.729     13.2921  36.6764    1.19683e-06 57.1462     180         
1 1 1 25 0  46 o 8  84.9577 2.81332 128.913     11.9179  128.913     11.9179  76.6172    60          42.4408     60          
1 1 1 25 0  47 o 11 85.7775 2.79002 131.398     11.9354  131.398     11.9354  79.8933    120         49.7727     120         
1 1 1 25 0  48 o 3  119.183 2.56206 252.749     15.2706  252.749     15.2706  118.214    5.26734e-07 72.4834     5.26734e-07 
1 1 1 25 0  49 o 2  82.9338 2.83339 122.96      11.7131  122.96      11.7131  72.9204    240         34.0517     240         
1 1 1 25 0  50 o 8  33.1407 6.15368 23.2104     8.82991  23.2104     8.82991  0.485978   120         28.2446     120         
1 1 1 25 0  51 o 18 77.8568 3.26229 108.875     12.6253  108.875     12.6253  60.2526    180         15.0231     180         
1 1 1 25 0  52 o 19 25.7182 6.96732 16.104      8.47868  16.104      8.47868  6.55466    240         26.2906     240         
1 1 1 25 0  53 o 7  132.35  2.72432 311.987     18.0346  311.987     18.0346  102.526    120         25.2987     120         
1 1 1 25 0  54 o 16 11.5449 5.25751 0.0978114   7.01179  0.0978114   7.01179  21.3422    180         46.9427     180         
1 1 1 25 0  55 o 17 89.0106 2.79866 141.676     12.4276  141.676     12.4276  83.3623    60          46.6483     60          
1 1 1 25 0  56 o 15 122.442 2.67208 267.268     16.3607  267.268     16.3607  97.8636    300         30.9263     300         
1 1 1 25 0  57 o 14 90.01   2.95436 145.111     13.2608  145.111     13.2608  47.3528    360         26.0658     180         
1 1 1 25 0  58 o 11 61.2305 3.39408 68.0653     10.2634  68.0653     10.2634  35.7499    60          10.3921     240         
1 1 1 25 0  59 o 8  24.038  6.93063 14.5796     8.20361  14.5796     8.20361  3.70725    300         13.3251     120         
1 1 1 25 0  60 o 2  14.591  6.09266 4.4836      7.63614  4.4836      7.63614  13.6907    8.65137e-06 39.8052     8.65137e-06 
1 1 1 25 0  61 o 16 103.547 2.74701 191.815     14.2091  191.815     14.2091  61.9504    60          13.2331     240         
1 1 1 25 0  62 o 13 160.604 2.66693 460.271     21.4381  460.271     21.4381  118.87     120         25.7632     120         
1 1 1 25 0  63 o 16 93.0636 3.05785 155.603     14.1908  155.603     14.1908  90.6173    180         58.8265     180         
1 1 1 25 0  64 o 2  99.3643 2.79118 176.906     13.8489  176.906     13.8489  71.8612    240         13.4846     240         
1 1 1 25 0  65 o 8  15.9575 6.32288 6.40305     7.60474  6.40305     7.60474  15.7046    120         49.6615     120         
1 1 1 25 0  66 o 1  26.3862 6.639   16.6917     7.99833  16.6917     7.99833  12.3666    5.92084e-08 2.6089      180         
1 1 1 25 0  67 o 11 75.4724 3.01796 102.837     11.3305  102.837     11.3305  39.8201    60          18.2136     240         
1 1 1 25 0  68 f 0  32.6551 6.66794 23.7782     9.46424  23.7782     9.46424  30.6312    120         0           0           
1 1 1 25 0  69 o 9  13.2305 6.07925 0.0555378   9.66053  0.0555378   9.66053  0.322258   180         1.87597     180         
1 1 1 25 0  70 o 2  29.0985 7.45008 20.8967     9.97146  20.8967     9.97146  18.809     60          3.36229     60          
1 1 1 25 0  71 o 3  20.2882 7.21662 11.58       9.0372   11.58       9.0372   0.99577    120         21.9288     300         
1 1 1 25 0  72 o 2  25.5737 7.51106 17.3278     9.59014  17.3278     9.59014  8.46724    360         3.24545     360         
1 1 1 25 0  73 o 8  55.9501 5.90605 61.8487     15.474   61.8487     15.474   47.5443    60          24.2342     60          
1 1 1 25 0  74 o 4  24.4012 8.32166 17.2028     11.8099  17.2028     11.8099  8.52026    300         9.22926     120         
1 1 1 25 0  75 o 10 48.7149 6.46556 48.7237     14.1585  48.7237     14.1585  35.2977    180         9.44249     180         
1 1 1 25 0  76 o 9  11.3606 5.53249 -6.4835     10.4076  -6.4835     10.4076  2.04025    240         6.73625     240         
1 1 1 25 0  77 o 12 54.9744 7.16021 62.6461     17.754   62.6461     17.754   42.8946    120         17.2955     120         
1 1 1 25 0  78 o 19 24.3803 8.18757 17.1992     11.3837  17.1992     11.3837  11.2912    180         4.31889     8.41364e-06 
1 1 1 25 0  79 o 11 29.4621 8.33295 23.3963     11.929   23.3963     11.929   17.6673    60          9.49206     60          
1 1 1 25 0  80 o 16 13.2043 6.26259 -2.40869    11.6274  -2.40869    11.6274  3.18795    300         13.7868     300         
1 1 1 25 0  81 f 0  31.3461 9.35032 28.6518     14.8148  28.6518     14.8148  8.57091    360         0           0           
1 1 1 25 0  82 o 18 15.5471 7.12555 2.61522     13.1563  2.61522     13.1563  1.22643    60          6.89312     60          
1 1 1 25 0  83 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 1  0  f 0  323.133 4.26233 1853.52     68.9682  1853.52     68.9682  212.738    1.42527e-05 0           0           
1 1 1 25 1  1  o 13 117.724 2.66793 251.778     16.1128  240.221     15.3282  52.0263    326.594     42.4528     146.594     
1 1 1 25 1  2  o 13 312.665 3.52735 1746.55     53.9556  1721.71     56.5332  179.89     229.211     91.1318     49.2114     
1 1 1 25 1  3  o 18 437.251 4.53206 3408.97     96.9024  3379.01     101.636  270.466    135.703     95.1322     315.703     
1 1 1 25 1  4  o 5  136.695 2.75317 341.998     19.8302  321.308     17.8474  23.8803    334.234     138.853     154.234     
1 1 1 25 1  5  o 14 61.6069 2.74812 63.9551     8.00023  71.2679     8.88846  16.6078    8.13888     85.4754     8.13888     
1 1 1 25 1  6  o 1  150.06  2.45669 398.254     18.0642  400.153     18.878   85.8682    154.449     28.8        334.449     
1 1 1 25 1  7  o 13 250.258 2.92877 1108.66     35.9635  1112.5      37.4855  221.094    336.158     91.6946     336.158     
1 1 1 25 1  8  o 10 331.669 3.53094 1978.7      53.4682  1924.28     63.3445  247.474    342.077     17.5946     342.077     
1 1 1 25 1  9  o 10 356.949 3.56701 2284.05     61.2712  2236.65     66.1912  290.856    143.661     67.5515     143.661     
1 1 1 25 1  10 o 11 204.749 2.64887 750.608     26.1541  736.014     28.1471  153.3      236.701     21.8272     236.701     
1 1 1 25 1  11 o 5  177.991 2.48552 563.975     21.3417  559.36      22.9625  98.1363    355.889     51.4484     175.889     
1 1 1 25 1  12 o 8  106.69  2.47304 202.762     12.9985  201.281     13.406   40.5905    301.267     54.1773     121.267     
1 1 1 25 1  13 o 11 412.163 4.31273 3037.67     86.9537  2993.71     91.124   312.759    117.291     28.9699     117.291     
1 1 1 25 1  14 o 13 342.866 4.0232  2103.63     67.2717  2069.21     70.9034  215.199    62.7859     64.654      242.786     
1 1 1 25 1  15 o 13 194.046 2.81772 667.921     26.7838  667.511     28.0038  58.6066    161.032     158.834     341.032     
1 1 1 25 1  16 o 1  149.228 2.85889 399.372     19.6464  390.813     22.9214  109.076    18.4903     17.0753     18.4903     
1 1 1 25 1  17 o 8  156.584 2.66759 448.275     19.9068  421.738     21.8209  13.7893    7.98289     193.968     187.983     
1 1 1 25 1  18 o 14 160.297 2.84218 452.202     22.2854  459.478     23.3532  118.279    309.406     16.6731     309.406     
1 1 1 25 1  19 o 7  135.525 2.56398 312.553     16.9655  339.546     17.8336  69.5035    354.331     46.2339     174.331     
1 1 1 25 1  20 o 9  68.062  2.75476 81.6274     9.24517  83.2172     9.46875  17.5752    146.035     10.8072     326.035     
1 1 1 25 1  21 o 1  72.5954 2.64544 96.6314     9.22645  90.8204     9.91485  24.426     336.838     19.5739     156.838     
1 1 1 25 1  22 o 6  409.62  3.95498 2990.41     77.7498  2967        84.4568  348.187    66.7477     108.201     66.7477     
1 1 1 25 1  23 o 12 473.991 4.51332 4000.75     104.887  3981.41     109.468  336.17     184.523     10.0102     4.52349     
1 1 1 25 1  24 o 4  266.677 3.04576 1259.86     39.0025  1263.33     42.342   160.166    201.761     59.0947     21.7614     
1 1 1 25 1  25 o 6  67.4252 2.81255 83.8216     8.79036  78.0607     10.0329  10.6351    177.401     102.185     177.401     
1 1 1 25 1  26 o 3  99.3992 2.55601 178.769     12.4028  172.156     12.9973  58.0986    114.028     2.14939     294.027     
1 1 1 25 1  27 o 9  282.414 3.27244 1420.84     44.1321  1409.77     48.3819  145.262    49.4037     110.887     229.404     
1 1 1 25 1  28 o 18 239.566 2.89822 1033.14     33.2817  1003.21     36.1985  171.136    236.223     5.91854     236.223     
1 1 1 25 1  29 o 17 97.6994 2.52897 175.42      11.7864  163.7       12.8628  48.4683    302.329     23.4456     122.329     
1 1 1 25 1  30 f 0  483.735 4.60356 4127.11     109.122  4191.97     114.055  264.684    106.936     0           0           
1 1 1 25 1  31 o 4  146.598 2.622   379.882     18.3793  382.759     20.0955  75.2403    81.5789     48.6448     261.579     
1 1 1 25 1  32 o 9  204.882 2.66538 736.163     27.3315  753.069     27.4003  118.114    291.232     48.7637     111.232     
1 1 1 25 1  33 o 1  210.404 2.64558 783.565     27.2984  786.995     28.4828  150.021    259.897     8.82224     259.897     
1 1 1 25 1  34 o 9  399.091 3.92604 2847.97     76.8068  2810.9      80.1744  272.03     245.942     19.7658     65.9416     
1 1 1 25 1  35 o 8  337.194 3.59019 1949.87     60.5941  2089.65     60.69    275.704    358.983     78.3131     358.983     
1 1 1 25 1  36 f 0  153.533 2.46137 419.523     18.5233  416.735     19.3414  82.2652    10.5264     0           0           
1 1 1 25 1  37 o 4  198.568 2.66515 709.878     26.4821  689.385     26.5546  116.984    301.453     40.2826     121.453     
1 1 1 25 1  38 o 6  252.265 2.83168 1114.52     35.0541  1144.51     36.5421  224.858    306.054     101.344     306.054     
1 1 1 25 1  39 o 15 369.323 3.66656 2398.89     67.8481  2449.76     67.8699  299.386    317.162     82.5032     317.162     
1 1 1 25 1  40 o 2  158.31  2.48588 444.835     19.281   444.629     20.1529  115.236    155.72      15.8027     155.72      
1 1 1 25 1  41 o 6  70.4855 2.96124 82.9848     10.395   94.2811     10.3971  24.6005    79.1529     38.0505     259.153     
1 1 1 25 1  42 o 19 243.857 2.81883 1054.7      33.7155  1057.45     35.1668  143.552    41.9514     50.7444     221.951     
1 1 1 25 1  43 o 3  99.2061 2.63937 176.057     13.0201  173.982     13.1753  68.113     51.3087     8.71022     51.3087     
1 1 1 25 1  44 f 0  117.521 2.58478 244.538     14.0371  246.505     16.295   124.531    194.049     0           0           
1 1 1 25 1  45 o 9  149.828 2.65543 382.055     20.2901  416.217     19.4969  112.133    128.719     22.5989     128.719     
1 1 1 25 1  46 o 16 160.298 2.49707 443.09      19.5982  470.044     20.5243  108.227    20.7687     0.671685    200.769     
1 1 1 25 1  47 o 9  31.9733 4.89193 14.3547     7.39859  24.0491     7.91813  3.13759    231.272     25.1412     231.272     
1 1 1 25 1  48 o 4  179.471 2.57669 571.82      22.6668  573.447     23.6733  144.708    134.224     46.9025     134.224     
1 1 1 25 1  49 o 15 26.2777 5.29199 15.0605     7.15245  10.2056     7.65858  9.39093    328.551     35.1007     328.551     
1 1 1 25 1  50 o 2  63.0309 3.27791 80.7046     9.50987  62.3613     10.7042  40.6942    3.36096     15.9932     3.36096     
1 1 1 25 1  51 o 14 103.336 2.83054 181.548     14.5226  199.706     14.7218  59.5415    110.174     16.4296     290.174     
1 1 1 25 1  52 o 18 99.7875 2.92678 190.347     15.0145  165.766     14.1869  46.1817    333.795     38.6346     153.795     
1 1 1 25 1  53 o 5  150.826 2.74082 398.802     20.6886  412.703     20.7059  131.863    302.819     64.0211     302.819     
1 1 1 25 1  54 o 3  79.9018 3.17724 115.92      13.0552  112.989     12.2831  38.1188    119.871     27.5914     299.871     
1 1 1 25 1  55 o 1  24.4719 5.5689  5.27061     7.75831  15.4691     8.44142  10.9233    168.2       47.8168     168.2       
1 1 1 25 1  56 o 8  36.2516 4.82714 24.8275     8.57122  24.3115     8.32468  18.1658    154.8       3.33232     154.8       
1 1 1 25 1  57 o 10 17.6293 4.96837 7.39886     7.31086  -5.33897    7.19556  8.40117    8.84262     30.2278     8.84262     
1 1 1 25 1  58 f 0  77.716  3.06739 102.1       12.2254  115.255     11.4758  58.868     125.87      0           0           
1 1 1 25 1  59 o 1  95.2712 2.99973 158.047     14.5525  168.194     13.984   70.9513    132.536     17.8944     132.536     
1 1 1 25 1  60 o 18 16.8949 5.11487 2.03247     7.40665  -2.59797    8.24639  2.18675    295.246     10.6853     295.246     
1 1 1 25 1  61 o 10 98.5076 2.88829 175.606     14.5933  173.262     13.8561  73.8362    274.52      19.852      274.52      
1 1 1 25 1  62 o 8  124.854 2.74379 279.973     17.5373  279.729     16.7473  97.8103    342.485     32.8531     342.485     
1 1 1 25 1  63 o 9  48.3036 4.23373 47.3608     10.5241  39.1867     9.53298  23.2501    27.9526     13.1625     207.953     
1 1 1 25 1  64 o 16 49.6015 4.01566 47.5444     10.0128  43.2589     9.58933  21.6497    43.7651     18.4057     223.765     
1 1 1 25 1  65 o 3  79.7786 3.07242 110.204     12.4352  120.115     11.9959  52.391     239.546     2.8507      239.546     
1 1 1 25 1  66 f 0  97.426  2.96349 166.114     14.6028  177.011     14.241   47.4407    232.36      0           0           
1 1 1 25 1  67 o 14 26.2807 6.07823 14.1362     9.90604  12.1024     8.53124  11.3645    170.438     2.18627     350.438     
1 1 1 25 1  68 o 4  16.8906 5.12606 0.912901    7.86137  -0.0457206  7.712    1.10013    232.828     5.52235     52.8278     
1 1 1 25 1  69 o 1  41.7908 5.2125  36.8977     12.1204  31.2536     8.86567  17.8704    163.504     15.2326     343.504     
1 1 1 25 1  70 o 3  46.2042 5.64022 31.4075     12.9852  54.0893     11.3192  27.4554    294.248     0.949664    114.248     
1 1 1 25 1  71 o 5  85.7204 3.96708 131.576     18.7481  142.817     14.5928  53.2615    301.34      1.38845     121.34      
1 1 1 25 1  72 o 1  27.5144 6.76733 7.45864     15.21    18.6252     9.76899  11.6585    200.749     3.80235     20.7489     
1 1 1 25 1  73 o 14 27.9161 7.02623 14.4299     11.9416  16.5883     12.8001  9.45859    279.063     3.14086     279.063     
1 1 1 25 1  74 f 0  22.394  6.51915 4.79599     11.3464  7.26873     12.238   11.9984    279.637     0           0           
1 1 1 25 1  75 o 18 24.0704 6.60812 9.23348     11.8381  9.87963     11.0009  7.70923    201.689     4.85831     21.689      
1 1 1 25 1  76 o 3  19.3104 5.88426 0.475464    10.3199  2.44442     10.3755  3.51337    268.799     3.38608     88.7995     
1 1 1 25 1  77 o 6  19.2027 5.90931 0.866173    10.7636  0.967312    10.5043  3.41817    330.566     2.55446     150.566     
1 1 1 25 1  78 o 13 20.2552 6.15965 -1.18213    12.187   5.19675     10.7362  3.816      156.16      1.38897     336.16      
1 1 1 25 1  79 o 12 39.5297 7.12639 31.8423     14.8729  38.5063     13.6348  27.7701    242         17.5105     242         
1 1 1 25 1  80 o 2  18.82   6.07875 4.48527     11.6267  -28.9323    17.8779  0.297881   296.998     0.630981    116.998     
1 1 1 25 1  81 o 10 31.6937 7.45015 31.6971     14.2839  16.098      14.6231  10.9078    166.386     4.95116     166.386     
1 1 1 25 1  82 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 2  0  o 16 111.856 2.54758 222.443     14.247   222.443     14.247   77.438     2.04963e-05 3.07425     2.04963e-05 
1 1 1 25 2  1  o 17 162.49  2.53076 471.828     19.7264  464.405     21.4395  84.04      240.436     56.9505     60.4356     
1 1 1 25 2  2  o 7  53.1399 2.95948 50.905      7.1724   49.8713     8.3956   19.4065    130.322     80.18       130.322     
1 1 1 25 2  3  o 14 152.322 2.66384 431.815     20.3095  391.722     20.3049  96.299     323.768     13.4651     143.768     
1 1 1 25 2  4  o 17 292.31  3.36513 1535.61     49.2841  1495.82     49.3     224.542    221.246     29.0252     221.246     
1 1 1 25 2  5  f 0  361.778 3.70413 2342.41     65.6804  2302.12     68.5724  203.437    343.916     0           0           
1 1 1 25 2  6  o 14 143.328 2.60355 373.035     17.7018  355.805     19.579   55.7529    14.0617     85.9763     194.062     
1 1 1 25 2  7  o 3  138.055 2.56044 342.532     17.3061  333.797     18.0715  79.2565    353.286     26.9044     173.286     
1 1 1 25 2  8  o 16 144.844 2.70957 372.164     19.643   372.36      19.6585  100.145    37.9398     6.95402     37.9399     
1 1 1 25 2  9  o 9  108.387 2.7679  217.177     14.5333  200.17      15.4172  43.701     73.8141     53.3517     253.814     
1 1 1 25 2  10 o 1  316.33  3.92598 1791.18     58.6989  1760.59     65.524   173.797    96.3217     110.641     276.322     
1 1 1 25 2  11 o 16 141.715 2.86262 367.245     19.2119  345.795     21.2765  40.6515    148.194     116.397     328.194     
1 1 1 25 2  12 o 11 437.732 4.78958 3418.98     96.393   3388.02     112.999  298.352    204.853     40.0881     24.8532     
1 1 1 25 2  13 o 17 104.148 2.90614 193.534     14.3052  191.794     15.9192  69.9382    273.231     18.3003     273.231     
1 1 1 25 2  14 o 12 395.649 4.44274 2803.66     80.802   2756        94.6972  303.561    236.65      33.4131     236.65      
1 1 1 25 2  15 o 3  234.397 3.06269 977.855     32.5297  971.208     39.0982  111.196    356.279     114.202     176.279     
1 1 1 25 2  16 f 0  189.137 2.66967 645.668     25.2494  623.151     25.3514  138.226    103.725     0           0           
1 1 1 25 2  17 o 12 166.066 2.49636 504.755     20.2635  473.487     21.2292  48.5916    161.826     137.82      341.826     
1 1 1 25 2  18 o 5  242.089 3.01795 1026.18     36.6843  1053.04     36.537   191.829    99.6311     39.726      99.631      
1 1 1 25 2  19 o 1  153.242 2.5663  427.3       18.7893  405.934     20.5164  102.02     351.901     6.3599      171.901     
1 1 1 25 2  20 o 18 218.337 2.82121 833.65      28.2642  857.436     33.3316  151.261    80.1087     6.41593     260.109     
1 1 1 25 2  21 o 14 167.244 2.52273 502.566     19.2965  489.467     22.7962  80.0134    252.917     74.0752     72.9174     
1 1 1 25 2  22 o 15 501.424 4.6186  4486.19     108.854  4449.06     122.78   357.884    278.277     8.10611     98.2775     
1 1 1 25 2  23 o 3  277.381 3.21201 1374.59     41.6231  1355.77     47.4428  170.65     10.887      54.6674     190.887     
1 1 1 25 2  24 o 10 138.803 2.44929 342.885     16.0122  340.656     17.9812  36.6387    32.4923     118.838     212.492     
1 1 1 25 2  25 o 1  123.466 2.38285 275.087     14.1662  265.982     15.2517  87.4576    246.546     16.3832     246.546     
1 1 1 25 2  26 o 18 121.508 2.41043 268.25      14.3133  255.865     14.9832  59.747     34.7947     45.8786     34.7947     
1 1 1 25 2  27 o 6  40.9775 3.53164 30.2243     6.8405   30.2684     7.35373  15.8265    38.9805     56.1112     38.9805     
1 1 1 25 2  28 o 17 103.964 2.45617 202.124     12.3018  181.936     13.1676  49.4321    325.393     34.2558     145.393     
1 1 1 25 2  29 o 5  218.454 2.75118 857.963     29.5429  835.217     30.6652  183.325    247.812     63.6771     247.812     
1 1 1 25 2  30 o 13 224.108 2.91029 872.584     32.7145  909.787     32.6439  148.872    301.151     15.9839     121.151     
1 1 1 25 2  31 o 3  137.55  2.60736 334.299     17.1333  337.39      18.7507  105.761    182.445     31.9875     182.445     
1 1 1 25 2  32 o 5  334.762 3.36713 2001.82     55.3769  1977.01     57.5623  216.266    94.4175     41.3815     274.417     
1 1 1 25 2  33 o 18 140.553 2.49142 334.282     16.8774  367.137     18.2148  116.167    351.853     50.0645     351.853     
1 1 1 25 2  34 o 6  411.683 3.9587  3006.02     81.7359  3017.14     81.6089  273.277    35.7549     36.201      215.755     
1 1 1 25 2  35 o 12 176.823 2.59688 531.326     23.4118  578.588     22.5345  114.485    175.073     13.9412     355.073     
1 1 1 25 2  36 o 17 111.024 2.55498 219.581     14.4183  218.269     13.9726  32.5879    157.853     83.6142     337.853     
1 1 1 25 2  37 o 7  84.89   2.68605 131.555     11.296   124.775     11.4878  50.1282    174.043     0.346644    174.043     
1 1 1 25 2  38 o 7  330.67  3.38719 1937.62     56.1165  1947.83     56.1432  250.419    168.989     37.4514     168.989     
1 1 1 25 2  39 o 10 106.84  2.74301 208.584     15.3577  197.312     13.9638  0.753613   77.0727     144.019     257.073     
1 1 1 25 2  40 o 16 179.408 2.67042 566.404     23.404   576.477     24.609   151.006    301.382     56.7593     301.382     
1 1 1 25 2  41 o 9  75.4515 2.93896 95.5653     10.7056  107.487     11.4361  36.2932    167.708     21.4485     347.708     
1 1 1 25 2  42 o 19 62.197  3.34144 65.4749     10.0831  73.0107     10.5889  23.8885    177.484     25.4123     357.484     
1 1 1 25 2  43 o 7  111.578 2.60776 207.552     14.1485  235.631     14.9711  32.819     315.955     85.1944     135.955     
1 1 1 25 2  44 o 17 32.2159 5.01453 20.8978     7.715    17.6891     8.04756  14.5163    88.0399     57.9521     88.0399     
1 1 1 25 2  45 o 7  48.6379 3.91045 41.7568     9.21571  43.7033     9.50996  16.2982    336.188     12.3228     156.188     
1 1 1 25 2  46 o 4  152.055 2.52914 397.926     19.1652  424.081     19.3707  102.398    233.551     1.2365      53.5515     
1 1 1 25 2  47 o 9  90.752  2.74    152.189     12.3261  141.435     12.5183  61.6164    358.971     6.49881     358.971     
1 1 1 25 2  48 o 11 169.803 2.59775 507.665     22.0193  518.082     22.1918  141.13     294.5       53.0828     294.5       
1 1 1 25 2  49 o 12 113.415 2.62435 224.113     14.8178  234.241     14.9714  79.5975    247.289     9.48776     247.289     
1 1 1 25 2  50 o 15 156.911 2.6551  428.185     20.8671  448.703     20.8813  117.225    241.85      23.735      241.85      
1 1 1 25 2  51 o 8  85.7078 2.79395 126.827     11.8569  135.624     12.0755  67.3927    244.911     29.0614     244.911     
1 1 1 25 2  52 o 6  51.1617 3.74804 51.7226     9.76154  43.237      9.16164  27.4221    287.941     0.0355055   287.94      
1 1 1 25 2  53 o 7  125.695 2.69818 286.314     17.3806  277.641     16.5718  98.7215    190.288     30.6026     190.288     
1 1 1 25 2  54 o 10 149.963 2.68184 408.478     20.6171  394.428     19.6607  115.313    296.539     29.6678     296.539     
1 1 1 25 2  55 o 14 102.258 2.69104 183.973     13.6862  189.884     13.8461  74.7951    155.829     14.3913     155.829     
1 1 1 25 2  56 o 6  24.3356 5.61752 11.7928     7.33755  9.0192      8.5817   1.57027    18.7044     27.0716     18.7044     
1 1 1 25 2  57 o 16 76.2801 3.24277 106.132     12.0842  103.486     12.5797  65.2612    25.216      33.5788     25.216      
1 1 1 25 2  58 o 14 72.6082 3.32063 91.0588     11.6571  99.4002     12.3824  48.4203    325.428     3.26629     325.428     
1 1 1 25 2  59 o 1  104.771 2.93407 194.628     15.9652  199.871     14.739   93.5299    231.662     50.8181     231.662     
1 1 1 25 2  60 o 11 23.245  5.72337 10.2387     7.90648  8.07328     8.52144  1.31982    8.26132     25.9882     8.26132     
1 1 1 25 2  61 o 9  21.9342 5.63778 9.79372     8.12614  5.18367     8.09464  2.59198    95.7987     7.75263     275.799     
1 1 1 25 2  62 o 13 78.9648 3.21392 119.383     12.0511  106.33      13.1472  52.9779    113.277     4.36879     113.277     
1 1 1 25 2  63 o 16 46.4153 4.60073 37.4752     10.5944  43.1884     10.1201  28.3652    109.491     0.634596    109.491     
1 1 1 25 2  64 o 2  48.7731 4.32404 42.6638     9.67192  45.8496     10.9928  27.1183    345.813     6.04229     165.813     
1 1 1 25 2  65 o 7  89.9604 3.06321 145.745     13.7018  147.188     13.8368  75.1478    36.6186     35.2249     36.6186     
1 1 1 25 2  66 o 6  20.6282 5.5785  9.57248     8.2109   1.02506     8.56423  0.512225   208.567     20.1069     28.5668     
1 1 1 25 2  67 o 18 39.2084 5.04824 26.7543     9.7881   32.7383     9.23845  28.305     321.55      12.0827     321.55      
1 1 1 25 2  68 o 4  66.171  3.42176 77.5133     11.4534  83.4241     11.0484  40.832     37.3263     1.93087     217.326     
1 1 1 25 2  69 o 16 98.1147 3.36545 184.326     18.702   169.135     14.1146  75.633     30.845      26.5267     30.845      
1 1 1 25 2  70 o 18 16.8096 5.30572 1.30135     9.79941  -6.03415    8.5186   0.882146   133.879     8.14369     313.879     
1 1 1 25 2  71 o 10 25.2422 6.78473 16.2386     14.0399  6.83696     9.65042  3.39607    297.557     1.09529     297.557     
1 1 1 25 2  72 o 5  42.5498 6.71629 44.7023     17.2426  32.1198     10.7116  31.1314    48.9052     15.9633     48.9052     
1 1 1 25 2  73 o 9  44.8924 6.35694 37.5528     15.0942  45.971      12.3243  21.8945    128.67      9.44093     308.67      
1 1 1 25 2  74 o 19 31.1485 7.12944 26.5158     14.2312  15.3386     11.3483  14.2431    75.4037     4.26737     255.404     
1 1 1 25 2  75 o 16 28.1913 6.76704 16.6376     11.437   15.8419     11.3771  12.5661    9.59709     3.73235     189.597     
1 1 1 25 2  76 o 12 38.9819 6.40514 28.3454     12.3025  35.703      12.315   28.0709    244.474     13.9354     244.474     
1 1 1 25 2  77 o 7  59.7491 5.18752 82.6612     14.9118  59.6357     15.0112  45.9134    4.25482     20.5008     4.25482     
1 1 1 25 2  78 o 17 45.8621 6.11701 43.8529     13.2069  44.6362     13.8769  36.0684    42.3175     21.6012     42.3175     
1 1 1 25 2  79 o 8  22.3685 6.58156 6.84005     12.1299  7.12847     12.2612  5.5247     125.83      3.63013     305.83      
1 1 1 25 2  80 o 8  34.8555 7.63491 36.2699     15.0416  23.0945     15.0763  18.9939    334.09      4.46438     334.09      
1 1 1 25 2  81 o 3  16.9769 5.63445 -4.14175    11.3636  -10.9031    13.1863  0.343642   87.8098     3.83982     87.8098     
1 1 1 25 2  82 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 3  0  o 3  84.0179 2.56498 125.814     10.7539  125.814     10.7539  38.1125    180         6.67506     180         
1 1 1 25 3  1  o 10 393.019 3.99572 2709.35     80.3552  2773.97     76.9575  283.015    50.0922     7.19968     230.092     
1 1 1 25 3  2  o 15 94.3279 2.55782 157.767     12.0179  158.223     12.1196  2.44405    53.4085     131.335     53.4084     
1 1 1 25 3  3  o 19 87.5544 2.68526 143.757     11.9682  128.818     11.533   25.2861    152.118     58.3809     332.118     
1 1 1 25 3  4  o 5  300.683 3.75142 1648.47     54.9447  1560.88     57.9572  250.096    70.1386     65.9013     70.1386     
1 1 1 25 3  5  o 5  290.066 3.56733 1492.41     51.8431  1493.32     51.8693  201.505    198.02      16.9674     18.0202     
1 1 1 25 3  6  o 2  179.507 3.15023 569.721     26.5819  573.793     29.9774  111.811    88.377      30.1379     268.377     
1 1 1 25 3  7  o 13 143.201 3.23853 365.477     20.8498  362.8       25.3342  97.5534    171.641     0.798553    351.641     
1 1 1 25 3  8  o 3  334.041 4.28286 1962.69     67.1635  1999.77     76.0303  209.56     12.0179     66.8631     192.018     
1 1 1 25 3  9  o 8  110.864 2.94888 216.883     15.566   219.71      17.1148  2.23134    263.333     149.325     83.3325     
1 1 1 25 3  10 o 8  131.997 2.91001 309.267     18.8977  309.351     19.5487  66.6446    200.829     48.5281     20.8295     
1 1 1 25 3  11 o 3  392.068 4.09419 2717.29     80.4821  2740.72     80.403   276.273    286.423     18.1175     106.423     
1 1 1 25 3  12 o 4  389.385 3.94368 2719.15     75.2707  2663.9      78.5655  304.609    344.07      43.4359     344.07      
1 1 1 25 3  13 o 18 237.971 3.16216 1024.06     38.5739  985.325     36.851   211.883    284.764     85.8543     284.764     
1 1 1 25 3  14 o 9  41.1611 3.69144 26.9905     7.29701  34.3355     7.51642  27.8853    10.1946     90.2061     10.1946     
1 1 1 25 3  15 o 7  189.856 2.75214 658.692     25.5197  620.119     26.7796  160.648    191.18      56.7323     191.18      
1 1 1 25 3  16 o 8  246.073 2.99494 1073.53     36.8516  1074.66     37.0141  171.639    265.645     8.91535     85.6454     
1 1 1 25 3  17 o 15 103.311 2.42493 196.36      12.1966  182.687     12.834   9.37037    10.4596     121.503     190.46      
1 1 1 25 3  18 o 19 88.4175 2.5868  137.142     11.2244  140.616     11.6501  30.8367    272.217     48.8803     92.2175     
1 1 1 25 3  19 o 5  209.664 2.82836 782.553     29.6166  776.876     29.818   158.866    322.925     22.139      322.925     
1 1 1 25 3  20 o 14 221.411 2.79424 887.782     29.6089  851.451     32.2762  218.428    3.57985     130.115     3.57985     
1 1 1 25 3  21 f 0  98.8759 2.52499 173.328     12.1252  173.873     12.8472  83.145     298.465     0           0           
1 1 1 25 3  22 f 0  185.08  2.54855 630.073     23.0709  585.317     24.1302  69.2201    97.378      0           0           
1 1 1 25 3  23 o 3  262.745 2.92682 1215.35     37.6843  1234.08     39.3845  191.185    120.603     8.50123     120.603     
1 1 1 25 3  24 o 8  236.808 2.71558 990.62      32.1617  998.768     32.2922  191.602    216.576     49.4531     216.576     
1 1 1 25 3  25 o 8  127.087 2.45088 291.852     15.4939  281.479     15.6876  103.205    90.6082     71.6244     90.6082     
1 1 1 25 3  26 o 2  174.298 2.54123 544.743     21.7827  532.916     22.5931  150.638    118.144     65.0067     118.144     
1 1 1 25 3  27 o 8  143.648 2.47281 373.588     17.485   358.648     18.0794  103.828    275.668     15.4687     275.668     
1 1 1 25 3  28 o 5  150.975 2.50612 408.036     18.6303  400.517     19.2793  89.5699    141.323     27.3023     321.323     
1 1 1 25 3  29 o 10 101.6   2.51011 180.68      12.7345  185.958     12.7859  69.0955    86.8243     21.8098     86.8243     
1 1 1 25 3  30 o 13 206.995 2.79637 755.548     28.4945  764.817     29.5175  130.927    208.794     27.7892     28.7945     
1 1 1 25 3  31 o 15 32.7826 4.71378 18.3591     7.0212   21.3088     7.94847  37.2194    335.004     99.3975     335.004     
1 1 1 25 3  32 o 1  196.75  2.60245 691.368     25.1878  682.114     26.1167  193.087    254.171     120.443     254.171     
1 1 1 25 3  33 o 2  102.589 2.64073 185.341     13.407   188.611     13.7008  43.2884    148.854     47.5095     328.854     
1 1 1 25 3  34 f 0  186.115 2.65532 622.593     23.7765  606.699     25.6906  77.6514    298.493     0           0           
1 1 1 25 3  35 o 13 158.636 2.6286  440.018     20.4337  453.153     21.3605  71.0717    286.361     77.2646     106.361     
1 1 1 25 3  36 o 10 207.344 2.67687 749.086     27.2856  777.099     28.3469  147.495    64.1091     6.57068     64.1091     
1 1 1 25 3  37 o 9  46.7289 3.57452 37.4129     7.93122  41.1588     8.54789  5.79853    34.5415     10.9567     214.542     
1 1 1 25 3  38 o 2  105.818 2.50247 202.223     12.7549  195.712     13.7124  74.2329    56.0324     61.0916     56.0324     
1 1 1 25 3  39 o 9  79.1308 2.70534 111.265     10.3401  111.619     11.0419  56.2313    302.313     25.5547     302.313     
1 1 1 25 3  40 o 18 70.4898 2.91538 89.3004     9.87549  87.8616     10.6111  38.0713    69.7185     8.07851     249.719     
1 1 1 25 3  41 o 7  93.2376 2.5935  151.149     11.7248  158.151     12.465   52.1798    359.158     17.7022     179.158     
1 1 1 25 3  42 o 11 97.3775 2.69215 167.138     12.4052  170.323     13.7941  64.0058    306.417     1.02685     306.417     
1 1 1 25 3  43 o 16 150.067 2.62777 402.472     18.7602  398.108     20.6862  123.804    226.204     44.7813     226.204     
1 1 1 25 3  44 o 4  229.385 2.87021 898.381     33.5318  973.872     32.3582  210.759    54.6007     106.466     54.6007     
1 1 1 25 3  45 o 13 140.241 2.59423 357.434     17.3282  342.18      19.0313  115.631    188.328     42.8962     188.328     
1 1 1 25 3  46 o 2  113.413 2.63077 218.042     15.0862  240.224     14.7309  69.1166    61.6794     13.5972     241.679     
1 1 1 25 3  47 o 3  103.279 2.58734 193.321     12.9937  186.677     13.7204  76.1656    102.69      17.0211     102.69      
1 1 1 25 3  48 o 9  71.8135 2.93553 98.4143     10.1223  86.179      10.8182  50.6747    311.208     34.1543     311.208     
1 1 1 25 3  49 o 1  43.3892 3.98639 30.1544     7.94307  38.6757     8.97689  6.28245    168.753     35.379      348.753     
1 1 1 25 3  50 o 9  28.3816 5.22966 12.01       7.21076  18.3299     7.93952  1.2989     225.984     12.53       225.984     
1 1 1 25 3  51 o 11 66.8874 3.22021 89.6613     10.621   71.4621     10.7132  47.1254    53.3903     13.5289     53.3903     
1 1 1 25 3  52 o 7  247.964 3.05106 1082.22     37.9107  1114.77     37.9109  173.207    114.661     9.34587     114.661     
1 1 1 25 3  53 o 2  108.651 2.81743 208.731     15.2744  213.362     15.3545  79.5881    322.009     14.333      322.009     
1 1 1 25 3  54 o 16 152.853 2.70766 427.61      20.9832  407.139     20.4817  115.629    132.137     25.743      132.137     
1 1 1 25 3  55 o 11 53.7636 3.87752 55.3801     10.6976  49.9247     9.90969  35.0952    12.0251     3.38517     12.0251     
1 1 1 25 3  56 o 17 39.3419 4.69781 34.4788     8.87148  23.7537     8.8282   17.2804    197.82      12.0289     17.8199     
1 1 1 25 3  57 o 4  37.5233 4.89863 32.6421     8.82228  20.9023     8.79755  20.5297    275.012     0.0234662   95.0115     
1 1 1 25 3  58 o 10 20.96   5.42798 10.1997     7.72554  2.07432     7.79957  1.07141    84.3685     7.61166     264.369     
1 1 1 25 3  59 o 3  27.1033 6.01259 10.6864     7.89914  17.1463     10.3444  2.45415    326.481     0.0777802   326.481     
1 1 1 25 3  60 o 16 68.6814 3.57837 85.9177     10.5453  85.6274     13.6727  52.7292    105.552     18.1722     105.552     
1 1 1 25 3  61 o 11 47.5905 4.38336 39.4133     8.8684   44.8128     11.4885  33.7984    299.688     10.8599     299.688     
1 1 1 25 3  62 o 15 67.4759 3.39866 91.392      10.5067  74.483      11.9976  47.1826    0.298957    8.47907     0.298957    
1 1 1 25 3  63 o 16 48.2725 4.27815 50.3824     10.0943  36.7608     9.92907  25.0375    50.1061     10.0321     230.106     
1 1 1 25 3  64 o 1  85.2848 3.30481 138.473     13.9044  125.931     14.194   72.3042    215.794     35.4031     215.794     
1 1 1 25 3  65 o 11 46.455  4.79223 43.4592     10.4693  38.4475     11.0881  22.7891    246.516     12.3713     66.5156     
1 1 1 25 3  66 o 4  20.3602 5.55735 -2.05789    8.45261  10.8477     8.81268  4.31698    273.811     8.71397     93.8109     
1 1 1 25 3  67 o 18 47.2243 4.62208 41.1323     11.2492  43.7727     9.9129   20.5375    187.287     17.9248     7.28682     
1 1 1 25 3  68 o 8  37.5041 5.57477 38.4908     11.4924  19.0094     9.03456  23.3143    216.898     2.91551     216.898     
1 1 1 25 3  69 o 3  49.473  5.15706 39.6053     12.8476  56.3645     11.1476  40.3944    181.924     22.3785     181.924     
1 1 1 25 3  70 f 0  23.6992 6.03718 0.804869    11.1169  15.5747     9.18503  15.4104    34.6669     0           0           
1 1 1 25 3  71 o 15 30.9639 6.71558 28.769      13.5368  12.4976     9.74151  11.0466    178.548     12.6006     358.548     
1 1 1 25 3  72 o 6  67.2391 4.53496 83.399      16.6352  89.6699     13.0371  54.5098    287.214     27.1581     287.214     
1 1 1 25 3  73 o 17 45.2662 6.29326 51.4786     15.1781  34.232      12.4441  27.2426    263.968     1.27849     263.968     
1 1 1 25 3  74 o 12 20.6495 6.25604 -1.61701    12.8002  5.35597     10.7644  0.265904   322.209     21.5743     322.21      
1 1 1 25 3  75 o 3  21.071  6.39561 2.3217      13.1049  3.32156     11.1605  5.99589    199.418     5.01526     19.4176     
1 1 1 25 3  76 o 3  20.8099 6.38821 3.92885     13.1858  0.586561    11.5015  4.50922    182.941     9.92139     2.94137     
1 1 1 25 3  77 o 17 20.1523 6.09253 2.0004      10.6044  4.25102     11.2381  4.89939    283.195     4.43788     103.195     
1 1 1 25 3  78 f 0  22.2519 6.54278 2.23809     12.0324  10.5347     12.3794  6.79731    301.037     0           0           
1 1 1 25 3  79 o 17 30.1412 7.21936 18.9322     13.2799  23.4764     12.8462  13.4949    244.72      1.49699     64.7204     
1 1 1 25 3  80 o 14 23.7781 6.81473 13.5462     12.2815  6.19948     13.4944  3.29409    278.93      1.42243     98.9302     
1 1 1 25 3  81 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 4  0  o 18 134.922 2.56751 323.367     17.3318  323.367     17.3318  58.9577    180         80.9058     8.7003e-06  
1 1 1 25 4  1  o 8  274.899 3.24266 1329.24     44.6674  1352.08     44.6741  193.086    281.874     12.3861     101.874     
1 1 1 25 4  2  o 7  250.954 3.20649 1114.65     41.3436  1119.82     39.2767  159.737    253.113     43.6967     73.1135     
1 1 1 25 4  3  o 11 350.77  3.77915 2177.74     64.862   2189.85     67.9734  280.992    76.4576     51.0308     76.4576     
1 1 1 25 4  4  o 18 539.492 5.33728 5159.45     140.857  5190.03     147.681  447.397    201.951     104.028     201.951     
1 1 1 25 4  5  o 13 62.3053 2.99832 73.7962     9.03536  64.7034     9.5047   13.81      101.811     102.215     101.811     
1 1 1 25 4  6  o 12 138.842 2.6571  335.65      18.8701  348.605     18.0415  27.9164    343.56      140.49      163.56      
1 1 1 25 4  7  o 7  256.909 3.23842 1159.65     38.6051  1182.3      44.6199  195.757    239.092     21.1524     239.092     
1 1 1 25 4  8  o 6  169.017 2.7567  519.094     21.0662  494.637     25.3024  127.479    237.011     18.958      237.011     
1 1 1 25 4  9  o 18 187.913 2.7084  633.296     23.7013  619.193     27.1507  143.13     12.5611     21.134      12.5611     
1 1 1 25 4  10 o 6  126.95  2.45164 288.239     14.8041  283.733     16.3117  79.943     185.389     11.3612     5.38943     
1 1 1 25 4  11 o 16 347.036 3.53366 2128.01     58.8173  2146.57     64.005   270.961    116.939     37.9902     116.939     
1 1 1 25 4  12 o 4  366.401 3.71644 2356.96     65.3385  2409.01     71.0784  246.968    282.392     39.1705     102.392     
1 1 1 25 4  13 o 4  335.42  3.6268  2008.14     59.6135  1985.61     62.2688  219.95     57.0373     47.0482     237.037     
1 1 1 25 4  14 o 9  142.343 2.49421 359.711     17.0387  359.114     18.4977  54.1327    33.4741     90.9111     213.474     
1 1 1 25 4  15 o 14 243.432 2.85386 1039.08     34.1632  1063.24     35.4668  169.017    218.841     10.9494     38.8415     
1 1 1 25 4  16 o 6  384.293 3.89658 2628.42     73.386   2615.85     76.6547  289.941    91.6219     22.6081     91.6219     
1 1 1 25 4  17 f 0  202.59  2.7933  712.198     29.4771  743.957     27.1313  128.924    51.3624     0           0           
1 1 1 25 4  18 o 2  112.501 2.57945 216.971     14.9684  232.554     14.0155  57.6497    176.733     33.5626     356.733     
1 1 1 25 4  19 o 2  92.2336 2.72466 153.878     12.3301  148.453     12.7864  34.5393    356.33      48.0558     176.33      
1 1 1 25 4  20 o 3  468.442 4.44171 3867.18     95.163   3931.74     112.769  325.348    32.1515     28.2929     212.151     
1 1 1 25 4  21 o 19 130.84  2.54308 306.058     15.0639  301.448     18.0988  80.0153    45.762      16.2691     225.762     
1 1 1 25 4  22 o 15 77.9432 2.71752 110.631     9.7189   105.446     11.3359  9.49241    108.676     78.0104     288.676     
1 1 1 25 4  23 o 11 199.14  2.72852 687         24.7306  720.112     29.6127  134.151    165.188     11.9146     345.188     
1 1 1 25 4  24 f 0  43.1148 3.93242 42.1965     7.34303  25.9375     8.4583   22.0519    96.5217     0           0           
1 1 1 25 4  25 o 1  251.236 2.92066 1122.23     34.3332  1117.58     39.0496  194.932    191.044     33.9641     191.044     
1 1 1 25 4  26 o 15 344.403 3.49667 2102.51     56.5096  2109.19     63.9706  289.947    252.38      87.954      252.38      
1 1 1 25 4  27 o 4  200.879 2.67097 690.539     25.5425  741.575     28.2371  156.485    355.37      32.8196     355.37      
1 1 1 25 4  28 o 10 119.768 2.59752 262.714     14.6016  246.791     16.4193  97.1832    134.362     48.5382     134.362     
1 1 1 25 4  29 o 2  126.006 2.5972  275.628     15.4486  288.246     17.3001  82.3392    118.107     2.66892     298.108     
1 1 1 25 4  30 o 2  130.62  2.63946 302.385     15.1261  303.492     19.1607  101.633    341.234     32.4228     341.234     
1 1 1 25 4  31 o 9  84.6953 3.06306 130.481     10.9044  124.873     14.6383  45.2101    293.99      19.4973     293.99      
1 1 1 25 4  32 o 12 115.569 2.70843 237.213     14.2011  237.316     17.0006  96.3774    105.038     65.3711     105.038     
1 1 1 25 4  33 o 10 100.523 2.5853  173.407     12.2045  185.78      13.794   47.4614    304.046     37.2846     124.046     
1 1 1 25 4  34 o 11 27.6482 5.28682 14.6517     7.09403  13.4579     7.93858  17.5943    190.344     48.1057     190.344     
1 1 1 25 4  35 o 11 64.8442 3.23935 70.9289     9.2512   79.3224     11.6356  24.9668    160.343     24.2645     340.343     
1 1 1 25 4  36 o 19 55.6951 3.36369 58.1892     8.68951  52.9274     9.79361  17.5113    216.884     24.2595     36.8844     
1 1 1 25 4  37 o 19 177.779 2.64615 544.155     22.11    578.352     25.0224  118.518    223.404     10.0461     43.4038     
1 1 1 25 4  38 o 9  154.924 2.61686 424.171     19.0693  428.463     21.4852  107.123    84.6581     0.944363    84.6582     
1 1 1 25 4  39 o 7  166.853 2.51267 477.635     19.7843  511.341     22.2296  149.339    230.47      70.8477     230.47      
1 1 1 25 4  40 o 14 220.584 2.79899 865.314     29.056   863.92      32.7136  146.78     282.721     13.7597     102.721     
1 1 1 25 4  41 o 16 165.96  2.6154  494.034     20.8537  484.675     22.597   131.275    103.691     35.0043     103.691     
1 1 1 25 4  42 o 18 168.066 2.54733 500.371     20.157   503.41      22.6849  136.936    113.715     43.7856     113.715     
1 1 1 25 4  43 o 15 148.282 2.55139 387.634     17.797   394.205     20.054   87.7348    93.3192     27.7487     273.319     
1 1 1 25 4  44 o 5  15.6337 4.82167 0.0089539   6.62529  -3.13317    7.70788  21.7409    299.625     50.1613     299.625     
1 1 1 25 4  45 o 3  79.0787 2.99292 105.865     10.8024  117.651     12.827   45.5295    357.403     10.8048     177.403     
1 1 1 25 4  46 o 16 20.3976 5.33642 1.97104     7.04936  9.15389     7.81481  12.3606    75.6871     33.7653     75.6871     
1 1 1 25 4  47 o 9  15.5384 4.74698 1.59992     6.34178  -4.65133    7.59297  12.7348    76.7303     29.9131     76.7303     
1 1 1 25 4  48 o 16 76.9479 2.92764 102.463     10.6028  109.342     11.8885  43.2301    121.626     11.9395     301.626     
1 1 1 25 4  49 o 1  104.839 2.73917 189.818     13.6467  202.602     15.0857  71.8322    104.155     4.98479     104.155     
1 1 1 25 4  50 o 10 82.8602 2.84504 110.993     11.1299  135.135     12.4337  64.3314    236.714     22.7237     236.714     
1 1 1 25 4  51 o 17 67.7355 3.29501 82.1636     10.6865  82.7904     11.5325  45.8777    223.177     5.44293     223.177     
1 1 1 25 4  52 o 11 192.415 2.90173 679.033     26.726   644.107     29.104   153.453    344.911     45.5472     344.911     
1 1 1 25 4  53 o 9  90.9136 3.10529 144.082     13.6567  152.616     14.558   68.0938    103.609     15.8053     103.609     
1 1 1 25 4  54 o 7  159.254 2.74494 441.82      21.4554  465.127     22.3619  126.953    289.52      39.4135     289.52      
1 1 1 25 4  55 o 10 66.1726 3.58639 73.0286     11.5795  85.8541     11.9928  33.3826    316.434     19.6329     136.434     
1 1 1 25 4  56 o 11 17.9473 5.29641 -0.0894929  7.49574  3.2404      8.40816  1.18045    124.254     8.28701     124.254     
1 1 1 25 4  57 o 18 90.0156 3.05593 146.632     13.0044  145.191     14.4373  71.826     137.979     25.8054     137.979     
1 1 1 25 4  58 o 9  81.8453 3.20017 130.143     12.1443  112.104     13.7599  66.1942    314.179     26.2474     314.179     
1 1 1 25 4  59 o 16 22.96   5.6138  2.27918     7.31741  15.2062     9.29877  3.315      295.662     3.70125     115.662     
1 1 1 25 4  60 o 5  67.2729 3.40443 84.1869     11.0304  80.2099     11.735   56.3356    30.9344     27.8352     30.9344     
1 1 1 25 4  61 o 8  84.3637 3.23795 133.394     12.8162  124.421     14.3408  72.3451    132.458     36.1511     132.458     
1 1 1 25 4  62 o 12 51.7259 4.55942 49.6838     10.1784  50.2312     12.7583  26.0422    205.35      13.2737     25.3496     
1 1 1 25 4  63 o 5  19.0895 5.47671 -11.5587    7.60967  12.0304     10.7464  1.10227    204.119     1.81189     24.1187     
1 1 1 25 4  64 o 16 34.3865 6.03878 23.8494     10.7125  23.1904     10.0076  14.4065    150.694     12.2756     330.694     
1 1 1 25 4  65 f 0  22.7857 5.80966 10.6459     8.00496  6.55755     9.2519   24.1428    303.474     0           0           
1 1 1 25 4  66 o 17 35.3061 5.26267 27.4932     9.22875  21.6542     8.82516  22.7995    234.199     5.22861     234.199     
1 1 1 25 4  67 o 17 48.6981 4.26401 38.9001     10.228   51.1285     9.86617  35.2697    330.144     10.8842     330.144     
1 1 1 25 4  68 o 6  44.5511 4.95951 36.8751     11.6478  40.3175     9.49388  23.8715    106.47      6.946       286.47      
1 1 1 25 4  69 o 17 34.494  6.22877 23.8881     11.4166  25.3638     10.2324  15.7447    33.8181     8.75913     213.818     
1 1 1 25 4  70 o 13 15.3523 5.13297 -11.3535    12.2438  -6.85796    8.36729  0.136349   117.659     3.5084      117.659     
1 1 1 25 4  71 o 18 26.4691 6.64592 4.59357     14.6452  18.2416     9.89309  10.4074    9.76184     2.05658     189.762     
1 1 1 25 4  72 o 6  50.0041 5.88659 43.4701     14.5285  58.2875     13.5452  34.4964    148.609     9.58545     148.609     
1 1 1 25 4  73 o 1  49.6981 5.8568  56.3709     14.9847  44.0593     13.1778  36.5724    94.2772     14.3504     94.2772     
1 1 1 25 4  74 o 18 18.6784 5.97367 -2.89147    13.1707  -2.87691    10.6706  0.469142   185.717     19.4204     185.717     
1 1 1 25 4  75 o 1  30.5357 7.17828 13.306      14.1854  25.8625     12.6815  17.0506    77.4551     2.88969     77.4551     
1 1 1 25 4  76 o 9  31.5773 7.14413 33.231      14.4621  10.9889     12.7077  9.31624    213.752     6.33096     213.752     
1 1 1 25 4  77 o 14 26.9066 7.17645 2.29273     16.7854  21.9036     12.7606  9.71391    274.861     7.63946     94.861      
1 1 1 25 4  78 o 17 40.9185 7.62913 38.4783     17.6004  42.0215     14.4469  23.1884    72.5818     0.809985    72.5816     
1 1 1 25 4  79 o 16 16.0435 5.35287 -5.17899    10.9322  -11.2928    11.6856  0.703998   219.501     5.59493     219.501     
1 1 1 25 4  80 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 5  0  o 7  266.534 3.29808 1260.75     44.0225  1260.75     44.0225  306.188    7.69039e-06 219.132     7.69039e-06 
1 1 1 25 5  1  o 3  47.6474 3.61627 41.186      8.28655  40.3263     8.70106  16.4262    287.786     75.6644     287.786     
1 1 1 25 5  2  o 13 94.7816 2.87786 164.284     13.5905  155.055     13.6735  34.2774    62.8049     55.2345     242.805     
1 1 1 25 5  3  o 17 264.89  3.18521 1272.66     39.3936  1217.39     44.8572  107.211    51.3148     171.467     231.315     
1 1 1 25 5  4  o 11 343.131 3.65315 2096.59     58.5826  2082.98     66.7591  212.834    30.1659     75.6965     210.166     
1 1 1 25 5  5  o 3  238.195 2.71471 1014.29     32.9879  998.245     31.8201  130.63     160.303     83.629      340.303     
1 1 1 25 5  6  o 10 152.262 2.37    413.556     18.3585  408.612     17.8087  88.825     280.354     35.7497     100.354     
1 1 1 25 5  7  o 2  233.788 2.80002 955.573     33.4216  983.399     32.1533  148.088    316.579     41.1344     136.579     
1 1 1 25 5  8  o 6  148.642 2.43333 386.668     18.0879  396.936     18.1628  126.766    71.4608     53.9708     71.4608     
1 1 1 25 5  9  o 17 242.63  2.81559 1048.41     35.4769  1039.98     32.957   181.2      254.995     13.3025     254.995     
1 1 1 25 5  10 o 6  432.784 4.00687 3327.23     90.1539  3324.84     83.5275  351.284    95.1812     70.6105     95.1812     
1 1 1 25 5  11 o 14 252.356 2.90168 1132.25     37.3541  1127.11     36.0296  175.677    90.5248     12.5245     270.525     
1 1 1 25 5  12 o 1  256.724 2.94925 1159.07     38.6027  1179.35     37.2589  156.451    193.111     58.0487     13.1108     
1 1 1 25 5  13 o 13 97.0647 2.6449  162.903     12.1536  171.848     13.5224  61.5199    263.768     11.8873     263.768     
1 1 1 25 5  14 o 3  136.271 2.50191 327.184     16.2593  331.707     17.8674  98.6965    64.2416     13.8782     64.2416     
1 1 1 25 5  15 o 10 212.261 2.77871 817.573     27.6594  781.016     31.2528  121.902    127.738     60.0463     307.738     
1 1 1 25 5  16 o 12 243.88  2.95877 1076.93     34.5818  1033.69     37.6044  170.16     230.754     9.53694     50.7539     
1 1 1 25 5  17 o 4  103.167 2.51651 190.527     12.4351  187.453     13.5149  70.9474    20.3453     21.2533     20.3453     
1 1 1 25 5  18 o 8  312.21  3.418   1705.65     52.3792  1754.86     54.5783  238.242    23.5779     26.165      23.5778     
1 1 1 25 5  19 o 3  265.709 3.0829  1259.17     41.9333  1246.39     40.1581  218.337    155.947     56.6617     155.947     
1 1 1 25 5  20 o 12 325.448 3.34477 1867.91     55.6062  1892.06     53.4604  232.04     211.704     5.33282     31.7042     
1 1 1 25 5  21 o 15 317.319 3.42787 1756.89     53.3038  1818.26     55.72    259.777    51.0751     63.6475     51.0751     
1 1 1 25 5  22 o 2  171.862 2.45704 528.681     21.1062  519.038     21.2149  153.436    267.437     73.1034     267.437     
1 1 1 25 5  23 o 16 150.381 2.47988 404.483     18.1788  397.721     19.1763  96.9056    300.604     13.169      120.604     
1 1 1 25 5  24 o 4  117.8   2.42238 246.141     13.5837  246.507     14.9545  95.6571    97.1384     52.135      97.1384     
1 1 1 25 5  25 o 7  310.799 3.22716 1715.8      48.1899  1713.37     52.2534  216.359    315.819     12.7433     135.819     
1 1 1 25 5  26 o 4  271.707 3.14949 1328.43     40.9246  1292.38     44.7023  212.488    51.6693     38.2545     51.6693     
1 1 1 25 5  27 o 16 91.4077 2.60789 150.948     11.2811  146.007     12.5065  5.0668     308.749     111.951     128.748     
1 1 1 25 5  28 o 8  169.523 2.56422 506.59      21.5789  513.066     21.9898  145.106    333.483     58.5213     333.483     
1 1 1 25 5  29 o 5  238.151 2.79218 1000.59     31.8718  1012.36     34.7301  175.276    29.9483     13.911      29.9483     
1 1 1 25 5  30 o 7  104.999 2.77123 197.289     12.5398  194.571     16.2962  77.8334    124.776     52.8243     124.776     
1 1 1 25 5  31 o 6  70.7605 3.0959  87.84       9.9849   90.6605     11.8112  26.7761    91.8485     29.4356     271.848     
1 1 1 25 5  32 o 19 92.1032 2.75175 149.868     11.6033  151.823     13.6682  57.181     235.727     39.184      235.727     
1 1 1 25 5  33 o 13 163.759 2.60144 475.148     19.7882  476.785     22.8074  68.9091    159.045     91.7355     339.045     
1 1 1 25 5  34 o 14 136.067 2.59001 337.943     16.1486  319.738     18.9486  88.8289    14.8031     9.50243     194.803     
1 1 1 25 5  35 o 1  80.3351 2.86361 109.629     10.5509  120.314     12.4234  22.7072    11.0198     60.9315     191.02      
1 1 1 25 5  36 o 9  58.1042 3.49974 66.4268     8.86888  54.8173     10.9027  22.6436    94.6669     20.0145     274.667     
1 1 1 25 5  37 o 14 114.417 2.72267 238.28      14.0999  227.392     16.8785  80.8142    35.9376     7.78005     35.9377     
1 1 1 25 5  38 o 7  47.4975 4.13348 49.3608     8.29639  33.1029     10.0816  10.2665    236.75      28.0366     56.7496     
1 1 1 25 5  39 o 12 170.793 2.65589 518.796     20.6639  517.771     24.6219  142.292    4.32034     49.1816     4.32034     
1 1 1 25 5  40 o 5  39.0025 4.91138 21.872      8.76166  34.8738     9.6627   2.11932    154.155     29.7702     334.155     
1 1 1 25 5  41 o 13 120.735 2.68442 260.684     14.6558  258.108     17.6322  93.393     302.596     24.3898     302.596     
1 1 1 25 5  42 o 3  50.1927 3.87469 44.0616     8.72104  46.9593     10.4182  21.6499    273.216     3.09993     93.216      
1 1 1 25 5  43 o 2  70.6615 3.09047 84.6648     10.2575  93.9991     11.5299  43.6493    233.857     0.676339    53.8566     
1 1 1 25 5  44 o 1  117.406 2.73455 234.949     14.195   256.49      17.8639  92.8954    288.244     28.6761     288.244     
1 1 1 25 5  45 o 3  52.368  3.62509 51.1494     8.74619  47.8187     9.93456  25.7312    86.6341     4.66922     266.634     
1 1 1 25 5  46 o 12 121.803 2.72533 247.397     15.4999  282.245     17.7472  72.0079    258.193     20.814      78.1933     
1 1 1 25 5  47 o 15 51.5534 3.64394 49.5596     8.57983  46.522      9.88243  25.9274    228.149     5.78308     228.149     
1 1 1 25 5  48 o 13 85.5403 3.03701 123.956     12.4628  138.129     13.4988  55.5286    302.956     0.771435    122.956     
1 1 1 25 5  49 o 14 22.3849 5.5595  5.55368     7.45403  10.5611     8.15901  8.68224    255.709     33.8588     255.709     
1 1 1 25 5  50 o 11 49.452  4.13985 40.9961     10.1268  48.3924     9.89962  14.6053    299.086     33.8142     119.086     
1 1 1 25 5  51 o 7  54.5813 3.82757 51.1253     9.73798  57.121      10.9333  26.6147    285.335     17.181      105.335     
1 1 1 25 5  52 o 8  27.0135 5.76427 9.31695     8.16516  17.7782     9.08068  1.54419    181.596     25.5408     1.5964      
1 1 1 25 5  53 o 6  35.6937 5.15342 25.4902     8.07149  22.6436     9.69193  12.3302    13.6393     17.3009     193.639     
1 1 1 25 5  54 o 9  118.997 2.95389 228.706     15.2954  280.913     19.9085  93.4961    113.978     27.5829     113.978     
1 1 1 25 5  55 o 13 24.6868 5.70302 11.4448     7.29865  10.4083     9.03423  4.89853    37.1872     7.21748     217.187     
1 1 1 25 5  56 o 13 60.5652 3.55339 65.4376     10.4518  67.9448     10.9252  18.8742    265.903     41.5876     85.9029     
1 1 1 25 5  57 o 8  102.773 2.97181 190.003     15.3112  190.257     15.2361  82.1733    267.69      28.4763     267.69      
1 1 1 25 5  58 o 2  91.7677 3.04608 148.887     13.9782  154.914     13.9556  69.6459    101.99      18.6969     101.99      
1 1 1 25 5  59 o 1  53.0691 4.09924 50.0733     9.74422  53.8145     11.6646  37.0673    358.831     7.91556     358.831     
1 1 1 25 5  60 o 15 25.8255 5.85243 8.06611     8.02892  16.8686     9.4541   4.76304    289.128     17.8991     109.128     
1 1 1 25 5  61 o 17 34.1984 5.604   12.3294     9.42106  34.3157     10.2699  19.8231    50.97       2.11651     50.97       
1 1 1 25 5  62 o 3  47.9721 4.98585 46.9076     10.7964  40.5047     12.2151  34.7951    78.1135     10.733      78.1135     
1 1 1 25 5  63 o 17 25.7046 5.74475 18.574      8.73441  5.01414     9.19785  9.57275    198.222     8.12964     18.2218     
1 1 1 25 5  64 o 10 68.7653 3.80229 86.1773     13.5696  88.5041     12.3724  47.2427    353.303     6.14668     353.303     
1 1 1 25 5  65 o 6  38.1128 5.92891 27.046      9.68097  31.3265     12.3568  17.3811    54.2272     11.8345     234.227     
1 1 1 25 5  66 o 5  39.6341 5.16711 21.6148     9.37562  41.3101     10.2597  16.1665    336.34      16.618      156.34      
1 1 1 25 5  67 o 6  15.3556 4.87925 -5.60289    8.16624  -0.359862   7.71006  0.236559   266.945     4.68924     86.9446     
1 1 1 25 5  68 o 2  24.7236 6.00535 9.92307     9.08167  13.4431     9.00108  10.1548    250.414     0.932848    70.4142     
1 1 1 25 5  69 o 7  32.3979 6.54402 25.052      11.1671  19.1091     11.3051  14.2793    118.313     8.19312     298.313     
1 1 1 25 5  70 o 2  24.9324 6.47715 13.9842     10.7748  8.90826     10.6303  8.45028    215.432     5.34119     35.4316     
1 1 1 25 5  71 o 3  36.2654 6.45939 19.4603     12.966   36.0819     11.4293  16.7742    14.2017     8.35086     194.202     
1 1 1 25 5  72 o 12 32.042  6.81372 16.3888     11.613   27.573      12.4677  12.0199    294.626     12.5907     114.626     
1 1 1 25 5  73 o 15 44.3632 6.68553 41.5502     14.9249  41.7942     13.8884  33.5182    241.194     15.7951     241.194     
1 1 1 25 5  74 o 9  33.7345 7.1179  14.4274     14.3283  34.8273     13.4744  18.5993    262.845     0.459904    82.8445     
1 1 1 25 5  75 o 13 24.6679 6.88688 17.6887     14.2112  3.32026     11.4264  6.58816    44.3174     12.8247     224.317     
1 1 1 25 5  76 o 10 25.5591 7.06448 5.95681     15.8335  16.333      11.8607  8.3699     163.998     2.0853      163.998     
1 1 1 25 5  77 o 16 56.5096 6.5326  73.08       19.8007  67.1683     15.7155  40.8094    163.858     15.1236     163.858     
1 1 1 25 5  78 o 13 36.3305 7.86388 30.2376     18.2219  36.1715     14.1068  19.8974    270.878     2.69185     270.878     
1 1 1 25 5  79 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 6  0  o 19 397.381 3.95053 2802.67     78.6374  2802.67     78.6374  326.062    180         65.0969     180         
1 1 1 25 6  1  o 19 128.725 2.52415 290.6       16.8864  297.586     15.6057  81.3708    58.5324     12.4539     238.532     
1 1 1 25 6  2  o 17 90.296  2.6239  139.109     11.4537  150.702     12.2468  23.1885    257.698     71.865      77.6982     
1 1 1 25 6  3  o 2  305.181 3.30799 1675.15     50.5563  1630.54     50.6198  229.449    208.228     14.4788     208.228     
1 1 1 25 6  4  o 14 238.549 2.90608 1023.33     34.6891  995.738     34.7873  171.181    66.8044     2.04939     246.804     
1 1 1 25 6  5  o 17 177.572 2.67804 550.305     24.2999  568.287     23.333   121.064    298.635     9.5454      118.635     
1 1 1 25 6  6  o 14 311.682 3.37878 1777        50.4127  1671.99     54.8705  195.794    156.986     63.1882     336.986     
1 1 1 25 6  7  o 2  216.126 2.73713 839.911     28.9525  817.223     30.3011  109.526    216.272     93.1379     36.2719     
1 1 1 25 6  8  o 2  183.163 2.63991 612.26      23.6824  578.036     24.7249  148.789    54.0487     40.0107     54.0488     
1 1 1 25 6  9  o 13 257.834 2.94274 1185.05     35.5984  1173.74     40.2805  154.364    265.275     65.2092     85.2753     
1 1 1 25 6  10 o 15 368.808 3.48542 2430.78     64.4459  2398.08     64.3912  358.542    274.859     181.297     274.859     
1 1 1 25 6  11 o 9  214.539 2.60051 818.219     28.4351  814.465     27.4772  168.94     105.111     31.7748     105.111     
1 1 1 25 6  12 o 1  114.206 2.44834 227.654     14.6881  235.419     13.2391  75.6216    226.12      2.44075     226.12      
1 1 1 25 6  13 o 6  376.927 3.8111  2504.91     71.9346  2541.01     72.0421  257.616    256.7       34.4764     76.7003     
1 1 1 25 6  14 o 11 198.152 2.63769 695.421     26.5892  697.465     25.7892  112.597    301.074     58.213      121.074     
1 1 1 25 6  15 o 14 274.833 3.05111 1331.04     42.7607  1349.54     41.26    203.359    328.592     10.0116     328.591     
1 1 1 25 6  16 o 15 133.367 2.55495 319.821     17.373   311.62      16.748   62.8098    143.572     59.1014     323.572     
1 1 1 25 6  17 o 15 221.538 2.79366 872.673     32.1542  868.705     29.8389  152.98     201.846     10.7603     21.8459     
1 1 1 25 6  18 o 4  179.051 2.73857 573.104     23.966   564.375     25.1556  169.94     172.152     95.5591     172.152     
1 1 1 25 6  19 f 0  532.261 5.14646 5054.7      137.29   5028.88     137.261  373.429    308.27      0           0           
1 1 1 25 6  20 f 0  172.238 2.67716 521.795     23.592   530.739     22.6036  158.648    180.232     0           0           
1 1 1 25 6  21 o 4  172.796 2.5471  523.814     22.0382  535.47      22.0736  149.71     196.519     61.4346     196.519     
1 1 1 25 6  22 o 17 78.5461 2.72081 106.639     10.6566  112.835     10.6923  23.8268    267.251     48.5361     87.2507     
1 1 1 25 6  23 o 9  208.166 2.64537 776.91      27.6167  760.629     27.5747  157.052    135.326     19.6465     135.326     
1 1 1 25 6  24 o 8  125.26  2.43522 286.168     15.3087  270.966     15.229   93.555     121.447     21.633      121.447     
1 1 1 25 6  25 o 15 31.0335 4.67184 16.4871     7.21279  19.0943     6.87317  31.5893    219.285     84.3145     219.285     
1 1 1 25 6  26 o 11 187.324 2.43683 647.973     23.266   597.479     22.4827  102.41     182.541     60.0658     2.54119     
1 1 1 25 6  27 o 9  184.1   2.63169 605.248     24.6237  597.529     23.935   179.705    138.033     107.48      138.033     
1 1 1 25 6  28 o 14 274.31  2.9768  1335.25     40.8259  1336.4      41.0171  188.387    253.652     15.0073     73.6515     
1 1 1 25 6  29 o 3  118.945 2.49493 245.434     14.1852  257.149     15.5205  94.7888    176.068     33.1891     176.068     
1 1 1 25 6  30 o 9  98.2938 2.68858 165.979     12.3162  177.62      14.1093  68.1992    1.74027     9.89695     1.74027     
1 1 1 25 6  31 o 17 199.497 2.69393 708.959     27.3019  704.06      26.5611  147.458    89.5937     13.6619     89.5937     
1 1 1 25 6  32 o 12 85.1377 2.61705 127.258     10.7737  130.581     11.5008  46.7404    35.2211     17.4913     215.221     
1 1 1 25 6  33 o 8  162.7   2.52594 461.398     20.435   478.499     20.7554  129.89     68.7111     33.4909     68.7111     
1 1 1 25 6  34 o 16 128.571 2.528   300.084     15.3865  287.415     17.0716  72.3472    186.438     33.1141     6.43846     
1 1 1 25 6  35 o 15 178.676 2.70014 555.525     22.7676  578.776     25.5564  117.839    296.104     14.791      116.104     
1 1 1 25 6  36 o 3  34.63   4.8473  22.8282     7.59355  21.4954     8.61135  31.7258    134.545     103.134     134.545     
1 1 1 25 6  37 o 15 142.275 2.49007 358.086     16.7769  361.231     18.6713  68.7139    239.126     60.4602     59.1258     
1 1 1 25 6  38 o 14 107.362 2.67574 207.466     13.1901  202.763     15.4391  92.7463    333.566     45.1071     333.566     
1 1 1 25 6  39 o 9  70.7244 3.2538  85.4044     11.1455  93.5504     11.7965  18.0707    143.576     56.7695     323.576     
1 1 1 25 6  40 o 18 113.557 2.58853 226.011     13.8187  232.99      15.5753  87.1078    31.1609     21.4213     31.1609     
1 1 1 25 6  41 o 19 40.8191 4.32372 29.263      7.89045  31.682      9.24251  9.50116    325.805     7.67442     145.805     
1 1 1 25 6  42 o 9  58.0008 3.53055 60.0614     8.98309  60.9028     11.2165  26.1818    221.126     18.188      41.1263     
1 1 1 25 6  43 o 5  29.6111 5.48757 16.6808     7.36347  16.0202     9.17309  0.525679   250.734     9.32058     250.734     
1 1 1 25 6  44 o 11 63.4559 3.41956 84.3049     9.4      61.2816     11.4782  38.5454    98.2924     0.811062    98.2924     
1 1 1 25 6  45 o 10 83.4517 3.03318 120.702     11.6083  128.51      13.6465  41.5403    114.047     27.1411     294.047     
1 1 1 25 6  46 o 4  245.516 3.20855 1026.16     35.474   1128.82     43.3871  182.955    63.8999     26.3184     63.8999     
1 1 1 25 6  47 o 4  90.491  3.15364 147.359     13.1047  145.989     15.3075  78.0124    18.5492     38.9753     18.5492     
1 1 1 25 6  48 o 8  69.2165 4.07586 93.4841     11.0355  80.243      15.9681  47.5847    182.104     5.91552     182.104     
1 1 1 25 6  49 o 4  79.0242 3.27869 104.282     11.7453  120.422     14.1195  64.2327    356.093     24.4344     356.093     
1 1 1 25 6  50 o 11 128.934 3.06545 296.438     18.0004  299.332     21.4181  67.428     78.1095     41.1681     258.109     
1 1 1 25 6  51 o 11 90.3336 2.94171 132.885     11.57    160.518     15.0027  70.8664    170.88      21.211      170.88      
1 1 1 25 6  52 o 5  40.1601 4.76521 27.1596     8.08749  33.2629     10.4293  13.597     122.471     22.6441     302.471     
1 1 1 25 6  53 o 4  24.9704 6.00973 12.0228     8.09472  9.38788     10.1182  1.12413    190.481     23.1924     10.4811     
1 1 1 25 6  54 o 14 86.2842 3.04851 127.935     12.6161  140.343     13.6708  66.0842    182.935     17.9102     182.935     
1 1 1 25 6  55 f 0  52.2525 3.95785 56.789      9.58264  43.7952     10.4811  24.9547    106.894     0           0           
1 1 1 25 6  56 o 9  130.104 2.85304 290.424     17.5589  318.417     19.6076  98.8662    13.542      23.4094     13.542      
1 1 1 25 6  57 o 1  20.0723 5.643   2.08779     7.73721  6.91509     9.31506  12.5929    163.918     47.4748     163.918     
1 1 1 25 6  58 o 7  94.9385 3.24304 161.204     15.4649  164.961     15.2988  66.5779    254.066     7.64161     254.066     
1 1 1 25 6  59 o 7  71.0956 3.82716 99.3764     14.0567  85.9363     13.0112  40.64      145.243     11.6367     325.243     
1 1 1 25 6  60 o 5  34.4011 5.61702 22.9864     9.26838  23.1984     9.70813  15.2107    109.595     10.4362     289.595     
1 1 1 25 6  61 o 14 54.3065 4.06531 50.9948     10.7372  58.4694     11.0271  39.9278    197.398     11.22       197.398     
1 1 1 25 6  62 o 18 15.5584 5.02207 -4.7547     7.90692  -4.15808    9.41733  0.0713988  235.042     7.93628     235.042     
1 1 1 25 6  63 o 8  52.6248 4.1529  55.7994     10.9923  47.9873     10.5167  31.8059    14.5668     3.37116     194.567     
1 1 1 25 6  64 o 10 54.2087 4.06209 50.7691     10.995   59.4344     10.6278  32.9379    229.78      3.14173     49.7802     
1 1 1 25 6  65 o 8  42.8812 4.78702 33.9405     9.33275  37.1329     10.5587  35.5469    249.42      21.9783     249.42      
1 1 1 25 6  66 o 15 23.7106 5.71841 16.4068     8.819    3.00742     8.81891  6.13198    141.956     13.1138     321.956     
1 1 1 25 6  67 o 8  81.104  3.44213 124.249     13.7754  119.094     14.0623  53.2194    199.733     2.37437     199.733     
1 1 1 25 6  68 o 19 37.2236 6.59641 25.6001     13.0146  32.9296     11.7574  23.8913    43.63       5.97823     43.63       
1 1 1 25 6  69 o 10 22.5352 6.46161 8.42724     12.5533  5.60031     10.1423  5.40804    140.186     2.72074     320.186     
1 1 1 25 6  70 o 19 31.5263 6.68235 17.4701     11.6964  24.7369     11.3823  13.0913    52.4304     9.00822     232.43      
1 1 1 25 6  71 o 17 29.9377 6.41024 28.0419     11.4286  8.48009     11.2797  15.1463    268.845     1.62907     88.8454     
1 1 1 25 6  72 o 17 33.4929 6.86648 28.3826     12.159   19.9459     12.5826  15.831     72.3668     7.08685     252.367     
1 1 1 25 6  73 o 2  29.3698 6.94821 12.9147     12.0139  23.6724     12.5717  12.5102    98.5639     7.5596      278.564     
1 1 1 25 6  74 o 6  27.604  6.87395 20.6872     11.8544  10.5184     12.546   5.31758    102.958     20.7581     282.958     
1 1 1 25 6  75 o 5  39.2716 6.73836 34.0925     12.9906  34.5586     13.2598  26.6084    240.007     9.72736     240.007     
1 1 1 25 6  76 o 14 45.7208 6.55958 35.3336     14.5205  58.6239     14.5327  32.9631    354.754     14.4647     354.754     
1 1 1 25 6  77 o 11 33.9507 7.7787  27.1421     16.9441  30.7425     13.8406  17.9505    323.955     3.03076     323.955     
1 1 1 25 6  78 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 7  0  o 11 195.589 2.67463 678.941     26.194   678.941     26.194   154.43     2.9936e-06  19.5515     2.9936e-06  
1 1 1 25 7  1  o 16 134.742 2.30321 317.169     15.5162  326.758     15.587   49.6654    111.616     90.3726     291.616     
1 1 1 25 7  2  o 13 209.938 2.61722 784.1       27.5353  779.378     27.5354  180.377    256.476     61.4852     256.476     
1 1 1 25 7  3  o 16 73.1949 2.61032 87.7748     9.68112  103.066     9.32568  27.7068    14.1036     152.5       14.1036     
1 1 1 25 7  4  o 7  118.298 2.39838 247.002     14.467   249.763     13.9323  84.9986    280.4       15.1773     280.4       
1 1 1 25 7  5  o 4  264.113 2.88663 1238.83     38.8943  1236.26     37.508   166.587    75.6186     51.1764     255.619     
1 1 1 25 7  6  o 5  136.38  2.38476 322.197     16.8179  337.797     15.7119  54.7389    330.985     82.2923     150.985     
1 1 1 25 7  7  o 10 286.002 3.08356 1474.45     45.0483  1428.67     43.3456  206.102    326.403     4.02455     146.403     
1 1 1 25 7  8  o 12 122.466 2.52934 273.974     15.3995  258.596     15.5974  48.9448    180.875     71.8261     0.874962    
1 1 1 25 7  9  o 14 146.341 2.61274 390.759     18.5592  369.378     19.6841  94.3663    305.049     15.0486     125.049     
1 1 1 25 7  10 o 14 165.885 2.50053 484.259     20.2505  491.869     21.3178  137.153    77.7864     43.8913     77.7864     
1 1 1 25 7  11 f 0  282.596 3.09374 1440.78     42.8553  1393.79     44.7123  197.459    9.00261     0           0           
1 1 1 25 7  12 o 3  420.168 4.15495 3178.13     89.3606  3095.92     85.6132  335.49     52.2659     56.5806     52.2659     
1 1 1 25 7  13 o 6  302.773 3.21529 1645.16     45.6926  1609.01     51.6273  138.102    78.9261     165.328     258.926     
1 1 1 25 7  14 o 15 194.936 2.53059 680.809     24.1892  667.245     25.2302  156.07     246.068     36.1484     246.067     
1 1 1 25 7  15 o 14 193.545 2.45937 662.96      23.8203  665.832     23.8884  113.061    117.559     50.6362     297.559     
1 1 1 25 7  16 o 18 183.813 2.45388 603.458     22.9383  595.081     22.2691  125.624    323.579     9.43071     143.578     
1 1 1 25 7  17 f 0  326.363 3.25463 1924.58     54.1754  1857.08     52.2902  245.73     153.189     0           0           
1 1 1 25 7  18 o 16 154.863 2.60455 444.486     19.5779  407.061     20.7332  138.164    4.36685     66.7455     4.36685     
1 1 1 25 7  19 o 9  304.856 3.45645 1626.44     55.0786  1674.18     50.3499  227.111    124.418     13.291      124.418     
1 1 1 25 7  20 o 11 163.943 2.59714 482.718     21.9889  470.938     20.6802  48.7032    335.901     136.128     155.901     
1 1 1 25 7  21 o 14 183.373 2.68452 592.81      25.5115  600.401     23.7856  108.206    160.531     44.0461     340.531     
1 1 1 25 7  22 o 11 108.952 2.50121 202.651     13.1799  219.113     14.1022  57.0317    134.985     32.0239     314.985     
1 1 1 25 7  23 o 6  94.8598 2.57663 159.172     11.7216  160.597     12.7142  52.2741    252.105     17.0238     72.1052     
1 1 1 25 7  24 o 9  94.6034 2.62508 157.324     12.4548  160.781     12.3857  67.3782    321.516     24.2062     321.516     
1 1 1 25 7  25 o 10 122.805 2.57676 264.001     15.8127  271.692     15.8665  81.0166    313.695     4.83446     133.695     
1 1 1 25 7  26 o 19 285.353 3.21044 1430.92     47.6605  1461.56     44.0453  222.501    350.524     35.6252     350.524     
1 1 1 25 7  27 o 18 220.73  2.99142 854.557     32.9823  875.851     33.1966  162.523    314.678     10.6986     314.678     
1 1 1 25 7  28 o 14 192.445 2.64658 655.741     25.9861  659.031     25.0511  130.919    113.697     11.138      293.697     
1 1 1 25 7  29 o 2  404.323 3.98121 2928.12     80.635   2890.09     80.6991  342.289    257.094     103.297     257.094     
1 1 1 25 7  30 o 3  139.028 2.60326 333.59      18.5538  353.308     17.6397  133.472    138.372     79.0922     138.372     
1 1 1 25 7  31 o 1  109.423 2.54366 206.727     13.6712  218.957     14.1893  40.5482    250.202     70.5469     70.2016     
1 1 1 25 7  32 o 19 126.067 2.53874 281.689     15.7985  283.16      16.245   100.949    83.9543     29.7236     83.9543     
1 1 1 25 7  33 o 5  33.8193 4.87263 27.6647     7.79137  15.1888     8.15744  1.49946    2.67016     17.5352     2.67016     
1 1 1 25 7  34 o 12 179.921 2.55723 570.529     22.8915  579.461     23.2237  159.34     23.2648     67.4241     23.2648     
1 1 1 25 7  35 o 3  111.831 2.64876 225.965     14.1143  218.991     15.476   85.165     153.905     19.3449     153.905     
1 1 1 25 7  36 o 7  102.041 2.55147 174.254     12.5736  196.563     13.4837  88.176     272.503     43.5867     272.503     
1 1 1 25 7  37 o 16 120.961 2.53379 261.655     14.8216  258.848     15.8401  106.306    251.208     49.8082     251.208     
1 1 1 25 7  38 o 5  52.086  3.59844 55.8418     8.96839  42.3056     9.34857  24.0218    207.525     6.78339     27.525      
1 1 1 25 7  39 o 15 35.7561 4.75028 22.1384     7.56923  25.2263     8.83725  0.386206   211.948     34.5629     211.948     
1 1 1 25 7  40 o 12 91.4314 2.63235 139.53      11.5595  158.728     12.5181  76.3733    251.791     34.6347     251.791     
1 1 1 25 7  41 o 4  44.898  3.93063 36.7674     8.15797  36.4462     9.11274  11.3033    22.1699     27.5944     202.17      
1 1 1 25 7  42 o 15 196.841 2.69125 683.938     25.9338  696.117     27.157   152.018    150.752     30.3055     150.752     
1 1 1 25 7  43 o 11 46.3349 4.00671 36.8044     8.98378  41.3628     9.22168  19.4187    173.182     3.203       353.182     
1 1 1 25 7  44 o 3  75.7442 3.15867 101.865     11.4858  103.759     12.3773  30.22      230.162     39.7747     50.1615     
1 1 1 25 7  45 o 13 25.0587 5.58139 15.8577     7.87509  5.25851     8.79113  4.9904     89.4213     25.962      89.4213     
1 1 1 25 7  46 o 4  18.7674 5.33726 2.43396     6.78708  4.03665     8.55306  4.3662     237.137     14.3872     237.137     
1 1 1 25 7  47 o 8  38.6619 4.93229 26.7067     8.83681  29.0953     9.57693  16.6677    213.637     10.876      33.637      
1 1 1 25 7  48 o 11 34.3948 5.00936 16.8911     7.68229  28.2379     9.09424  16.3334    187.061     3.24847     187.061     
1 1 1 25 7  49 o 2  57.898  3.60144 67.4158     10.2713  54.3777     10.3045  28.6919    201.562     18.7637     21.5622     
1 1 1 25 7  50 o 19 110.107 2.66116 213.252     14.4694  220.687     14.8566  95.8118    276.995     42.9791     276.995     
1 1 1 25 7  51 o 18 101.664 2.76122 187.012     14.1383  183.547     13.9454  69.0617    12.3913     0.659467    12.3914     
1 1 1 25 7  52 o 6  17.124  5.10305 0.0249265   7.21543  1.93343     7.74717  0.310699   308.187     1.95054     308.187     
1 1 1 25 7  53 o 17 76.1791 3.13503 105.174     11.327   104.288     12.4704  55.2499    321.506     9.70963     321.506     
1 1 1 25 7  54 o 14 13.3631 4.43304 -3.893      6.73357  -13.4791    8.77851  10.5334    61.1877     30.2874     61.1877     
1 1 1 25 7  55 o 13 133.183 3.04765 310.203     19.3256  329.157     21.2991  96.3846    210.045     13.2868     210.045     
1 1 1 25 7  56 o 17 21.0199 5.79515 -0.18506    8.0523   10.6147     10.105   1.576      39.4358     13.5859     219.436     
1 1 1 25 7  57 f 0  88.9323 3.33532 149.637     14.5233  137.278     15.0474  51.2715    322.232     0           0           
1 1 1 25 7  58 o 5  15.9698 5.17566 -3.95972    7.8971   -6.88607    10.7559  1.77181    207.512     11.8318     207.512     
1 1 1 25 7  59 o 10 52.0057 4.72174 52.4537     11.5298  49.2158     12.4368  31.2046    300.654     4.09156     120.654     
1 1 1 25 7  60 o 16 73.0811 3.74252 104.713     12.2206  91.6305     14.6361  43.7701    215.533     8.37681     35.533      
1 1 1 25 7  61 o 18 23.2544 5.89037 12.9451     8.05695  2.91448     10.6891  6.30003    124.148     11.8611     304.148     
1 1 1 25 7  62 o 10 22.4937 5.84994 7.65855     8.05881  9.35199     9.26645  1.58378    353.503     22.1139     173.503     
1 1 1 25 7  63 o 15 63.4065 3.95264 71.7727     12.3351  78.2724     12.5143  39.0449    208.715     3.90069     28.7147     
1 1 1 25 7  64 o 10 38.7685 5.3405  35.3602     9.12252  24.4136     10.6756  10.8118    81.7896     27.0479     261.79      
1 1 1 25 7  65 o 17 13.2028 4.41009 -12.6318    8.12525  -4.47707    7.50922  8.48835    131.738     28.9729     131.738     
1 1 1 25 7  66 o 6  63.6456 4.13294 79.2927     12.929   73.8644     13.1154  55.0882    184.13      30.5661     184.13      
1 1 1 25 7  67 o 19 54.0426 4.21799 53.792      11.3953  57.4078     11.0385  26.5423    35.9009     15.1307     215.901     
1 1 1 25 7  68 o 4  55.5907 5.00016 47.9258     13.2022  74.2441     13.3758  29.7266    212.57      10.1819     32.5699     
1 1 1 25 7  69 o 7  56.3347 4.78738 56.3168     13.3284  67.2757     12.9949  41.5406    331.35      13.7628     331.35      
1 1 1 25 7  70 o 5  42.1459 5.96575 31.7532     12.3508  41.4855     11.9326  26.854     281.625     3.50265     281.625     
1 1 1 25 7  71 f 0  19.1217 5.85525 1.97704     10.6786  0.653291    9.98163  4.82235    65.1733     0           0           
1 1 1 25 7  72 o 5  58.4892 5.15703 72.1509     14.4828  63.7097     14.9709  34.0801    248.935     4.68047     68.9345     
1 1 1 25 7  73 o 11 36.7971 7.44625 19.8226     12.6508  44.1293     16.9342  22.6117    258.966     3.44652     258.966     
1 1 1 25 7  74 o 5  29.9014 7.22386 6.35948     12.0575  34.413      15.8904  12.1279    105.061     6.62547     105.061     
1 1 1 25 7  75 o 15 19.2145 6.23326 -8.04051    11.759   3.11731     15.1837  2.22735    107.541     7.08833     287.541     
1 1 1 25 7  76 o 4  22.6433 6.75653 15.0959     13.0928  -8.31465    16.1274  1.56128    260.503     0.636589    80.5026     
1 1 1 25 7  77 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 8  0  o 5  57.7932 3.03108 60.1948     8.66523  60.1948     8.66523  4.52584    180         57.5493     8.39885e-06 
1 1 1 25 8  1  o 19 160.314 2.453   459.772     20.0675  451.899     19.3459  119.632    80.9622     14.2863     80.9622     
1 1 1 25 8  2  o 16 210.683 2.55809 789.616     26.9849  785.036     27.0325  165.526    14.9225     28.4895     14.9225     
1 1 1 25 8  3  o 19 234.185 2.68073 973.625     31.4477  972.142     31.4743  126.031    160.511     88.7309     340.511     
1 1 1 25 8  4  o 1  172.594 2.42113 524.166     20.9144  532.487     20.9675  129.661    100.886     15.1887     100.886     
1 1 1 25 8  5  o 10 209.018 2.56426 784.033     26.8537  765.892     26.8634  119.543    263.699     63.2529     83.6992     
1 1 1 25 8  6  o 8  54.2339 2.97406 47.865      7.98529  57.3634     8.00132  3.60611    80.2599     32.2152     260.26      
1 1 1 25 8  7  o 4  191.841 2.50206 652.594     24.468   652.954     23.6337  157.981    75.6158     43.423      75.6158     
1 1 1 25 8  8  o 7  193.812 2.61604 671.107     25.4001  661.563     25.4165  153.971    115.817     31.8173     115.817     
1 1 1 25 8  9  o 12 257.487 2.92244 1173.95     39.1427  1178.93     36.2147  193.148    116.252     12.7057     116.252     
1 1 1 25 8  10 o 1  153.911 2.47364 429.859     19.3773  410.583     18.7832  132.84     173.617     54.7214     173.617     
1 1 1 25 8  11 o 6  296.806 3.15345 1593.61     47.8065  1533.84     46.0079  243.69     248.794     55.7525     248.794     
1 1 1 25 8  12 o 10 159.581 2.59794 449.088     21.5389  454.419     19.9746  127.59     259.724     32.8428     259.724     
1 1 1 25 8  13 o 15 435.506 4.21263 3395.11     87.9497  3347.41     95.7072  324.755    327.991     11.2644     327.991     
1 1 1 25 8  14 o 2  70.8442 2.86873 90.7372     9.71156  87.9725     10.5397  26.4326    235.651     23.2023     55.6509     
1 1 1 25 8  15 o 14 129.814 2.52277 313.38      15.9341  285.263     16.7797  111.09     41.9848     51.9956     41.9848     
1 1 1 25 8  16 o 16 300.98  3.16749 1625.95     46.7138  1590.4      48.7891  235.246    151.659     33.5098     151.659     
1 1 1 25 8  17 o 16 83.1236 2.65571 131.828     10.5348  114.17      11.407   9.32605    292.965     91.7811     112.965     
1 1 1 25 8  18 o 11 152.838 2.58114 426.832     19.1687  402.466     20.2911  70.2105    218.932     76.3111     38.9322     
1 1 1 25 8  19 o 15 290.885 3.23561 1514.61     45.1563  1490.26     49.0621  246.44     326.509     72.5507     326.509     
1 1 1 25 8  20 o 14 224.103 2.83563 891.388     32.3547  891.324     31.3295  152.957    335.444     16.1659     155.444     
1 1 1 25 8  21 f 0  227.157 2.63928 914.774     30.4833  916.543     29.5993  204.261    314.111     0           0           
1 1 1 25 8  22 f 0  162.294 2.53075 469.972     19.9214  464.773     21.2168  116.826    70.9041     0           0           
1 1 1 25 8  23 o 8  141.958 2.52269 368.809     17.4536  346.805     18.369   78.9902    299.382     41.7132     119.382     
1 1 1 25 8  24 o 2  180.483 2.53268 585.747     22.7305  570.472     23.0755  161.923    107.737     70.0153     107.737     
1 1 1 25 8  25 o 2  98.074  2.60306 174.616     12.5342  167.354     12.9895  32.3077    92.3745     70.3177     272.375     
1 1 1 25 8  26 o 12 163.492 2.60608 463.194     21.5802  485.909     21.1008  98.8831    310.539     34.4193     130.539     
1 1 1 25 8  27 o 11 229.621 2.77212 959.331     31.1393  913.509     32.5929  185.752    115.755     42.9141     115.755     
1 1 1 25 8  28 o 13 229.456 2.67466 929.445     31.2481  940.39      30.249   149.434    292.445     30.0476     112.445     
1 1 1 25 8  29 o 14 249.302 3.02783 1142.79     36.8836  1066.9      38.6571  178.32     96.5228     0.554124    276.523     
1 1 1 25 8  30 o 2  71.4405 3.11312 91.1012     11.0101  91.0547     11.1721  38.6863    106.63      12.7788     286.63      
1 1 1 25 8  31 o 19 244.879 2.85004 1081.28     34.9479  1050.26     34.9967  163.017    86.7794     23.9437     266.779     
1 1 1 25 8  32 o 19 37.6439 4.65129 30.5327     8.52418  21.8783     8.30527  2.43671    8.43058     19.3753     188.431     
1 1 1 25 8  33 o 19 66.6725 3.10618 83.1808     10.5192  75.7462     10.1196  42.7544    107.468     8.47373     107.468     
1 1 1 25 8  34 o 17 84.0366 3.20089 128.252     13.9673  123.899     12.8871  39.8314    278.363     33.2576     98.3633     
1 1 1 25 8  35 o 14 41.0477 4.56743 35.6579     8.15671  26.3729     9.5963   8.57903    291.431     17.2226     111.431     
1 1 1 25 8  36 o 8  223.341 2.75008 864.293     30.5066  910.6       31.0502  147.761    116.586     20.7348     296.586     
1 1 1 25 8  37 o 17 59.8907 3.5358  67.8739     9.72745  61.0859     11.1399  22.4837    184.85      31.1423     4.85013     
1 1 1 25 8  38 f 0  80.7142 3.06415 109.337     11.5676  123.719     13.1417  66.3745    235.523     0           0           
1 1 1 25 8  39 o 3  116.841 2.67932 228.283     15.5331  258.75      15.7692  93.8549    235.227     28.6705     235.227     
1 1 1 25 8  40 o 8  81.6932 2.98282 117.992     11.8927  120.626     12.4464  51.0672    351.962     5.70497     171.962     
1 1 1 25 8  41 o 18 42.8626 4.42957 31.3271     8.94554  36.1579     9.51754  14.6935    300.099     5.60123     120.099     
1 1 1 25 8  42 o 13 20.332  5.53238 1.23338     7.66445  8.32492     8.57203  9.87525    17.9992     28.276      17.9992     
1 1 1 25 8  43 o 2  81.0503 3.00766 121.27      11.5574  113.992     12.7133  50.8246    129.781     5.94624     309.781     
1 1 1 25 8  44 o 12 58.8516 3.54887 67.8075     9.65783  57.4085     10.8579  29.5932    339.677     16.6181     159.677     
1 1 1 25 8  45 f 0  19.561  5.22603 0.287908    6.8809   8.88031     7.72019  20.2086    66.4185     0           0           
1 1 1 25 8  46 o 1  103.794 2.73434 182.85      13.8611  202.664     14.533   68.709     291.434     4.97913     111.434     
1 1 1 25 8  47 o 14 98.0746 2.85976 166.933     14.1955  177.734     13.8298  71.6842    31.0283     9.7133      31.0283     
1 1 1 25 8  48 o 14 52.1851 3.71398 48.1395     9.4886   50.956      9.67109  35.8542    186.297     5.41293     186.297     
1 1 1 25 8  49 f 0  53.8589 3.77907 46.3364     9.47465  59.7952     10.6424  24.6059    284.096     0           0           
1 1 1 25 8  50 o 5  19.9066 5.55555 4.1896      7.34235  4.86073     8.99571  0.341259   253.162     12.5268     253.162     
1 1 1 25 8  51 o 17 64.6486 3.55761 77.3046     10.7388  74.5348     12.056   55.7238    119.143     28.4158     119.143     
1 1 1 25 8  52 o 10 31.482  5.56715 8.3872      9.24841  29.99       9.69997  11.4829    270.208     4.33342     270.208     
1 1 1 25 8  53 o 17 26.932  5.42138 0.594914    8.54037  24.8725     9.5113   9.48772    68.3431     3.49197     248.343     
1 1 1 25 8  54 o 11 95.6531 2.99462 165.543     14.1353  164.442     14.4995  66.169     341.408     3.88286     341.408     
1 1 1 25 8  55 o 8  39.8881 5.19176 18.915      9.7476   43.8111     9.90887  27.5636    325.803     9.62802     325.803     
1 1 1 25 8  56 o 2  93.9712 2.96268 152.4       13.4656  166.557     14.3733  57.7493    143.295     10.2378     323.295     
1 1 1 25 8  57 o 4  87.9989 2.96001 130.508     12.7729  149.686     13.2399  76.2618    115.903     36.3366     115.903     
1 1 1 25 8  58 o 4  47.344  4.35792 42.7578     9.36255  41.1191     10.7204  39.3681    44.6776     21.3077     44.6776     
1 1 1 25 8  59 o 18 86.4575 3.02363 127.629     12.5417  143.845     13.5848  59.4067    49.3822     4.21683     49.3823     
1 1 1 25 8  60 o 5  84.385  3.04381 124.059     12.8826  135.008     12.7508  47.2008    267.514     17.34       87.514      
1 1 1 25 8  61 o 4  19.9584 5.61257 6.58768     8.73096  3.23228     8.13628  2.58138    182.72      15.0035     2.71966     
1 1 1 25 8  62 f 0  58.6494 3.9805  61.7542     11.2559  67.0357     11.858   35.9545    70.1468     0           0           
1 1 1 25 8  63 o 17 19.425  5.59054 6.36706     8.47585  1.16162     8.88436  3.23069    355.983     1.7066      175.983     
1 1 1 25 8  64 o 7  19.4573 5.54417 5.94475     8.35944  2.99469     8.34002  4.0401     120.066     3.66804     300.066     
1 1 1 25 8  65 o 13 84.9222 3.45223 134.713     15.1011  132.433     14.1486  68.7002    67.4544     27.7285     67.4544     
1 1 1 25 8  66 o 17 20.1566 5.80959 7.30108     9.0813   1.34697     9.75724  3.06018    82.6291     2.40559     262.629     
1 1 1 25 8  67 o 4  47.3758 6.41729 50.2258     12.953   43.4597     16.1265  32.2352    219.697     7.29766     219.697     
1 1 1 25 8  68 o 2  50.4282 6.04784 43.9123     13.0908  61.1936     16.4596  30.7093    83.4246     0.904759    263.425     
1 1 1 25 8  69 o 13 41.4744 6.98995 38.0077     12.6716  36.2768     16.0726  18.7491    160.325     13.1673     340.325     
1 1 1 25 8  70 o 4  25.4956 7.10001 7.0732      11.4397  16.083      15.1971  11.9437    216.26      0.569251    216.26      
1 1 1 25 8  71 o 3  31.0998 6.97886 29.8626     12.0274  8.33711     15.8952  4.43341    18.6129     28.3313     198.613     
1 1 1 25 8  72 o 15 74.0977 5.2047  130.737     16.1877  89.6535     19.8693  54.9404    84.1566     16.9546     84.1566     
1 1 1 25 8  73 o 2  35.0587 6.76698 14.9095     12.8146  41.4145     13.6041  19.3524    195.969     0.898073    15.9694     
1 1 1 25 8  74 o 7  27.2632 7.061   20.5916     12.7535  12.3675     12.8768  11.1737    63.0066     3.23567     243.007     
1 1 1 25 8  75 o 3  31.5063 7.41228 21.7827     13.8092  27.0955     13.7226  15.1005    99.1583     0.561701    279.158     
1 1 1 25 8  76 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 9  0  o 14 193.619 2.48096 665.246     24.0551  665.246     24.0551  159.789    180         32.3735     180         
1 1 1 25 9  1  o 14 136.954 2.48227 341.733     17.0131  324.014     17.0352  102.41     222.719     15.9637     222.72      
1 1 1 25 9  2  o 13 161.708 2.42111 461.086     19.642   466.547     19.5979  135.629    181.296     44.8914     181.296     
1 1 1 25 9  3  o 1  348.09  3.376   2157.74     57.7978  2144.91     59.959   316.851    334.833     123.668     334.833     
1 1 1 25 9  4  o 14 111.986 2.45922 232.123     13.5314  213.392     13.9953  71.2236    186.975     7.82505     6.9751      
1 1 1 25 9  5  o 5  628.433 5.2507  7104.57     165.364  6961.82     165.348  523.924    132.704     119.237     132.704     
1 1 1 25 9  6  o 7  46.1917 3.46176 34.142      7.67259  42.7254     8.06459  0.0772995  42.6276     9.29298     42.6277     
1 1 1 25 9  7  o 14 147.124 2.37505 383.196     17.531   384.645     17.4912  83.5012    222.759     41.4403     42.759      
1 1 1 25 9  8  o 3  132.462 2.37301 322.97      15.7111  299.889     15.7613  72.9921    353.739     39.6395     173.739     
1 1 1 25 9  9  o 8  146.897 2.44884 391.624     18.3495  374.021     17.7073  80.1924    286.547     47.9208     106.547     
1 1 1 25 9  10 o 19 119.854 2.4678  254.374     15.0609  255.699     14.5467  82.353     316.753     2.19529     316.753     
1 1 1 25 9  11 o 16 161.116 2.54329 465.146     20.0618  455.913     20.9871  124.932    135.642     22.9092     135.642     
1 1 1 25 9  12 o 6  120.887 2.53065 261.675     15.9263  257.296     14.6861  105.799    72.0019     58.8871     72.0019     
1 1 1 25 9  13 o 7  185.499 2.5467  613.869     23.662   607.102     23.6863  108.98     106.052     48.9205     286.052     
1 1 1 25 9  14 o 12 168.608 2.48351 510.25      21.0572  498.48      20.9117  121.353    8.82713     3.23032     8.82712     
1 1 1 25 9  15 o 3  273.414 2.99269 1325.82     42.5683  1328.28     39.3773  208.341    187.502     19.2045     187.502     
1 1 1 25 9  16 o 17 193.989 2.60309 654.327     25.2697  681.313     25.3362  156.446    19.2221     35.6636     19.2221     
1 1 1 25 9  17 o 5  204.674 2.71154 747.284     28.259   739.666     27.3626  122.385    135.415     50.7459     315.415     
1 1 1 25 9  18 o 10 35.5842 4.39882 26.1011     7.47698  20.4257     7.57902  7.83388    348.726     32.9225     348.726     
1 1 1 25 9  19 o 17 112.333 2.6707  225.263     15.2298  223.178     14.7953  66.228     176.14      22.0929     356.14      
1 1 1 25 9  20 o 14 267.454 3.17619 1313.41     41.4194  1228.61     43.5867  247.323    304.665     108.423     304.665     
1 1 1 25 9  21 o 1  202.094 2.73617 747.663     27.5316  702.821     27.8597  118.1      125.748     55.3032     305.748     
1 1 1 25 9  22 o 18 35.0838 4.85408 26.2764     8.11485  19.305      8.30639  5.22222    184.348     30.875      184.348     
1 1 1 25 9  23 o 14 139.196 2.62948 358.324     17.9868  330.392     18.6111  98.6022    52.1031     1.02194     52.1024     
1 1 1 25 9  24 o 2  137.848 2.59661 351.173     17.732   324.286     18.0745  106.38     159.291     19.3344     159.291     
1 1 1 25 9  25 o 6  192.647 2.64105 658.27      25.2853  659.754     25.7086  140.914    190.547     5.82807     190.547     
1 1 1 25 9  26 o 15 95.9622 2.69362 164.763     12.2606  162.866     13.5541  34.1936    148.934     64.7263     328.934     
1 1 1 25 9  27 o 11 149.066 2.60401 389.693     19.1235  399.655     19.7824  100.175    312.11      10.6884     132.11      
1 1 1 25 9  28 o 8  159.917 2.65777 464.464     20.6753  444.287     21.8725  115.573    67.3082     4.51633     67.3082     
1 1 1 25 9  29 o 18 114.28  2.6331  242.98      14.3061  221.809     15.6922  69.4292    301.85      20.0767     121.85      
1 1 1 25 9  30 o 15 42.8219 4.09292 34.9234     8.1871   31.7114     8.85496  9.4927     251.878     11.4203     71.8781     
1 1 1 25 9  31 o 13 123.919 2.5134  269.63      15.1638  276.521     16.0179  104.617    205.2       38.7417     205.2       
1 1 1 25 9  32 o 2  62.6315 3.11247 67.7841     9.94142  72.5817     9.43732  9.23214    354.759     64.3519     174.759     
1 1 1 25 9  33 o 14 40.2923 4.24802 28.3452     8.52719  30.9735     8.05983  6.32573    15.7064     4.5834      195.706     
1 1 1 25 9  34 o 8  109.636 2.55327 208.202     14.1773  219.792     13.8212  90.8282    328.128     32.6132     328.128     
1 1 1 25 9  35 o 10 107.764 2.76515 207.688     15.0652  206.217     14.751   78.7854    318.63      9.80846     318.63      
1 1 1 25 9  36 o 10 137.363 2.69767 347.283     18.7651  325.106     18.3361  111.086    342.371     31.2473     342.371     
1 1 1 25 9  37 o 9  214.145 3.06619 820.142     31.1438  815.266     34.5652  157.684    39.6804     12.554      39.6803     
1 1 1 25 9  38 o 5  79.5786 3.23453 104.407     12.6101  122.812     13.0455  55.5207    45.4095     6.96313     45.4095     
1 1 1 25 9  39 o 17 74.0985 3.15219 102.63      10.6873  94.2115     12.445   60.8729    327.568     34.4997     327.568     
1 1 1 25 9  40 o 13 57.6225 3.60558 61.7535     9.78422  58.0808     10.7548  35.2181    267.834     3.11382     267.834     
1 1 1 25 9  41 o 1  74.5956 2.94534 101.37      10.4277  97.9089     11.4582  40.5583    337.282     18.276      157.282     
1 1 1 25 9  42 o 2  74.7219 3.00895 101.949     11.1026  98.1956     11.33    54.9966    76.716      11.6307     76.716      
1 1 1 25 9  43 o 5  52.5203 3.64782 55.2377     9.17029  44.9595     9.62804  34.1892    113.836     2.80251     113.836     
1 1 1 25 9  44 o 15 61.6086 3.30693 65.4307     9.87699  71.4334     10.3917  22.7483    187.604     37.8825     7.60388     
1 1 1 25 9  45 o 11 24.7329 5.68688 11.8752     7.58336  9.84199     8.66947  4.13288    205.529     7.61846     25.5294     
1 1 1 25 9  46 o 6  116.639 2.77181 252.841     15.0399  234.505     17.1456  74.1743    24.4978     12.7689     204.498     
1 1 1 25 9  47 o 9  19.4654 5.39773 7.8512      7.43364  -2.3283     9.01817  9.26908    24.8232     38.069      24.8232     
1 1 1 25 9  48 o 2  65.8928 3.58835 79.6476     11.5025  77.8971     11.9999  53.5968    87.7562     20.7874     87.7562     
1 1 1 25 9  49 o 10 115.831 2.92049 223.771     16.4163  259.081     17.4253  78.5626    146.349     1.65363     326.349     
1 1 1 25 9  50 o 19 24.8376 5.96364 8.81452     8.30787  13.1577     9.47089  4.78933    15.5678     38.4564     15.5678     
1 1 1 25 9  51 o 10 21.3588 5.60104 0.984053    8.30859  11.163      8.47973  0.0816924  75.4037     19.5551     255.404     
1 1 1 25 9  52 o 8  125.363 2.72581 284.29      17.0754  280.443     17.1323  96.2911    337.485     21.9196     337.485     
1 1 1 25 9  53 o 6  92.822  2.94474 151.133     13.6466  159.659     13.6721  66.0012    136.925     6.92455     136.925     
1 1 1 25 9  54 o 17 21.8819 5.56005 11.9009     7.82732  1.54595     8.80941  3.85324    147.678     4.96678     327.678     
1 1 1 25 9  55 o 18 22.8537 5.74569 12.3541     7.98104  3.41652     9.50708  4.4119     227.843     13.2286     47.8433     
1 1 1 25 9  56 f 0  94.8114 3.01584 151.305     13.297   174.389     15.3059  56.632     9.15186     0           0           
1 1 1 25 9  57 o 6  147.331 2.80462 364.858     20.2164  419.661     21.1385  118.076    263.04      37.6182     263.04      
1 1 1 25 9  58 o 14 38.0076 5.21354 25.9429     8.92154  30.3169     10.2352  20.0617    208.713     7.42506     28.7127     
1 1 1 25 9  59 o 4  23.8011 5.74434 6.83998     8.20912  13.7376     8.57652  9.56403    50.2446     4.39466     230.245     
1 1 1 25 9  60 o 18 36.4345 5.32934 29.0979     9.26538  23.452      9.55048  23.8906    49.0828     3.84799     49.0828     
1 1 1 25 9  61 o 1  67.3221 3.69195 93.6687     11.6609  75.108      12.7453  46.7845    249.537     5.59538     249.537     
1 1 1 25 9  62 o 18 19.7169 5.71731 6.88929     8.83273  -0.0171612  9.67314  0.334809   41.7292     0.0887962   221.729     
1 1 1 25 9  63 o 9  34.9703 6.12865 34.5838     10.7603  16.313      11.5798  21.0547    96.1197     0.971613    96.1197     
1 1 1 25 9  64 o 8  56.1215 4.45475 54.9669     12.4534  66.0111     11.9923  48.6222    230.231     27.6863     230.231     
1 1 1 25 9  65 o 7  27.8521 6.52632 10.2857     10.7117  21.2577     11.1629  11.6512    52.8026     6.36198     232.803     
1 1 1 25 9  66 o 15 18.1984 5.68666 -3.90574    10.2286  2.06937     10.3353  1.43       79.0362     5.97101     259.036     
1 1 1 25 9  67 o 2  27.6885 6.58393 11.2756     11.3497  19.7704     10.8045  5.63136    5.01719     20.7295     185.017     
1 1 1 25 9  68 f 0  44.3688 5.85601 34.8118     12.7534  46.013      12.1954  30.5725    283.916     0           0           
1 1 1 25 9  69 o 17 18.3124 5.73894 -3.12341    11.0098  1.19065     10.0501  1.27054    107.186     15.225      287.186     
1 1 1 25 9  70 o 18 53.6145 5.369   58.1925     14.7364  57.7282     13.247   27.5454    284.306     12.2606     104.306     
1 1 1 25 9  71 o 9  44.6345 6.66313 45.7744     13.5495  41.3529     15.2995  22.877     210.997     8.95443     30.9971     
1 1 1 25 9  72 o 2  36.3936 7.3027  25.5292     14.7978  36.8108     13.7156  21.3167    356.242     1.4661      356.242     
1 1 1 25 9  73 o 6  27.4981 7.59481 20.4149     16.4896  14.1705     13.7687  11.2786    356.972     2.84598     176.972     
1 1 1 25 9  74 o 8  18.2802 5.93841 -4.49422    12.2951  -1.22035    12.5844  0.685538   272.135     6.68024     92.1353     
1 1 1 25 9  75 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 10 0  o 7  441.164 4.11236 3456.23     90.8827  3456.23     90.8827  374.521    3.12061e-06 93.6496     3.12061e-06 
1 1 1 25 10 1  o 17 47.5663 3.62686 34.2774     8.01752  47.5984     8.93661  16.4683    350.31      84.4431     350.31      
1 1 1 25 10 2  o 5  112.016 2.53379 231.362     14.211   214.484     14.1851  28.4473    22.7412     100.888     202.741     
1 1 1 25 10 3  o 17 32.6058 4.62272 20.0151     7.49623  19.1716     7.08522  67.2356    77.944      170.334     77.944      
1 1 1 25 10 4  o 3  160.108 2.44163 443.246     19.9489  466.432     19.1968  107.666    16.8745     13.3491     196.875     
1 1 1 25 10 5  o 10 307.733 3.11253 1690.26     47.0732  1672.45     48.8999  236.697    343.344     21.5558     343.344     
1 1 1 25 10 6  o 10 238.067 2.7301  1018.99     32.5637  992.672     32.5751  184.324    102.629     21.9177     102.629     
1 1 1 25 10 7  o 13 345.931 3.40362 2135.46     60.1029  2115.77     57.896   266.517    268.018     24.1533     268.018     
1 1 1 25 10 8  o 2  143.416 2.39463 367.406     17.1922  362.372     17.2281  81.2546    230.882     41.6422     50.8823     
1 1 1 25 10 9  o 19 121.095 2.38693 266.838     14.4552  253.94      14.4797  71.3312    350.37      26.1703     170.37      
1 1 1 25 10 10 o 6  174.666 2.44763 542.008     21.416   540.559     21.4334  139.421    108.56      29.1718     108.56      
1 1 1 25 10 11 o 18 193.2   2.52915 675.676     24.9124  649.119     24.0647  131.8      353.558     15.8778     173.558     
1 1 1 25 10 12 f 0  144.668 2.44731 372.473     17.7308  370.213     17.7545  109.034    161.807     0           0           
1 1 1 25 10 13 o 4  157.815 2.4867  445.205     19.6224  438.69      19.7095  98.652     335.198     28.8362     155.198     
1 1 1 25 10 14 o 1  170.75  2.43615 526.385     20.8014  508.388     20.8845  113.202    205.077     19.1962     25.0773     
1 1 1 25 10 15 o 12 40.0285 4.03401 30.3301     7.93862  27.8474     7.78225  26.684     235.659     98.6498     235.659     
1 1 1 25 10 16 o 18 200.408 2.54904 708.154     26.0664  717.549     25.1189  177.399    176.08      66.5385     176.08      
1 1 1 25 10 17 o 14 218.013 2.71854 845.585     29.6231  842.098     29.7793  139.723    326.767     37.4879     146.767     
1 1 1 25 10 18 o 17 59.922  3.15756 58.2566     9.4466   70.3289     9.2954   24.644     49.313      19.8559     229.313     
1 1 1 25 10 19 o 17 67.8805 3.00426 82.2968     10.5927  82.0506     9.72602  17.9629    310.752     53.6984     130.752     
1 1 1 25 10 20 o 7  108.807 2.63569 216.185     14.2022  204.792     14.4818  73.8952    171.433     3.1595      351.434     
1 1 1 25 10 21 o 18 172.828 2.6919  539.807     23.2565  521.167     23.366   151.163    239.016     55.6264     239.016     
1 1 1 25 10 22 o 1  155.776 2.58099 438.647     19.4773  423.238     20.7713  92.1277    176.051     39.1578     356.051     
1 1 1 25 10 23 o 3  87.9945 2.8537  143.273     12.4397  132.575     12.6381  54.242     180.791     10.1544     0.791297    
1 1 1 25 10 24 o 5  188.279 2.70233 651.27      25.3633  608.66      25.6013  135.337    323.559     0.0522964   143.555     
1 1 1 25 10 25 o 7  77.8336 2.96595 103.638     11.2712  112.479     11.7818  46.2666    292.124     9.79104     112.124     
1 1 1 25 10 26 o 16 233.33  2.86508 992.258     32.6323  943.718     34.2925  193.83     156.703     51.5621     156.703     
1 1 1 25 10 27 o 5  106.15  2.75418 204.983     14.6056  196.184     14.6409  101.133    194.933     63.8935     194.933     
1 1 1 25 10 28 o 11 65.443  3.17096 77.3733     10.0216  75.7904     10.6342  13.2217    221.767     60.9583     41.7675     
1 1 1 25 10 29 o 16 28.283  5.41969 13.7146     7.60572  16.0112     8.15019  11.4428    264.918     44.8475     264.918     
1 1 1 25 10 30 o 18 113.727 2.65208 222.662     14.6086  237.924     15.5843  57.9325    293.94      43.8852     113.94      
1 1 1 25 10 31 o 9  69.4334 3.26458 87.9192     10.7564  84.6674     11.7837  49.4614    67.3672     31.5665     67.3672     
1 1 1 25 10 32 o 8  201.395 3.13451 713.413     28.6295  732.125     34.4408  169.57     185.286     52.2917     185.286     
1 1 1 25 10 33 o 13 85.6335 3.0711  127.938     12.2365  134.131     14.011   64.0843    99.1947     14.1088     99.1947     
1 1 1 25 10 34 o 13 77.7046 3.20539 110.129     11.5832  106.027     13.1811  66.5224    136.795     39.826      136.795     
1 1 1 25 10 35 o 18 24.3678 5.39414 1.69387     8.10307  17.3472     8.23304  9.29663    162.493     33.6241     162.493     
1 1 1 25 10 36 o 1  133.565 2.73093 312.427     18.4773  323.883     18.0276  132.9      183.424     83.2007     183.424     
1 1 1 25 10 37 o 10 35.474  4.89699 21.8163     8.81635  25.1292     7.92765  5.06942    103.377     19.2724     283.377     
1 1 1 25 10 38 o 4  179.723 2.59381 597.161     23.7192  554.305     23.0009  135.999    113.279     18.8293     113.279     
1 1 1 25 10 39 o 6  20.8489 5.49205 0.682195    8.01686  9.99689     8.10137  6.59572    37.009      22.6543     37.009      
1 1 1 25 10 40 o 18 45.3556 4.40759 35.6318     9.90117  39.9605     9.54532  13.1697    8.68668     86.6132     8.68668     
1 1 1 25 10 41 o 2  131.64  2.78106 315.576     17.8603  303.855     18.7578  110.532    256.444     37.677      256.444     
1 1 1 25 10 42 o 4  52.6883 3.95856 51.9736     9.57026  49.1221     10.9041  41.0796    320.062     15.897      320.062     
1 1 1 25 10 43 o 5  56.9562 3.73146 57.4729     9.66851  60.2947     11.3511  43.5408    18.0208     13.1726     18.0208     
1 1 1 25 10 44 o 1  41.5031 4.66896 28.9558     8.5086   35.307      10.2863  28.5965    32.8786     14.3335     32.8786     
1 1 1 25 10 45 o 9  46.9878 4.51373 37.3627     10.407   44.4755     10.1994  36.873     277.916     19.0374     277.916     
1 1 1 25 10 46 o 7  67.3702 3.43143 77.8802     11.1083  86.5729     11.9111  41.0717    189.365     8.8037      9.36495     
1 1 1 25 10 47 o 7  97.2417 2.96453 164.224     13.904   176.068     14.9258  73.611     326.831     14.0507     326.831     
1 1 1 25 10 48 o 4  31.1633 5.74192 21.2873     9.29424  16.3339     8.88753  10.5718    162.554     14.989      342.554     
1 1 1 25 10 49 o 19 57.3259 3.64    58.0829     10.1735  61.8945     10.5183  41.7771    354.207     8.53855     354.207     
1 1 1 25 10 50 o 7  23.3178 5.66141 4.42914     8.12948  13.7547     8.50425  3.31014    192.72      16.1678     12.7204     
1 1 1 25 10 51 o 18 33.7752 5.29555 20.3838     8.23436  23.6754     9.23216  15.4225    323.621     9.36841     143.621     
1 1 1 25 10 52 o 2  69.1443 3.30722 85.9727     10.6523  87.6914     12.0947  41.6136    46.4375     9.44338     226.438     
1 1 1 25 10 53 o 1  141.163 2.66936 350.391     18.2186  366.33      19.5141  102.904    318.451     13.1639     318.451     
1 1 1 25 10 54 o 16 61.3197 3.68786 74.2513     10.269   63.8368     11.9025  38.1168    215.601     5.0331      35.6009     
1 1 1 25 10 55 o 2  34.0079 5.50107 18.1921     8.60311  27.4612     9.8416   20.4155    85.6629     12.9189     85.6629     
1 1 1 25 10 56 o 10 64.6649 3.77625 76.9544     10.8644  77.2758     13.2496  47.1699    133.345     8.80426     133.345     
1 1 1 25 10 57 o 2  41.9027 5.01872 27.9231     9.61011  40.3961     10.6597  22.0788    76.3257     9.54717     256.326     
1 1 1 25 10 58 o 19 79.5451 3.23155 112.413     12.2993  119.26      13.3566  56.7272    269.791     7.57744     269.791     
1 1 1 25 10 59 o 6  35.8247 5.52967 23.6899     9.17604  27.7082     10.1329  20.3597    140.486     3.49455     320.486     
1 1 1 25 10 60 o 4  44.6897 4.90891 45.7372     9.99978  32.3918     10.8307  24.6748    175.643     7.84732     355.643     
1 1 1 25 10 61 o 6  16.6104 4.99141 -8.74741    7.88159  6.05583     7.96631  1.52847    257.688     5.43008     77.6876     
1 1 1 25 10 62 o 6  27.1952 6.01253 17.0628     8.92101  12.909      9.44748  4.39168    357.921     23.7248     177.921     
1 1 1 25 10 63 o 18 51.7722 4.64143 53.5924     12.5266  50.2434     10.9951  28.1286    297.346     9.99948     117.346     
1 1 1 25 10 64 f 0  23.7757 5.90413 0.673088    9.46146  18.1043     9.85093  10.085     239.448     0           0           
1 1 1 25 10 65 o 18 18.7315 5.7045  3.30689     10.4413  -0.0569656  8.93734  0.963768   193.818     14.1477     13.8181     
1 1 1 25 10 66 o 1  75.0685 4.01978 112.298     15.1309  101.101     14.8661  47.2513    117.814     2.54987     297.815     
1 1 1 25 10 67 o 8  55.3902 5.57697 61.4634     16.0156  61.9252     13.9337  42.6234    223.459     15.8191     223.459     
1 1 1 25 10 68 o 8  32.2548 7.14207 18.4962     12.5339  27.6297     13.3918  21.3468    204.607     10.5049     204.607     
1 1 1 25 10 69 o 17 52.4894 5.58158 45.667      13.9308  67.7476     14.0136  41.277     52.4946     17.8697     52.4946     
1 1 1 25 10 70 f 0  28.6477 6.97347 14.5481     12.6079  21.4978     12.0205  18.8704    138.259     0           0           
1 1 1 25 10 71 o 15 32.1556 7.27554 27.4687     13.0216  21.5204     13.7649  17.9651    27.0716     1.75445     27.0716     
1 1 1 25 10 72 o 12 20.4487 6.26402 -5.72766    12.6122  9.84916     12.2021  3.10958    282.364     3.79457     102.364     
1 1 1 25 10 73 o 12 36.8017 7.38862 32.6126     14.427   34.3543     14.1153  22.6372    168.899     8.85748     168.899     
1 1 1 25 10 74 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 11 0  o 15 245.567 2.77862 1070.31     34.1751  1070.31     34.1751  202.422    180         39.4521     180         
1 1 1 25 11 1  o 14 166.939 2.52322 507.815     21.0725  481.5       21.1331  143.999    345.84      49.1259     345.84      
1 1 1 25 11 2  o 16 29.5811 5.00342 20.9328     7.2908   11.5654     7.61478  20.8981    122.056     61.4489     122.056     
1 1 1 25 11 3  o 12 137.568 2.47404 340.303     17.3675  331.825     16.7173  53.8631    112.629     90.7673     292.629     
1 1 1 25 11 4  o 10 101.331 2.56147 175.923     13.4286  189.125     12.4783  52.2657    271.196     35.9641     91.1955     
1 1 1 25 11 5  o 2  107.679 2.53156 205.738     13.0706  206.266     14.1911  40.8569    201.14      70.4877     21.1396     
1 1 1 25 11 6  o 12 93.2464 2.56945 154.857     12.0212  154.254     11.9468  72.3333    350.065     26.2163     350.065     
1 1 1 25 11 7  o 14 141.616 2.36577 367.254     16.7826  344.652     16.7841  85.9417    64.0791     31.3466     244.079     
1 1 1 25 11 8  o 5  174.474 2.4787  545.095     21.3568  535.421     21.9774  139.773    244.552     27.7627     244.552     
1 1 1 25 11 9  f 0  262.992 2.90132 1253.43     38.9548  1203.38     37.5257  217.813    155.371     0           0           
1 1 1 25 11 10 o 2  86.4662 2.59366 135.443     11.2265  130.483     11.1975  46.3708    149.998     23.9955     329.998     
1 1 1 25 11 11 o 17 191.506 2.52581 661.416     24.2131  640.605     24.2625  138.019    141.22      2.58746     321.221     
1 1 1 25 11 12 o 4  179.043 2.57551 577.806     23.5454  560.378     22.6736  131.887    338.886     4.14655     338.886     
1 1 1 25 11 13 o 1  120.282 2.47723 256.163     14.6245  257.88      15.2044  73.8373    200.316     23.1487     20.3162     
1 1 1 25 11 14 o 9  213.795 2.63845 810.942     28.2231  812.183     28.3143  118.485    301.811     75.9511     121.811     
1 1 1 25 11 15 o 12 191.692 2.65259 652.839     24.9485  652.134     26.0039  148.147    164.919     17.9783     164.919     
1 1 1 25 11 16 o 4  30.524  4.96523 11.6869     7.56911  23.2027     7.58677  4.872      359.389     23.0548     359.389     
1 1 1 25 11 17 o 4  284.204 3.0611  1441.75     44.3767  1429.5      42.8117  237.585    94.3069     59.2837     94.3069     
1 1 1 25 11 18 o 18 233.127 2.66459 970.947     31.0602  959.736     31.1986  194.658    36.7614     49.9273     36.7614     
1 1 1 25 11 19 f 0  130.061 2.52251 301.853     16.5981  299.421     16.2532  48.0073    326.586     0           0           
1 1 1 25 11 20 o 17 290.331 3.09313 1511.77     46.6506  1486.12     43.3212  255.152    327.829     86.6966     327.829     
1 1 1 25 11 21 o 4  76.5294 2.9733  103.322     11.4984  105.569     11.2143  27.7176    29.2542     48.9347     209.254     
1 1 1 25 11 22 o 16 151.191 2.51918 410.528     19.7755  401.624     18.3873  135.763    249.141     57.1051     249.141     
1 1 1 25 11 23 o 8  120.147 2.63782 258.919     16.6963  254.629     14.997   93.3174    149.376     18.2358     149.376     
1 1 1 25 11 24 o 18 65.3417 3.26929 85.4259     10.0463  67.8503     10.9725  43.9106    200.552     13.314      200.552     
1 1 1 25 11 25 o 3  105.959 2.6354  202.797     13.751   196.87      14.1813  34.6845    344.12      80.8714     164.12      
1 1 1 25 11 26 o 14 111.89  2.65608 232.935     14.3335  212.975     15.3257  104.455    23.4495     56.8409     23.4495     
1 1 1 25 11 27 o 12 116.708 2.67965 238.569     15.456   246.453     15.8484  83.7718    93.5905     3.73877     93.5905     
1 1 1 25 11 28 o 8  30.5168 5.70595 17.4469     8.47964  17.3291     9.2448   4.17762    68.0804     31.4268     68.0804     
1 1 1 25 11 29 o 14 77.5488 3.02152 117.022     11.4382  98.2766     11.8439  37.5945    148.11      30.4978     328.11      
1 1 1 25 11 30 o 8  42.9516 4.40066 39.4971     9.10653  28.4349     9.07835  11.7702    85.8832     23.6173     265.883     
1 1 1 25 11 31 o 7  112.743 2.749   241.082     16.0302  212.593     14.9892  65.1397    247.567     28.2641     67.5665     
1 1 1 25 11 32 o 9  89.0524 2.90853 143.105     13.0858  140.204     12.8046  63.3636    345.377     5.77264     345.377     
1 1 1 25 11 33 o 10 148.055 2.66543 393.304     20.2762  387.892     19.2519  111.315    220.557     13.3042     220.557     
1 1 1 25 11 34 o 19 33.7476 5.48732 16.3151     8.26855  27.1259     10.0504  3.77133    27.313      14.0857     207.313     
1 1 1 25 11 35 o 13 54.2863 4.2178  57.5754     10.3334  49.7507     11.9561  29.6259    171.063     5.2011      351.063     
1 1 1 25 11 36 o 13 33.5147 5.63344 20.7286     8.31261  21.7114     10.3452  4.18876    266.741     45.8052     266.741     
1 1 1 25 11 37 o 6  77.1792 3.18831 112.797     11.476   101.119     12.9194  50.7215    285.129     2.94568     105.129     
1 1 1 25 11 38 o 8  38.0278 4.96271 25.1754     8.27399  28.9153     9.95077  8.69815    76.8857     3.06001     76.8857     
1 1 1 25 11 39 o 11 67.8372 3.16685 81.7126     10.011   83.7573     11.3696  18.5202    40.1481     56.7361     220.148     
1 1 1 25 11 40 o 5  39.6438 4.83776 27.2947     9.13325  31.3983     9.38373  7.86057    303.904     35.9898     123.904     
1 1 1 25 11 41 o 16 30.1018 5.83366 16.6429     9.38401  17.8113     8.75868  7.85478    202.304     18.4069     22.3041     
1 1 1 25 11 42 o 1  87.5362 3.25645 135.486     14.8459  140.459     13.5641  87.9542    161.443     58.0237     161.443     
1 1 1 25 11 43 o 8  64.0023 3.57812 78.1393     11.9081  70.5123     10.8654  48.4822    46.8361     11.325      46.8361     
1 1 1 25 11 44 o 5  24.9712 5.92109 17.6247     9.95512  3.44203     8.62055  5.15618    22.3865     12.4298     202.386     
1 1 1 25 11 45 o 17 94.2483 2.84897 151.523     13.1952  167.98      13.6472  72.9566    227.21      16.173      227.21      
1 1 1 25 11 46 f 0  42.4387 4.39699 33.8586     8.58416  33.2263     9.52142  13.9186    207.521     0           0           
1 1 1 25 11 47 o 4  84.8023 3.02836 126.086     12.0222  133.428     13.6198  63.2228    134.266     10.6072     134.266     
1 1 1 25 11 48 o 9  48.1457 4.22081 39.5837     9.35477  46.4634     10.5899  23.999     271.415     15.3446     91.4149     
1 1 1 25 11 49 o 18 60.3307 3.64938 69.0403     10.2222  64.0411     11.5146  38.1498    23.5551     4.32265     203.555     
1 1 1 25 11 50 f 0  71.6574 3.33421 100.169     11.1042  86.6092     12.4962  59.1984    345.804     0           0           
1 1 1 25 11 51 o 13 132.285 2.82097 305.715     17.035   324.958     20.2641  110.662    195.864     39.9631     195.864     
1 1 1 25 11 52 o 13 38.1323 5.39901 42.4694     8.93221  15.1812     10.9686  21.8251    179.985     3.68051     359.985     
1 1 1 25 11 53 o 18 65.9674 3.65642 80.2452     10.9654  79.4057     12.9079  33.9833    97.2203     20.8296     277.22      
1 1 1 25 11 54 o 1  49.5652 4.45081 48.3714     10.2328  44.0833     11.2541  28.2817    336.832     8.64252     156.832     
1 1 1 25 11 55 o 3  115.246 2.89013 237.845     15.7216  243.619     17.5741  101.223    244.775     46.3975     244.775     
1 1 1 25 11 56 o 10 80.9997 3.47697 112.835     13.8594  128.634     14.2073  62.6987    11.8262     16.8611     11.8262     
1 1 1 25 11 57 o 16 31.7563 5.81836 19.0593     8.99173  21.7955     9.68558  19.823     119.457     2.61996     119.457     
1 1 1 25 11 58 o 2  18.727  5.31496 8.435       7.99336  -3.60609    8.41449  0.981817   153.883     17.4662     333.884     
1 1 1 25 11 59 o 7  16.8679 5.1768  -0.458836   7.99367  0.849729    8.24288  0.875937   356.229     12.4241     176.229     
1 1 1 25 11 60 o 11 46.2224 4.59052 34.536      10.015   48.6384     10.4577  25.8645    58.886      7.69611     238.886     
1 1 1 25 11 61 o 10 35.6941 5.64476 24.0802     9.60396  28.0209     10.0976  20.3406    176.357     2.52251     356.357     
1 1 1 25 11 62 o 7  31.411  5.78511 15.4782     9.29082  25.5303     9.44797  11.1567    136.767     15.4107     316.767     
1 1 1 25 11 63 o 10 67.1073 3.83174 73.5076     13.0071  96.8721     12.1504  44.0893    52.6453     1.1659      52.6453     
1 1 1 25 11 64 o 18 18.286  5.65289 -6.86465    10.7711  4.47407     9.71028  1.40285    202.51      12.4291     22.5105     
1 1 1 25 11 65 o 17 32.9881 6.42945 20.9673     12.3837  25.1482     9.8912   20.4282    235.915     3.38537     235.915     
1 1 1 25 11 66 o 8  45.2814 6.53324 25.06       15.4216  64.4477     13.6457  36.3963    59.9664     18.1617     59.9664     
1 1 1 25 11 67 o 7  53.9299 5.16165 61.6642     13.757   54.6515     13.3999  38.3321    98.9239     8.59046     98.9239     
1 1 1 25 11 68 f 0  26.6946 6.58821 23.3866     12.076   5.00786     11.247   10.9445    30.1144     0           0           
1 1 1 25 11 69 o 3  39.6946 6.71338 34.9339     13.1822  35.6935     13.1679  23.7303    280.282     0.0868051   100.282     
1 1 1 25 11 70 o 3  20.4076 6.1726  8.54288     11.8595  -0.462768   10.8496  4.25449    128.17      6.39061     308.17      
1 1 1 25 11 71 o 6  30.65   7.28333 19.9567     13.5339  25.9097     13.1397  10.8567    259.989     12.3083     79.9891     
1 1 1 25 11 72 o 12 16.073  5.394   -2.7383     11.8893  -17.5462    12.0006  0.675488   136.742     6.10687     136.742     
1 1 1 25 11 73 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 12 0  o 4  220.497 2.76431 863.252     30.5241  863.252     30.5241  183.408    180         38.1843     180         
1 1 1 25 12 1  o 18 198.158 2.54986 699.03      25.3181  695.199     25.3247  82.0851    151.828     127.94      331.828     
1 1 1 25 12 2  o 4  190.937 2.58294 653.864     24.2073  640.701     25.201   184.797    125.755     92.4189     125.755     
1 1 1 25 12 3  o 6  79.0597 2.8543  104.83      11.2616  117.986     11.2493  46.753     146.028     12.198      326.028     
1 1 1 25 12 4  o 11 168.399 2.43063 520.626     20.5091  486.411     20.4985  168.287    311.875     94.9871     311.875     
1 1 1 25 12 5  o 4  98.6082 2.59342 173.646     12.7992  172.121     12.7876  33.9586    38.2764     72.5578     218.276     
1 1 1 25 12 6  o 14 91.6078 2.57848 144.294     11.7804  154.264     11.8389  64.8568    248.018     4.90136     248.018     
1 1 1 25 12 7  o 1  157.728 2.53455 459.345     19.6044  424.404     20.4007  156.169    277.351     87.3411     277.351     
1 1 1 25 12 8  o 11 200.999 2.52123 721.773     25.8204  712.857     24.9691  173.139    357.175     52.7071     357.175     
1 1 1 25 12 9  o 13 86.2736 2.7     133.711     11.311   131.206     11.9617  54.4141    309.128     8.69367     129.128     
1 1 1 25 12 10 o 19 40.8791 4.13794 32.1712     8.12005  28.6309     8.31145  0.677071   24.4121     40.1751     204.412     
1 1 1 25 12 11 o 6  39.1479 4.24987 23.3504     7.98645  32.9469     7.97416  2.89151    68.0629     7.31143     248.063     
1 1 1 25 12 12 o 16 62.6475 3.32701 71.1024     10.2757  69.3114     10.4573  7.54814    119.329     69.2288     299.329     
1 1 1 25 12 13 f 0  301.24  3.14585 1603.99     46.5501  1623.52     48.4236  205.929    336.14      0           0           
1 1 1 25 12 14 o 7  141.541 2.47416 359.065     17.4865  352.75      17.5967  100.744    40.8238     2.29784     220.824     
1 1 1 25 12 15 o 13 95.4439 2.55507 157.53      12.1135  166.627     12.2814  58.1942    27.3401     16.6542     207.34      
1 1 1 25 12 16 o 12 152.997 2.54491 418.758     19.0996  412.908     19.9107  96.9247    93.1291     27.7538     273.129     
1 1 1 25 12 17 o 14 159.638 2.47559 460.597     19.7166  444.828     19.8856  138.213    289.246     46.877      289.246     
1 1 1 25 12 18 o 15 37.8358 4.35803 24.5591     7.93673  27.9215     8.00372  15.0181    51.8767     74.7707     51.8767     
1 1 1 25 12 19 o 3  27.1878 5.35349 9.42983     7.95659  17.5361     7.59614  5.77438    153.887     23.308      153.887     
1 1 1 25 12 20 o 15 69.3404 2.98119 83.1188     10.3262  88.6296     10.2847  42.7       150.598     4.14371     330.598     
1 1 1 25 12 21 o 8  128.616 2.50645 303.411     15.8555  285.138     16.3909  82.1117    222.489     19.8377     42.4891     
1 1 1 25 12 22 o 3  92.9356 2.70831 162.956     12.2903  145.013     12.8125  47.1129    116.249     36.0474     296.249     
1 1 1 25 12 23 o 10 24.5386 5.73106 14.053      8.88406  6.51386     7.80674  1.53578    293.19      5.64502     293.19      
1 1 1 25 12 24 f 0  115.942 2.88705 233.189     16.3556  246.042     17.1444  91.2497    110.438     0           0           
1 1 1 25 12 25 o 15 49.712  4.17048 50.4964     10.7279  39.5057     9.62842  13.5615    229.16      34.8543     49.1595     
1 1 1 25 12 26 o 13 117.821 2.9053  248.163     17.7278  246.903     16.509   92.6854    30.2666     19.3257     30.2666     
1 1 1 25 12 27 o 3  90.7372 3.10446 146.953     14.4158  147.3       13.7239  64.716     31.8502     4.57818     31.8502     
1 1 1 25 12 28 o 17 91.3725 3.0218  145.063     14.0607  153.343     13.5062  86.0109    14.8764     53.0944     14.8764     
1 1 1 25 12 29 o 12 64.0302 3.37112 71.3395     11.042   75.9729     10.3949  45.005     330.966     11.0567     330.966     
1 1 1 25 12 30 o 14 92.9923 2.76223 155.784     12.5381  152.987     13.136   54.6273    272.995     20.0362     92.9948     
1 1 1 25 12 31 o 7  54.6812 3.86531 63.0212     10.1199  45.9111     10.4682  17.3666    54.7788     36.0671     234.779     
1 1 1 25 12 32 o 5  97.3673 2.74767 173.568     13.0883  165.095     13.6452  74.8759    286.407     15.9996     286.407     
1 1 1 25 12 33 o 14 59.3672 3.41642 65.6368     10.417   61.3773     9.7389   35.5301    359.02      4.61581     179.02      
1 1 1 25 12 34 o 5  124.128 2.61636 272.174     16.1563  277.759     16.358   100.662    213.936     26.7011     213.936     
1 1 1 25 12 35 f 0  124.547 2.69698 266.017     15.8734  288.291     17.7558  54.0541    18.3303     0           0           
1 1 1 25 12 36 o 16 43.6582 4.17698 40.1449     8.71932  30.1334     8.88516  27.4382    158.729     13.2385     158.729     
1 1 1 25 12 37 o 13 35.4969 5.34832 26.3275     9.19455  21.4108     9.26224  2.62572    240.823     51.8114     240.823     
1 1 1 25 12 38 o 14 109.674 2.86206 212.786     15.7956  218.085     15.6064  102.416    0.917007    51.4895     0.917007    
1 1 1 25 12 39 o 10 35.2008 5.33817 19.65       9.02954  27.6324     9.28204  8.33372    119.054     27.9597     299.054     
1 1 1 25 12 40 o 4  38.0379 4.89527 26.5702     9.08846  27.8179     8.8816   8.45592    7.97714     32.6024     187.977     
1 1 1 25 12 41 f 0  80.8688 3.22862 116.5       12.1102  119.363     13.9059  50.8525    240.836     0           0           
1 1 1 25 12 42 o 1  55.6803 3.748   61.2067     9.47514  52.0757     10.922   39.5182    259.72      5.05951     259.72      
1 1 1 25 12 43 o 6  76.0113 3.43999 107.757     12.6566  101.685     13.37    71.0503    167.327     39.7566     167.327     
1 1 1 25 12 44 o 7  44.3492 4.9894  28.5268     9.6828   46.7197     11.6905  31.7982    115.35      8.4133      115.35      
1 1 1 25 12 45 o 13 78.2527 3.48663 114.291     12.3294  108.141     14.6797  65.3537    28.0401     24.1309     28.0401     
1 1 1 25 12 46 o 10 88.02   3.24552 132.641     13.0472  148.091     15.4805  48.0188    318.169     25.7277     138.169     
1 1 1 25 12 47 o 12 50.7407 4.59483 34.9212     10.178   63.3309     12.3592  40.5075    334.887     16.0935     334.887     
1 1 1 25 12 48 o 10 66.6712 3.62057 80.857      11.2254  81.5158     12.7331  49.4201    0.650571    9.02948     0.650571    
1 1 1 25 12 49 o 15 76.429  3.22531 90.6219     11.182   122.65      13.4386  60.9267    178.414     18.3452     178.414     
1 1 1 25 12 50 o 13 53.2303 3.98047 50.5141     9.70737  54.3149     11.1922  43.7966    248.482     18.611      248.482     
1 1 1 25 12 51 o 10 73.8006 3.33892 101.34      11.3872  97.2141     13.0697  45.0226    324.138     10.3047     144.138     
1 1 1 25 12 52 o 3  113.063 2.76575 222.653     14.9771  239.356     16.3214  82.1263    151.917     9.23324     151.917     
1 1 1 25 12 53 o 9  94.8547 3.07844 160.469     14.1578  166.881     15.0306  67.3401    57.437      5.37483     57.4369     
1 1 1 25 12 54 o 3  13.0133 4.30542 -1.17318    7.3234   -18.819     7.73305  3.03557    262.9       14.7892     262.9       
1 1 1 25 12 55 f 0  14.652  4.72926 -3.79902    7.6614   -4.1336     7.77231  14.3454    174.959     0           0           
1 1 1 25 12 56 o 13 17.1504 5.28052 -5.21639    8.20613  3.72971     9.15617  2.44093    223.256     4.67294     43.2557     
1 1 1 25 12 57 o 10 28.1065 6.16822 19.4198     10.1546  12.9214     9.1786   8.84457    88.2274     16.4045     268.227     
1 1 1 25 12 58 f 0  55.4386 3.92427 55.7704     10.5934  60.1873     10.9162  40.8448    135.052     0           0           
1 1 1 25 12 59 o 18 20.5245 5.70659 4.59974     8.6222   7.49841     8.6454   3.471      110.2       14.1015     290.2       
1 1 1 25 12 60 f 0  40.8501 5.20907 23.1437     10.0606  44.9415     10.1113  32.025     295.594     0           0           
1 1 1 25 12 61 o 4  25.999  5.94687 8.87621     9.15577  18.1329     9.13466  8.29708    300.334     12.2506     120.334     
1 1 1 25 12 62 o 18 25.2189 6.14106 15.3863     9.72639  9.88494     9.24473  10.5921    232.14      1.02175     52.1402     
1 1 1 25 12 63 o 8  42.3355 5.61258 45.0528     12.5929  28.8888     10.4002  33.1401    0.14826     15.6801     0.14826     
1 1 1 25 12 64 o 4  41.3082 5.97934 30.6832     13.1372  40.1657     10.6445  33.4122    71.8231     18.032      71.8231     
1 1 1 25 12 65 o 6  15.7102 5.17777 -9.88181    11.2065  -4.08438    8.91524  1.01692    282.815     2.4557      102.815     
1 1 1 25 12 66 o 7  26.4206 6.77745 2.92458     14.4653  20.9279     11.405   13.849     349.701     1.29521     349.701     
1 1 1 25 12 67 o 11 32.0743 6.94796 14.3566     13.3686  31.7356     12.6564  19.2981    91.7851     2.3425      91.7851     
1 1 1 25 12 68 o 15 25.8956 6.89809 19.0446     13.188   9.40564     11.4283  10.8371    25.9113     4.57909     205.911     
1 1 1 25 12 69 o 7  46.2521 6.37199 51.5965     14.9477  43.9288     13.5456  32.2612    52.9589     8.95084     52.959      
1 1 1 25 12 70 o 14 43.2171 7.50359 44.1927     19.2707  48.0448     13.551   26.2657    277.859     1.63054     277.859     
1 1 1 25 12 71 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 13 0  o 4  78.3352 2.71348 109.66      10.5938  109.66      10.5938  68.5623    6.13105e-05 47.4908     6.13105e-05 
1 1 1 25 13 1  o 15 66.7314 2.9425  85.7321     9.76739  73.4473     9.76792  1.18562    143.752     95.2481     143.752     
1 1 1 25 13 2  o 15 78.7761 2.77752 108.999     10.8818  112.123     10.9787  52.2276    41.8533     0.933164    221.853     
1 1 1 25 13 3  o 17 178.26  2.64061 566.906     23.5148  562.224     23.663   145.967    271.456     31.2169     271.456     
1 1 1 25 13 4  o 9  136.268 2.53221 340.249     17.2121  320.04      17.3266  133.674    150.105     74.5204     150.105     
1 1 1 25 13 5  o 18 113.111 2.50803 232.371     14.1739  222.631     14.2182  56.5711    272.237     49.8455     92.2369     
1 1 1 25 13 6  o 6  246.646 2.84041 1094.07     35.7079  1068.75     34.51    237.262    115.785     111.458     115.785     
1 1 1 25 13 7  o 11 85.7232 2.65705 131.573     11.3982  130.076     11.3752  24.2487    22.8136     73.0211     202.814     
1 1 1 25 13 8  o 12 106.438 2.44257 204.459     12.9818  198.428     13.0381  59.3244    182.24      33.4732     2.24024     
1 1 1 25 13 9  o 11 60.376  3.12091 65.2408     9.34571  65.1428     9.40944  26.9831    99.7052     23.0784     279.705     
1 1 1 25 13 10 o 17 30.6434 5.12424 19.2603     7.78067  15.7515     7.73733  19.9964    210.845     71.8249     210.845     
1 1 1 25 13 11 o 16 173.377 2.61661 542.716     23.6393  525.724     21.8183  145.481    140.928     38.3975     140.928     
1 1 1 25 13 12 o 2  205.532 2.67576 753.986     27.0145  747.723     28.0909  163.289    134.952     25.0721     134.952     
1 1 1 25 13 13 o 6  195.648 2.63469 682.19      26.2614  678.532     25.3984  148.253    153.529     9.83061     153.529     
1 1 1 25 13 14 o 16 80.8826 2.89226 121.08      11.3449  112.321     11.9788  40.6956    271.96      30.7326     91.9597     
1 1 1 25 13 15 o 17 114.001 2.47487 234.67      14.0803  227.687     14.1606  109.851    269.565     62.3233     269.565     
1 1 1 25 13 16 o 19 72.8207 2.96789 88.3211     11.017   101.255     10.4652  28.2896    228.078     43.737      48.0781     
1 1 1 25 13 17 o 16 213.159 2.5851  826.265     27.5471  789.588     27.6687  170.205    129.373     28.3611     129.373     
1 1 1 25 13 18 o 18 112.304 2.61367 232.155     14.586   217.012     14.7735  85.2916    138.742     11.3866     138.742     
1 1 1 25 13 19 o 15 70.989  3.2596  91.5297     11.7962  88.8561     11.2706  5.33666    236.622     88.8733     56.6224     
1 1 1 25 13 20 o 10 142.32  2.84997 372.19      20.7355  349.697     19.8799  107.477    49.2041     9.77062     49.2042     
1 1 1 25 13 21 o 5  56.9768 3.72407 62.616      10.4251  54.4896     10.5456  15.7132    27.1767     44.3509     207.177     
1 1 1 25 13 22 o 2  149.62  2.81547 400.033     21.5679  397.767     20.6072  105.856    285.595     4.57495     105.595     
1 1 1 25 13 23 o 1  72.9543 3.5891  105.684     12.5609  85.9235     13.3074  50.8041    170.926     4.5461      170.926     
1 1 1 25 13 24 o 11 107.045 2.85782 204.11      15.7126  204.816     14.8806  69.2314    251.486     13.3762     71.4857     
1 1 1 25 13 25 o 5  134.525 2.59808 319.333     17.0524  325.601     17.9412  125.553    170.975     60.5475     170.975     
1 1 1 25 13 26 o 6  106.414 2.65537 198.047     14.287   205.929     13.978   84.5178    190.054     19.9564     190.054     
1 1 1 25 13 27 o 12 40.3619 4.33794 27.0368     8.55221  32.9653     8.35438  11.2175    150.203     19.8279     330.203     
1 1 1 25 13 28 o 10 121.733 2.61566 269.733     15.2834  258.919     16.5364  112.324    33.1302     54.2263     33.1302     
1 1 1 25 13 29 o 5  44.3967 4.04888 37.2942     8.79556  34.6819     8.79072  5.29449    260.437     1.79919     260.437     
1 1 1 25 13 30 o 1  20.1185 5.37927 0.0112661   7.38658  9.44318     8.15387  8.22348    196.756     25.8631     196.756     
1 1 1 25 13 31 o 18 195.457 2.77937 686.417     27.0813  677.234     27.3639  121.774    195.194     38.5593     15.1943     
1 1 1 25 13 32 o 19 113.922 2.92166 233.461     17.4043  230.912     15.8717  69.4271    103.509     23.3488     283.509     
1 1 1 25 13 33 o 4  42.0985 5.08402 26.4351     10.5341  40.309      9.7745   18.4127    182.49      10.3514     182.49      
1 1 1 25 13 34 o 6  100.624 3.04556 177.387     14.3382  185.738     16.2809  67.8913    72.193      6.99477     252.193     
1 1 1 25 13 35 o 6  25.0365 5.85285 13.1347     8.25553  8.7215      9.05994  3.15572    357.489     18.5286     177.489     
1 1 1 25 13 36 o 4  15.5354 4.84875 -7.21606    7.60047  1.27795     7.6482   21.5318    331.033     59.3906     331.033     
1 1 1 25 13 37 o 2  15.4142 4.78677 2.1299      7.61769  -7.82131    7.21427  12.9302    21.3955     39.4998     21.3955     
1 1 1 25 13 38 o 16 57.3786 3.55522 55.8984     9.63948  63.8068     10.6076  33.7519    191.741     10.7555     11.741      
1 1 1 25 13 39 o 18 48.6312 3.96471 39.6386     9.20384  47.3248     9.74459  35.268     142.398     7.4551      142.398     
1 1 1 25 13 40 f 0  18.3083 5.24411 1.58535     7.34635  4.2523      7.66642  11.1407    345.741     0           0           
1 1 1 25 13 41 o 16 27.8727 5.65614 16.1572     7.94018  13.4604     8.78305  7.54149    203.895     1.12843     203.895     
1 1 1 25 13 42 o 12 142.46  2.80845 356.948     19.0942  372.642     20.9556  111.532    197.718     22.2022     197.718     
1 1 1 25 13 43 o 11 17.6855 5.24157 -1.3562     7.3969   3.99273     8.38618  0.764824   191.266     11.2896     191.266     
1 1 1 25 13 44 o 11 83.261  3.06319 127.148     12.0859  123.446     13.3326  67.6916    142.43      20.619      142.43      
1 1 1 25 13 45 o 12 62.8471 3.47762 71.7237     10.3153  72.2924     11.389   48.7518    133.609     12.7405     133.609     
1 1 1 25 13 46 o 17 52.7058 4.08351 52.0306     11.4577  50.7212     9.68712  34.1388    169.649     2.04952     349.649     
1 1 1 25 13 47 o 5  58.7951 3.87653 55.8765     11.1807  71.8716     11.242   40.3275    310.088     1.53317     310.088     
1 1 1 25 13 48 o 13 35.1357 6.06027 23.6788     9.58003  25.2081     11.5834  20.0743    240.212     2.79974     60.2121     
1 1 1 25 13 49 o 6  16.2509 5.2099  -3.81006    8.48719  -4.33256    9.81518  1.00241    115.191     13.9876     115.191     
1 1 1 25 13 50 o 17 118.795 2.89943 246.742     16.7269  264.328     17.7484  86.4552    73.0145     8.67095     73.0145     
1 1 1 25 13 51 o 14 43.2693 5.02096 33.1886     9.36581  39.1287     11.6567  21.3453    301.008     14.5508     121.008     
1 1 1 25 13 52 o 19 83.4349 3.13885 116.864     12.5027  137.769     13.6542  58.9065    278.388     3.86641     278.388     
1 1 1 25 13 53 o 17 75.1059 3.46599 102.172     12.0662  105.825     13.8408  71.0295    179.851     41.3112     179.851     
1 1 1 25 13 54 o 15 47.8331 4.623   35.0051     10.274   53.8431     11.0008  32.9993    332.786     3.21785     332.786     
1 1 1 25 13 55 o 1  41.9117 5.01114 34.8516     10.6147  34.1331     9.67059  37.0348    144.229     25.2782     144.229     
1 1 1 25 13 56 o 15 46.9599 4.78914 38.0291     11.0353  48.1093     10.6352  24.3446    271.148     13.0513     91.1483     
1 1 1 25 13 57 o 5  68.1579 3.70756 83.7291     12.887   90.2978     12.1839  50.8878    301.692     11.0599     301.692     
1 1 1 25 13 58 o 8  44.9418 4.93711 37.591      10.9623  42.034      10.4843  27.634     298.313     2.43184     118.313     
1 1 1 25 13 59 o 12 47.1861 4.76532 38.9948     11.0037  48.4565     10.7142  36.5402    199.289     13.9057     199.289     
1 1 1 25 13 60 o 1  28.9367 6.20261 14.7594     9.99457  20.4273     9.76781  9.89631    29.0352     14.1163     209.035     
1 1 1 25 13 61 o 17 15.5913 5.05329 -4.96897    9.37962  -3.50032    8.49439  0.396247   286.728     4.71358     106.728     
1 1 1 25 13 62 o 7  47.5577 6.03248 48.6435     16.186   44.9111     11.1843  34.007     240.398     7.85541     240.398     
1 1 1 25 13 63 o 1  48.5959 5.76441 50.0943     14.234   46.737      12.844   24.7613    214.604     13.2145     34.6043     
1 1 1 25 13 64 f 0  16.5519 5.34658 -13.0668    11.3897  0.776017    9.40805  11.7107    148.192     0           0           
1 1 1 25 13 65 o 1  35.0912 6.82892 15.2045     13.4741  40.3488     13.3866  25.9814    276.693     15.8358     276.693     
1 1 1 25 13 66 o 7  20.3729 6.36639 -1.45015    14.7377  3.91315     11.1937  4.83827    215.543     1.61568     35.5433     
1 1 1 25 13 67 o 11 24.5621 7.06418 5.44265     15.5748  15.3613     12.7818  8.09344    247.738     1.03461     247.738     
1 1 1 25 13 68 o 18 28.1305 7.59638 21.5891     16.088   16.9887     13.7013  8.50729    242.616     3.28135     242.616     
1 1 1 25 13 69 o 1  29.325  7.78428 21.8335     17.4765  22.2009     13.8683  12.6942    202.111     3.14224     22.1113     
1 1 1 25 13 70 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 14 0  o 2  15.5471 6.19391 5.75529     7.34823  5.75529     7.34823  11.0229    180         25.5945     180         
1 1 1 25 14 1  o 6  21.5121 5.55962 6.63888     8.11882  6.87557     7.50181  14.8412    18.494      41.0732     18.494      
1 1 1 25 14 2  o 8  156.746 2.52392 414.902     19.4639  458.986     20.1796  123.43     247.709     17.6309     247.709     
1 1 1 25 14 3  o 9  99.7401 2.67578 180.102     13.2791  174.179     13.416   57.7523    44.1881     27.1123     224.188     
1 1 1 25 14 4  o 1  140.311 2.53246 366.735     18.1446  333.72      17.4502  147.689    176.36      96.3961     176.36      
1 1 1 25 14 5  o 11 63.7713 3.07745 73.1132     9.8172   72.3389     9.73508  1.11851    0.0736732   91.3923     0.0736733   
1 1 1 25 14 6  o 9  141.14  2.46632 358.959     17.4235  349.349     17.4487  160.667    19.2937     126.848     19.2937     
1 1 1 25 14 7  o 18 85.9848 2.77847 127.508     11.6571  136.125     12.2271  60.3262    156.602     1.56815     156.602     
1 1 1 25 14 8  o 2  303.002 3.05819 1663.81     46.408   1605.54     46.4554  195.218    309.467     59.896      129.467     
1 1 1 25 14 9  o 4  66.7406 3.08525 83.7263     9.97262  75.6734     10.4953  5.55547    221.9       82.4079     41.9001     
1 1 1 25 14 10 o 10 60.4584 3.17644 64.0556     9.532    66.8914     9.57578  39.9058    80.7471     18.2288     80.7471     
1 1 1 25 14 11 o 4  152.581 2.56205 427.086     19.5913  401.066     19.5759  112.652    280.898     2.45815     280.898     
1 1 1 25 14 12 o 19 162.959 2.70041 470.1       22.0176  474.783     22.0884  164.878    8.1541      94.0827     8.1541      
1 1 1 25 14 13 o 12 113.934 2.6969  230.862     15.2881  231.576     15.4654  92.0964    351.391     21.6253     351.391     
1 1 1 25 14 14 o 11 76.302  3.33209 110.165     12.706   98.4394     12.6244  47.1253    238.766     10.6013     58.7657     
1 1 1 25 14 15 o 18 15.538  4.93066 -3.3575     8.03388  -3.8601     7.91108  7.47015    168.237     17.8163     168.237     
1 1 1 25 14 16 o 9  20.9051 5.6496  2.54891     8.35619  7.90418     8.39348  11.9737    170.906     34.9692     170.906     
1 1 1 25 14 17 o 3  113.216 2.8575  236.185     15.9689  221.135     16.3744  67.5296    300.64      28.1546     120.64      
1 1 1 25 14 18 o 6  166.269 2.92326 491.756     23.927   493.846     24.7627  173.342    34.4689     107.058     34.4689     
1 1 1 25 14 19 o 12 172.484 2.88379 534.602     25.7652  525.818     24.0728  99.3539    9.00483     53.7986     189.005     
1 1 1 25 14 20 o 18 172.914 2.7562  530.665     23.7537  534.723     24.0135  131.294    204.35      10.4719     204.35      
1 1 1 25 14 21 o 11 170.127 2.63313 525.225     22.5547  505.909     22.3419  156.927    341.031     67.3886     341.031     
1 1 1 25 14 22 o 18 71.7734 3.10926 85.2307     10.7744  99.6631     11.4771  39.8283    105.547     18.5575     285.547     
1 1 1 25 14 23 o 17 29.3577 5.5234  14.6819     7.62777  17.7973     8.92032  3.19085    104.541     30.2981     104.541     
1 1 1 25 14 24 o 1  79.1662 2.93129 108.365     11.4904  116.006     11.6828  69.5952    177.51      36.3155     177.51      
1 1 1 25 14 25 o 9  119.084 2.61424 255.076     15.562   250.939     15.6017  81.6491    8.65463     7.05085     188.655     
1 1 1 25 14 26 o 14 129.877 2.62829 304.335     15.8949  297.637     18.1766  104.834    177.424     23.7335     177.424     
1 1 1 25 14 27 o 8  37.5103 5.29679 32.2355     9.28981  20.9879     9.8619   12.6101    338.308     13.0872     158.308     
1 1 1 25 14 28 o 16 76.7575 3.24654 94.5394     12.2721  117.756     12.4938  64.1711    336.374     23.995      336.374     
1 1 1 25 14 29 o 10 97.7388 2.89636 169.951     13.9366  172.061     14.3727  83.1257    62.5376     28.4621     62.5376     
1 1 1 25 14 30 o 19 88.652  3.06254 147.517     13.625   134.583     13.4882  56.0954    304.758     13.7749     124.758     
1 1 1 25 14 31 o 6  124.119 2.76676 281.286     17.7031  269.914     16.6732  76.5454    327.073     25.797      147.073     
1 1 1 25 14 32 f 0  162.138 2.7356  469.503     22.8157  470.349     21.6223  103.282    179.053     0           0           
1 1 1 25 14 33 o 9  40.953  4.58543 36.2145     8.93603  26.4988     9.07627  29.0402    290.306     10.1741     290.306     
1 1 1 25 14 34 o 1  29.7159 5.43707 22.5995     8.51082  11.1547     8.30218  12.5239    132.85      64.2225     132.85      
1 1 1 25 14 35 o 7  65.2006 3.38658 75.4102     10.8878  78.4529     11.0886  44.6274    70.6169     1.08358     250.617     
1 1 1 25 14 36 o 1  35.1281 5.07519 23.8639     8.94257  23.0301     8.32156  9.25683    32.656      26.932      212.656     
1 1 1 25 14 37 o 9  65.4142 3.34888 70.2123     10.6734  85.1974     11.0883  66.2761    296.012     47.9992     296.012     
1 1 1 25 14 38 o 12 29.1044 5.34801 10.7651     7.93714  21.9004     8.28113  11.7915    87.5034     1.88117     87.5034     
1 1 1 25 14 39 o 18 55.3144 3.55404 61.0608     9.44287  50.7951     9.91203  35.1922    199.527     4.93241     19.5266     
1 1 1 25 14 40 o 16 18.3974 4.73919 11.6942     7.22333  -11.0892    7.30947  3.82729    219.11      24.9876     219.11      
1 1 1 25 14 41 o 6  73.475  3.15281 91.0722     11.5349  104.655     11.5272  40.8851    346.063     20.7531     166.063     
1 1 1 25 14 42 o 17 42.8477 4.46318 32.7543     9.3126   36.0811     9.25801  27.34      71.0271     0.921693    251.027     
1 1 1 25 14 43 o 7  25.6624 5.5571  6.57329     8.46736  17.4632     8.08591  9.58983    45.1759     5.1864      225.176     
1 1 1 25 14 44 o 19 56.2037 3.66055 65.526      10.4296  50.7953     9.88199  42.122     32.1119     8.67817     32.1119     
1 1 1 25 14 45 f 0  26.4512 5.81006 6.76038     8.6584   19.3572     9.27169  4.28846    255.348     0           0           
1 1 1 25 14 46 o 13 17.0542 5.03436 -12.978     7.91099  7.69633     8.52878  3.36778    95.3077     23.1343     95.3077     
1 1 1 25 14 47 o 14 27.5807 6.07604 17.7245     8.98256  11.2914     10.0393  11.5071    96.6237     4.886       96.6237     
1 1 1 25 14 48 o 14 62.1918 4.07639 73.2894     12.661   70.5412     12.4589  35.9747    349.362     13.235      169.362     
1 1 1 25 14 49 o 5  85.5726 3.20432 134.882     13.6115  132.445     13.7702  76.3313    231.241     35.1813     231.241     
1 1 1 25 14 50 o 11 20.3944 5.64711 -1.11258    9.57202  9.55164     8.31565  4.54738    139.219     12.2774     319.219     
1 1 1 25 14 51 o 9  20.7364 5.87185 7.63633     10.0994  3.34819     8.44122  3.32969    248.71      16.4682     68.7098     
1 1 1 25 14 52 o 19 34.1038 5.9548  28.6215     11.0662  19.3903     9.26709  15.5952    150.42      12.5448     330.42      
1 1 1 25 14 53 o 10 35.0419 6.02202 27.9743     11.4998  22.8411     9.45726  26.0154    42.6557     10.533      42.6557     
1 1 1 25 14 54 o 2  86.7667 3.18326 134.694     14.138   142.745     13.4048  61.6152    112.313     5.05953     112.313     
1 1 1 25 14 55 f 0  39.4667 5.727   24.1264     10.9369  40.2737     10.997   25.3315    138.859     0           0           
1 1 1 25 14 56 o 17 62.3486 4.11867 65.0653     12.2056  83.3617     13.1726  45.8318    98.3672     8.79505     98.3672     
1 1 1 25 14 57 o 8  48.6521 5.39965 55.624      11.2383  39.8013     13.3784  34.2757    103.887     5.9168      103.887     
1 1 1 25 14 58 o 16 32.3654 6.29663 22.9733     10.0859  21.72       11.0201  19.7293    310.329     10.2136     310.329     
1 1 1 25 14 59 o 8  21.0572 6.00073 7.20979     9.36014  4.88003     10.2035  5.84464    45.1438     6.06918     225.144     
1 1 1 25 14 60 o 16 25.4056 6.2878  4.33975     10.1842  19.9255     10.9089  0.380322   160.992     30.2492     340.991     
1 1 1 25 14 61 o 13 61.6077 4.4929  71.2218     14.8376  75.6781     12.1696  52.2675    87.0064     24.2771     87.0064     
1 1 1 25 14 62 o 8  35.9116 6.65186 38.8987     14.1541  19.1137     10.5114  26.8268    90.2463     12.0149     90.2463     
1 1 1 25 14 63 o 15 70.2548 4.63216 89.8365     17.6466  103.878     13.7024  54.8755    37.3246     17.7755     37.3246     
1 1 1 25 14 64 o 6  28.2634 7.07031 26.0675     14.2404  9.99699     11.3921  14.1568    80.6789     3.40545     260.679     
1 1 1 25 14 65 o 1  43.8461 7.26622 38.843      16.2268  51.9821     15.3957  36.4416    340.068     23.9156     340.068     
1 1 1 25 14 66 o 2  23.2555 7.01274 15.9437     15.9893  0.742634    13.085   7.33672    62.1929     3.09356     242.193     
1 1 1 25 14 67 o 14 20.6717 6.61936 -4.39104    14.9045  5.81128     14.9075  2.65481    269.035     2.86195     89.0345     
1 1 1 25 14 68 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 14 69 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 15 0  f 0  111.135 2.76964 220.162     15.3818  220.162     15.3818  128.865    6.6293e-06  0           0           
1 1 1 25 15 1  o 12 94.0163 2.82955 177.76      13.6354  138.77      12.8925  76.5907    127.567     21.0428     127.567     
1 1 1 25 15 2  o 11 133.742 2.59113 325.958     17.7299  311.077     16.9732  79.4903    91.7185     37.3614     271.718     
1 1 1 25 15 3  o 9  39.2123 4.78992 26.7338     9.30513  30.0757     8.79369  6.39739    200.609     30.7388     20.6088     
1 1 1 25 15 4  o 15 45.5425 4.26718 33.0075     9.52423  42.9008     9.27643  5.64895    72.7202     71.9296     72.7202     
1 1 1 25 15 5  o 6  89.103  2.96801 141.402     13.5748  142.119     12.8442  27.2563    319.119     74.2841     139.119     
1 1 1 25 15 6  o 2  89.1509 2.91318 137.662     13.0243  146.163     12.9233  51.8858    261.996     23.459      81.9961     
1 1 1 25 15 7  o 12 67.7877 3.32786 76.2128     11.4167  88.7994     10.9552  23.6315    76.765      47.5585     256.765     
1 1 1 25 15 8  o 8  154.687 2.775   432.966     21.9509  419.826     21.0384  132.407    14.7428     38.2705     14.7429     
1 1 1 25 15 9  o 7  67.6243 3.46201 87.2366     11.7019  77.1006     11.5753  16.6771    18.8535     61.8173     198.854     
1 1 1 25 15 10 o 7  21.1096 5.69776 11.153      9.25645  -3.66297    9.01586  3.63214    42.9382     11.4467     42.9382     
1 1 1 25 15 11 o 14 178.338 3.10164 572.027     27.3677  562.924     28.0388  119.177    99.6326     24.8679     279.633     
1 1 1 25 15 12 o 19 140.551 2.82445 361.226     19.6533  343.45      20.072   135.006    171.842     66.8457     171.842     
1 1 1 25 15 13 o 19 117.841 2.80997 240.52      16.7602  255.064     16.355   88.5275    189.305     6.77549     189.305     
1 1 1 25 15 14 o 4  130.058 2.90341 298.4       19.5077  305.415     18.2536  118.807    323.905     50.2908     323.905     
1 1 1 25 15 15 o 10 85.9236 2.83343 131.746     12.1135  132.06      12.2206  52.5338    158.157     16.3985     338.157     
1 1 1 25 15 16 o 1  138.304 2.66546 344.445     18.2765  337.722     18.631   132.316    124.062     65.4136     124.062     
1 1 1 25 15 17 o 17 188.33  2.58955 642.832     24.8855  621.012     23.9967  146.502    161.17      16.3603     161.17      
1 1 1 25 15 18 f 0  34.1973 4.88595 24.7791     8.25419  19.0848     7.92219  38.4818    56.5071     0           0           
1 1 1 25 15 19 o 6  81.9168 2.87071 116.424     11.9141  123.687     11.5595  54.0888    174.391     6.09928     354.391     
1 1 1 25 15 20 o 2  16.0785 4.93473 2.27792     8.03672  -5.39108    7.01986  10.7013    170.715     26.5573     170.715     
1 1 1 25 15 21 o 13 96.7562 2.82977 160.9       14.1287  173.937     13.1823  92.6345    122.211     52.0224     122.211     
1 1 1 25 15 22 f 0  47.592  3.97019 43.5495     9.68464  39.0318     8.89491  35.2491    349.665     0           0           
1 1 1 25 15 23 o 16 39.564  5.24285 35.6354     11.3743  23.6318     8.731    3.71591    3.65749     1.20272     3.65749     
1 1 1 25 15 24 o 16 99.1333 3.01445 184.597     15.4139  167.657     14.4721  100.168    53.3904     62.3532     53.3904     
1 1 1 25 15 25 o 3  147.11  2.97053 397.736     23.3     376.972     20.4228  130.754    201.358     48.1288     201.358     
1 1 1 25 15 26 o 5  77.1658 3.43274 112.672     14.1034  101.983     12.3144  79.7397    304.975     57.1058     304.975     
1 1 1 25 15 27 o 19 83.9722 3.37317 128.14      14.4301  125.729     13.8414  80.4142    100.445     43.0754     100.445     
1 1 1 25 15 28 o 7  17.1097 5.08652 0.331029    7.55053  1.59289     7.26591  20.0064    129.352     59.1059     129.352     
1 1 1 25 15 29 o 7  25.9123 5.59934 9.97216     8.18622  14.7314     7.89545  6.49781    131.474     3.94905     311.474     
1 1 1 25 15 30 o 6  81.9983 2.94039 120.373     12.226   121.185     11.8564  60.7324    91.526      4.91736     91.526      
1 1 1 25 15 31 o 9  23.5787 5.61749 12.5776     8.21254  6.68369     7.75422  1.99782    264.647     19.9539     84.6469     
1 1 1 25 15 32 o 17 59.4469 3.57032 63.685      9.94216  64.7123     11.1016  56.1513    253.903     34.1605     253.903     
1 1 1 25 15 33 o 2  80.6562 2.93451 117.252     12.2283  116.879     11.4001  61.2417    43.2581     8.45313     43.2582     
1 1 1 25 15 34 f 0  52.1303 3.77472 48.3196     10.0775  51.135      9.31274  8.67894    176.202     0           0           
1 1 1 25 15 35 o 13 17.4803 5.19221 2.36443     7.74866  0.122242    7.69056  9.77045    109.931     37.5054     109.931     
1 1 1 25 15 36 f 0  35.7517 5.00842 30.1478     9.0192   19.1082     8.30725  36.7317    162.13      0           0           
1 1 1 25 15 37 o 16 20.82   5.58252 9.50034     8.73577  2.46732     7.58631  2.71263    346.477     27.7976     346.477     
1 1 1 25 15 38 o 10 45.5822 4.23441 42.4774     10.0082  34.9524     8.87764  23.1189    274.277     15.3531     94.2769     
1 1 1 25 15 39 o 2  23.9308 5.67986 15.4087     8.75899  4.31719     8.15506  6.64671    248.541     9.53689     68.5407     
1 1 1 25 15 40 o 13 36.1189 5.26152 23.3441     9.80136  26.9521     8.58021  23.2045    233.234     2.49096     233.234     
1 1 1 25 15 41 o 11 23.3803 5.85754 10.7507     8.98009  8.05542     8.22057  1.29667    136.344     24.2912     316.344     
1 1 1 25 15 42 o 15 117.148 2.76765 262.12      16.5481  233.002     15.892   93.1156    305.908     20.8361     305.908     
1 1 1 25 15 43 o 3  74.6164 3.28651 104.48      12.3873  98.2578     12.0682  47.0998    203.428     9.86497     23.4277     
1 1 1 25 15 44 o 5  38.5774 5.23133 24.1756     9.22386  33.781      10.2819  23.2456    166.337     3.4973      346.337     
1 1 1 25 15 45 o 1  78.694  3.16177 125.991     12.3601  100.147     12.3422  51.7111    10.949      6.25784     190.949     
1 1 1 25 15 46 o 3  79.4611 3.1741  114.904     12.6832  115.378     12.492   55.6342    207.057     0.721262    207.056     
1 1 1 25 15 47 o 6  46.9683 4.51129 44.6852     10.0876  39.1933     10.5103  43.0428    327.033     25.8551     327.033     
1 1 1 25 15 48 o 3  21.7146 5.83502 9.31978     9.14064  5.40801     8.46949  3.314      345.983     18.7469     165.983     
1 1 1 25 15 49 o 5  21.6101 5.49538 -0.444231   8.60254  13.5862     8.20839  6.04453    358.318     12.0866     178.318     
1 1 1 25 15 50 o 5  24.3691 5.9299  10.6153     8.8129   12.0532     8.7362   8.2265     356.418     12.3999     176.418     
1 1 1 25 15 51 o 1  72.7389 3.33502 86.2658     11.9523  110.05      12.0947  42.3007    83.0344     15.316      263.034     
1 1 1 25 15 52 o 15 55.4006 4.30284 44.2347     11.5527  74.7576     10.8565  31.635     318.942     11.6202     138.942     
1 1 1 25 15 53 o 10 42.5053 5.10774 38.1656     11.0463  33.7362     9.94475  20.9214    187.352     14.2845     7.35221     
1 1 1 25 15 54 o 10 23.6968 5.87353 18.1941     9.89676  1.1061      9.05429  5.56463    282.111     16.2785     102.111     
1 1 1 25 15 55 o 4  66.414  3.8354  88.8678     12.8661  77.918      12.4222  47.2193    340.685     5.31741     340.685     
1 1 1 25 15 56 o 11 25.5539 6.07612 9.74519     9.3639   16.4983     9.36768  9.16537    175.409     9.86197     355.409     
1 1 1 25 15 57 o 7  34.0296 6.19107 27.97       9.99849  21.2128     11.526   23.9336    312.682     10.7773     312.682     
1 1 1 25 15 58 o 12 60.1457 4.10358 62.8531     12.0602  75.6403     12.2909  51.1894    16.1144     23.5501     16.1144     
1 1 1 25 15 59 o 9  43.8694 5.63849 40.1176     12.922   38.7073     10.9018  21.4345    200.252     14.3686     20.252      
1 1 1 25 15 60 o 17 65.5796 4.72411 80.7377     16.5461  87.8084     13.6307  43.3336    308.555     0.435629    128.555     
1 1 1 25 15 61 o 4  29.7699 7.14301 23.7453     14.3652  16.4886     11.0518  15.2259    271.315     4.70477     91.3147     
1 1 1 25 15 62 o 10 17.1607 5.82271 -9.97971    16.5417  -12.6219    11.3318  2.85081    340.373     4.31961     160.373     
1 1 1 25 15 63 o 5  23.7295 6.99537 9.83775     14.2816  8.81483     13.3446  7.98636    263.455     8.89296     83.4551     
1 1 1 25 15 64 o 4  30.7289 7.72678 27.5228     15.8545  20.447      14.0988  15.4567    171.276     3.33884     351.276     
1 1 1 25 15 65 o 2  20.439  6.59509 -0.520654   16.2887  0.848037    13.7293  1.34754    167.229     1.00991     347.229     
1 1 1 25 15 66 o 16 27.6995 7.67893 24.2042     17.2355  14.8321     13.7812  10.9044    301.555     0.693851    301.555     
1 1 1 25 15 67 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 16 0  o 14 108.534 2.79672 210.181     15.1657  210.181     15.1657  75.9575    180         11.0301     360         
1 1 1 25 16 1  o 9  107.537 2.74638 201.063     14.6235  211.764     14.928   79.3935    275.431     3.15361     275.431     
1 1 1 25 16 2  o 7  26.7612 5.51885 7.89026     8.00375  18.249      8.33014  4.31862    225.999     26.5328     225.999     
1 1 1 25 16 3  o 7  56.2925 3.52634 52.9377     9.69178  61.4819     9.97161  27.1683    76.5409     20.2572     256.541     
1 1 1 25 16 4  o 8  94.6595 2.83937 152.796     13.2088  167.504     13.6642  65.7868    107.751     4.12723     287.751     
1 1 1 25 16 5  o 6  47.9856 4.50616 36.6299     10.4419  48.0567     10.5201  16.0313    95.8661     29.2093     275.866     
1 1 1 25 16 6  o 1  47.6629 4.20245 38.6437     9.92081  44.3119     9.64747  20.3615    274.801     17.7816     94.8007     
1 1 1 25 16 7  f 0  55.0549 3.66327 56.9825     9.61779  52.5776     10.2978  32.8436    85.8287     0           0           
1 1 1 25 16 8  o 10 114.612 2.75717 237.671     15.3325  231.315     16.2644  66.4042    124.673     34.6597     304.673     
1 1 1 25 16 9  o 14 82.2679 3.06143 112.389     12.141   130.324     13.0105  75.3664    353.466     40.6513     353.466     
1 1 1 25 16 10 o 1  72.8398 2.98743 97.2186     10.512   92.8743     11.1729  62.0458    192.077     29.0462     192.077     
1 1 1 25 16 11 o 3  61.5569 3.3134  67.8104     10.1033  68.5088     10.186   34.6256    257.379     13.4566     77.3794     
1 1 1 25 16 12 o 12 115.237 2.85665 247.762     15.1849  226.991     17.5391  101.129    24.5965     36.6071     24.5965     
1 1 1 25 16 13 o 6  63.8018 3.31689 75.2818     9.8604   71.1788     11.114   27.6092    21.82       32.8568     201.82      
1 1 1 25 16 14 o 10 63.9261 3.32089 74.3859     10.0974  72.6501     10.997   36.928     210.603     13.0928     30.6032     
1 1 1 25 16 15 o 11 119.676 2.72696 265.544     15.7249  246.187     16.8592  92.0964    299.685     10.3848     299.685     
1 1 1 25 16 16 o 5  18.277  5.3537  -2.4045     7.71521  5.07022     8.6648   8.48646    301.308     24.6721     301.308     
1 1 1 25 16 17 o 19 91.956  3.09299 152.349     13.1697  150.755     15.1686  41.9745    0.243485    49.2069     180.243     
1 1 1 25 16 18 o 3  93.2456 3.09343 149.751     14.0711  162.095     14.7611  67.5527    173.644     1.25727     173.644     
1 1 1 25 16 19 o 13 182.006 2.97939 600.011     26.8998  584.631     27.4372  141.107    341.429     13.9981     341.429     
1 1 1 25 16 20 o 13 46.8827 4.93283 32.2285     10.564   50.2367     11.7026  33.248     353.134     15.3651     353.134     
1 1 1 25 16 21 o 16 102.417 3.31667 198.541     15.867   178.641     17.8745  93.811     172.86      40.3371     172.86      
1 1 1 25 16 22 o 8  60.7425 4.01988 65.1447     12.5857  69.1109     11.5277  47.169     114.821     10.5272     114.821     
1 1 1 25 16 23 o 17 63.9488 3.38944 67.5595     10.399   80.3688     11.1569  44.2732    28.1801     1.76385     208.18      
1 1 1 25 16 24 o 19 66.2339 3.46031 91.4903     10.6246  67.9083     11.7516  51.2449    294.223     9.27491     294.223     
1 1 1 25 16 25 o 8  60.2069 3.73638 67.5489     10.3177  64.1554     11.8806  57.7293    334.461     35.6805     334.461     
1 1 1 25 16 26 o 2  75.2813 3.19977 103.988     12.3347  100.301     11.697   52.3015    340.369     2.97191     160.369     
1 1 1 25 16 27 o 3  60.4961 3.46764 66.7023     9.93709  65.9746     10.8772  37.9372    191.806     9.23553     11.8058     
1 1 1 25 16 28 o 14 73.3694 3.16366 103.296     11.4536  91.1046     11.6486  45.4996    106.612     13.7967     286.612     
1 1 1 25 16 29 o 2  44.8064 4.3577  42.1427     9.10606  32.569      9.68886  24.8804    232.341     10.8089     52.3413     
1 1 1 25 16 30 o 11 37.8302 5.18972 33.0957     9.01072  21.7417     9.81817  20.5725    339.3       7.47196     159.3       
1 1 1 25 16 31 o 8  35.663  5.21996 25.5362     8.53774  23.1051     9.48933  8.88202    106.809     29.6654     286.809     
1 1 1 25 16 32 o 7  57.1768 3.63199 61.3357     9.98405  58.056      10.5715  24.2756    356.145     31.9884     176.145     
1 1 1 25 16 33 o 18 56.4434 3.78679 58.9413     10.7539  57.8097     10.4122  28.2869    212.075     22.5027     32.0747     
1 1 1 25 16 34 o 6  45.7048 4.31677 39.1586     9.02949  38.5979     10.1906  36.5384    57.1596     13.9303     57.1596     
1 1 1 25 16 35 o 15 23.9188 5.65654 14.405      8.14901  5.12921     8.57532  7.09057    190.403     5.26832     10.4032     
1 1 1 25 16 36 o 8  56.7556 3.74771 72.0343     10.0276  47.4043     10.4953  37.5586    344.549     3.49481     164.549     
1 1 1 25 16 37 o 16 58.0296 3.61057 63.1003     9.92494  60.2307     10.8078  39.2879    86.4833     1.82762     266.483     
1 1 1 25 16 38 o 7  94.0292 2.90171 166.687     12.9911  152.753     14.1847  66.0674    89.7393     1.5148      269.739     
1 1 1 25 16 39 o 16 85.8971 3.00513 141.764     13.2395  125.573     12.5489  61.0474    82.3499     0.620459    82.3499     
1 1 1 25 16 40 o 9  53.1616 3.89525 47.9993     10.1991  56.6473     10.1848  45.778     201.244     20.3965     201.244     
1 1 1 25 16 41 o 13 22.6756 5.68427 4.36068     8.40401  12.4741     8.35206  2.79175    311.287     0.0961842   311.287     
1 1 1 25 16 42 o 14 31.9285 5.56148 18.1078     9.10316  22.098      8.6382   15.4223    7.5822      9.76391     187.582     
1 1 1 25 16 43 o 11 67.1821 3.43087 80.5824     11.5849  84.9907     11.3453  36.4788    314.759     21.1157     134.759     
1 1 1 25 16 44 o 10 22.7435 5.7802  12.3372     8.81121  5.18913     8.34197  8.94351    76.7531     0.724546    76.7531     
1 1 1 25 16 45 o 4  57.1045 3.66581 58.2989     10.8227  62.6505     9.84295  38.3189    124.79      2.09389     304.79      
1 1 1 25 16 46 f 0  34.0125 5.30313 21.8579     9.10794  24.1515     8.48875  25.1872    1.50905     0           0           
1 1 1 25 16 47 o 10 73.4324 3.21334 104.039     11.983   94.3592     11.5469  64.981     220.504     28.6357     220.504     
1 1 1 25 16 48 o 1  38.4617 5.00395 36.9134     9.56298  22.2107     8.91955  23.7581    128.713     3.07254     308.713     
1 1 1 25 16 49 o 2  22.7433 5.9794  12.1299     9.96971  6.14527     8.32316  9.68524    62.1842     3.62836     242.184     
1 1 1 25 16 50 o 17 29.0537 5.84857 17.3591     9.3856   17.5724     8.48258  15.3435    158.18      4.57058     338.18      
1 1 1 25 16 51 o 6  40.5813 5.24062 24.5968     10.3073  42.3598     9.89626  26.0805    239.535     0.755547    59.5348     
1 1 1 25 16 52 o 15 26.1453 6.08695 14.5617     9.31603  13.3879     9.16639  11.2485    228.114     4.61676     228.114     
1 1 1 25 16 53 o 9  42.1336 5.05256 33.04       10.1697  37.937      10.3871  23.5658    287.439     7.93989     107.439     
1 1 1 25 16 54 o 12 19.5634 5.63049 9.69759     9.39333  -2.72933    8.90678  3.06234    90.9128     11.5917     270.913     
1 1 1 25 16 55 o 5  24.4087 6.19397 5.68162     10.9686  15.7245     9.39507  6.5367     188.204     2.07372     188.204     
1 1 1 25 16 56 o 2  14.5504 4.94105 -9.93046    11.2839  -13.2075    9.33102  0.178086   228.939     5.46534     48.9386     
1 1 1 25 16 57 o 3  44.5329 5.94808 44.1136     13.6999  38.5124     11.8855  27.4782    80.5121     3.1856      260.512     
1 1 1 25 16 58 o 10 76.6541 4.26851 128.097     17.5016  99.1273     15.0488  48.9297    214.212     5.55198     34.2116     
1 1 1 25 16 59 o 12 29.7689 7.24636 38.541      17.4468  2.61636     11.1639  15.1654    21.3461     5.24527     201.346     
1 1 1 25 16 60 o 10 30.5292 6.94713 9.1512      15.0925  30.2028     12.2278  20.0173    175.919     6.11427     175.919     
1 1 1 25 16 61 o 15 29.6429 7.16852 29.5031     14.6481  12.3845     11.5548  15.6046    153.466     8.7302      153.466     
1 1 1 25 16 62 o 2  27.8968 6.98347 1.60586     18.7933  25.6103     11.4541  14.6671    327.095     1.68627     327.095     
1 1 1 25 16 63 o 14 43.2055 7.03488 54.3613     16.6758  35.9069     13.2957  33.7032    27.0603     16.9277     27.0603     
1 1 1 25 16 64 o 2  20.1823 6.457   2.24162     14.5812  0.549725    13.3825  2.98055    164.042     6.71643     344.042     
1 1 1 25 16 65 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 17 0  o 9  47.9254 4.59973 43.2564     10.4732  43.2564     10.4732  13.2465    4.38016e-06 45.0443     180         
1 1 1 25 17 1  o 3  139.423 2.75702 346.103     18.9294  348.251     19.5563  112.185    88.9776     18.7033     88.9776     
1 1 1 25 17 2  o 7  101.379 2.81722 182.252     13.9913  185.273     14.577   70.8112    137.093     5.90456     317.093     
1 1 1 25 17 3  o 17 212.228 2.82156 797.071     28.9923  811.221     31.0074  183.059    275.974     49.7308     275.974     
1 1 1 25 17 4  o 2  142.518 2.69508 349.298     18.7436  376.253     19.7232  112.657    277.548     14.7902     277.548     
1 1 1 25 17 5  o 6  69.6568 3.23582 92.2088     11.3348  82.3373     11.114   63.0944    173.864     36.2557     173.864     
1 1 1 25 17 6  o 15 71.4544 3.20738 99.3971     11.2373  84.365      11.5242  58.1758    24.9575     18.3199     24.9575     
1 1 1 25 17 7  o 16 15.3803 4.81015 -8.28792    7.12038  1.67139     7.98513  25.1113    359.439     62.1531     359.439     
1 1 1 25 17 8  o 10 41.4364 4.55085 27.3784     8.88001  36.4027     9.32611  7.97498    248.885     38.2458     68.8851     
1 1 1 25 17 9  o 15 26.7043 6.01196 12.5166     9.43875  13.3201     8.70007  1.11533    242.912     5.92169     62.9119     
1 1 1 25 17 10 o 3  138.075 2.90569 333.929     21.0545  348.159     19.007   135.79     333.846     69.1707     333.846     
1 1 1 25 17 11 o 10 68.3304 3.63976 82.1348     12.9974  86.5343     11.6586  61.6815    317.773     31.49       317.773     
1 1 1 25 17 12 o 12 81.1159 3.31207 109.595     13.307   127.37      13.4561  66.646     234.399     17.7062     234.399     
1 1 1 25 17 13 o 14 71.9973 3.57551 97.6236     13.8645  89.5718     11.7551  58.7431    133.339     16.2085     133.339     
1 1 1 25 17 14 o 4  80.6354 3.47351 116.52      14.3478  117.791     13.575   45.1293    357.45      26.8548     177.45      
1 1 1 25 17 15 o 10 26.2748 6.17893 8.41314     10.3119  15.2658     9.20044  1.5999     345.897     33.4056     345.897     
1 1 1 25 17 16 o 17 66.4224 4.16049 91.2871     14.0087  70.0445     13.288   45.0017    28.6976     4.80526     208.698     
1 1 1 25 17 17 o 2  95.0267 3.19931 167.052     14.3224  157.59      15.9533  71.9116    238.538     4.92406     238.538     
1 1 1 25 17 18 o 19 63.5911 3.64219 78.2048     10.8409  68.471      12.0066  46.0573    173.58      1.76071     173.58      
1 1 1 25 17 19 o 11 82.9851 3.15966 127.642     12.4746  120.212     13.6338  68.2351    173.072     16.5699     173.072     
1 1 1 25 17 20 o 11 72.2834 3.55103 108.359     11.8487  81.6114     13.241   47.0241    277.501     10.175      97.5014     
1 1 1 25 17 21 o 4  32.3699 5.59034 14.1431     9.11973  26.226      9.23886  17.2076    84.4821     3.20025     84.4821     
1 1 1 25 17 22 o 14 92.1189 2.9837  153.119     13.536   151.965     13.9342  81.241     105.492     29.2339     105.492     
1 1 1 25 17 23 o 6  19.9251 5.20864 -5.49166    7.22267  12.6446     8.57833  6.38047    72.0729     34.3564     72.0729     
1 1 1 25 17 24 o 3  83.1317 3.03603 131.357     11.8252  117.748     13.23    56.0329    61.5718     8.29826     241.572     
1 1 1 25 17 25 o 4  34.6397 5.50416 27.849      8.30738  18.136      10.4826  15.2575    2.04699     8.51891     2.04699     
1 1 1 25 17 26 o 14 74.1742 3.26822 104.154     11.6837  95.0216     12.4215  47.8893    190.404     10.8579     10.4038     
1 1 1 25 17 27 o 4  26.8483 5.99778 10.9628     8.49781  16.1652     9.64906  8.81309    307.167     11.6532     127.167     
1 1 1 25 17 28 o 11 49.7557 4.25331 46.5074     9.10716  45.1627     11.4421  30.853     197.333     7.0763      17.3326     
1 1 1 25 17 29 o 4  15.906  4.99124 -0.975174   7.39234  -3.6102     8.53934  13.2603    235.842     43.382      235.842     
1 1 1 25 17 30 o 6  91.5272 3.04688 148.547     12.4653  154.101     15.2999  72.8386    230.206     13.9677     230.206     
1 1 1 25 17 31 o 3  22.3343 5.74762 5.68208     7.79131  10.4796     8.96946  3.07716    142.291     1.87558     322.291     
1 1 1 25 17 32 o 12 55.9488 3.78365 48.2306     9.68853  67.5726     11.2394  51.0079    97.5903     26.4185     97.5903     
1 1 1 25 17 33 o 18 21.5573 5.5517  -0.596292   7.73306  13.5254     9.06894  7.53159    232.794     41.5678     232.794     
1 1 1 25 17 34 o 11 63.9097 3.56905 72.8495     10.6278  76.5495     12.0303  42.5848    293.241     4.97742     113.241     
1 1 1 25 17 35 o 11 33.4172 5.56378 26.6704     8.53535  16.8813     10.0658  16.6111    39.6115     9.3247      219.612     
1 1 1 25 17 36 o 19 48.7483 4.3197  46.6743     9.49172  42.1585     10.9492  27.19      176.447     12.9169     356.447     
1 1 1 25 17 37 o 19 103.085 2.8651  188.858     13.859   195.235     15.6542  77.2926    250.582     7.03502     250.582     
1 1 1 25 17 38 o 4  38.6919 5.25651 29.9187     9.10202  28.0801     10.4899  27.5185    277.402     5.10077     277.402     
1 1 1 25 17 39 o 16 26.3409 6.3384  14.2479     8.70185  10.9981     11.7277  5.53462    155.356     2.48869     155.356     
1 1 1 25 17 40 o 11 36.9404 5.7679  28.453      9.99114  25.7382     10.7994  25.4314    333.676     3.08127     333.676     
1 1 1 25 17 41 o 8  46.4372 4.84362 52.0557     9.69933  31.6257     11.1323  24.3346    156.552     15.4076     336.552     
1 1 1 25 17 42 o 11 53.5054 4.38901 64.0598     10.262   44.8569     11.9616  40.9186    141.888     8.20022     141.888     
1 1 1 25 17 43 o 10 60.6005 3.75144 76.8157     10.9532  60.3241     11.3793  41.6082    273.526     1.23873     93.5263     
1 1 1 25 17 44 o 12 55.0171 4.03177 59.8432     10.977   54.1951     10.9101  39.0708    244.006     2.17283     244.006     
1 1 1 25 17 45 o 9  49.9983 4.21859 48.6369     10.6848  46.4799     10.0385  31.3063    351.257     6.08497     171.257     
1 1 1 25 17 46 o 5  70.3656 3.59921 95.3493     13.3922  89.2475     11.8068  59.8857    146.118     22.2891     146.118     
1 1 1 25 17 47 o 19 26.1871 6.14882 12.8695     9.40385  14.8581     9.46404  9.75052    169.691     12.6485     349.691     
1 1 1 25 17 48 o 16 40.8378 5.10094 42.3711     10.37    25.1094     9.57946  25.4598    269.804     3.262       89.8041     
1 1 1 25 17 49 o 7  14.9319 4.81239 0.37336     8.32254  -9.52023    7.99565  2.30462    310.477     18.1402     310.477     
1 1 1 25 17 50 o 2  25.8047 5.95814 10.6997     9.3235   16.1922     8.71434  10.5383    34.1471     8.94695     214.147     
1 1 1 25 17 51 o 16 34.7091 5.96845 26.2253     10.9081  24.581      9.65695  25.7252    90.2403     13.2499     90.2403     
1 1 1 25 17 52 o 8  37.2173 5.57078 45.3477     11.1796  14.6263     9.7501   28.7769    349.912     14.4247     349.912     
1 1 1 25 17 53 o 15 26.2826 6.37511 16.7935     10.6565  11.8093     9.67482  10.9372    168.413     4.50048     168.413     
1 1 1 25 17 54 o 1  40.7891 6.3397  35.305      12.4858  35.7109     12.7243  35.3122    12.5901     24.6441     12.5901     
1 1 1 25 17 55 o 7  48.5878 5.55702 43.656      12.8207  52.8798     13.2646  37.5711    87.2093     11.2782     87.2093     
1 1 1 25 17 56 o 11 24.3973 6.57981 10.6733     10.9939  11.7674     11.3502  10.2063    40.6833     7.47289     220.683     
1 1 1 25 17 57 o 6  24.658  6.59456 15.7302     11.33    7.35921     11.4901  12.9265    222.52      1.58722     222.52      
1 1 1 25 17 58 o 10 55.5359 6.26301 69.8723     16.3402  63.0289     17.2206  39.6504    67.5093     5.85704     67.5093     
1 1 1 25 17 59 o 18 25.7655 6.90527 25.581      14.438   0.167114    12.2219  11.9324    132.386     4.31973     132.386     
1 1 1 25 17 60 o 3  29.717  7.40508 30.3684     15.2968  13.5306     12.759   17.307     63.8082     4.25165     63.8082     
1 1 1 25 17 61 o 4  16.7658 5.62053 -7.42359    13.8104  -8.11352    11.325   0.439647   36.7027     2.05837     216.703     
1 1 1 25 17 62 o 13 23.3892 7.28832 30.8209     21.1793  -14.2778    12.3491  6.46132    207.605     2.87489     27.6052     
1 1 1 25 17 63 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 18 0  f 0  38.742  5.26814 29.7034     9.13583  29.7034     9.13583  47.6928    180         0           0           
1 1 1 25 18 1  o 15 158.525 3.0018  458.26      24.404   442.326     23.2484  120.289    287.822     3.49194     287.822     
1 1 1 25 18 2  o 13 29.2276 6.60136 16.3515     11.1577  15.1648     10.6699  9.08299    312.226     13.0554     132.226     
1 1 1 25 18 3  o 9  98.4997 3.48108 165.406     17.0673  184.376     17.155   78.4687    86.9338     11.7453     86.9338     
1 1 1 25 18 4  o 12 26.7832 6.32218 9.9699      10.0672  15.3019     10.0466  3.81355    154.32      1.21515     334.32      
1 1 1 25 18 5  o 7  70.5881 3.86424 90.6507     13.5828  90.0601     13.5437  66.3443    258.057     32.6687     258.057     
1 1 1 25 18 6  o 1  154.689 3.23125 426.457     24.8278  432.824     25.2157  135.032    148.618     39.1665     148.618     
1 1 1 25 18 7  o 12 100.435 3.08068 190.944     15.9723  171.528     14.9695  61.1907    33.4118     26.6017     213.412     
1 1 1 25 18 8  o 13 27.2301 5.99228 14.4182     9.10061  13.0449     9.00383  7.30626    49.9731     15.6249     229.973     
1 1 1 25 18 9  o 19 20.5381 5.57437 10.3555     8.52237  -3.51041    9.10775  4.45947    45.9839     30.3226     45.9839     
1 1 1 25 18 10 o 13 22.229  5.67312 11.1429     7.73857  2.34338     9.38982  2.68338    295.192     11.4004     115.192     
1 1 1 25 18 11 o 6  36.9002 5.44383 24.3051     9.09246  27.5422     10.397   4.31285    52.9259     60.3812     52.9259     
1 1 1 25 18 12 o 1  127.353 2.78774 282.59      16.4704  298.694     19.036   123.983    142.098     59.6525     142.098     
1 1 1 25 18 13 o 16 28.2638 5.87459 15.432      8.25277  14.7207     9.5362   11.2755    173.634     3.12484     353.634     
1 1 1 25 18 14 o 5  61.9948 3.48283 72.7899     10.005   66.5664     11.3244  48.8721    116.947     9.61637     116.947     
1 1 1 25 18 15 o 3  37.2799 5.16488 30.9956     8.26943  21.8215     10.1325  25.7229    219.803     8.98587     219.803     
1 1 1 25 18 16 o 9  124.109 2.85525 284.659     16.2797  268.271     18.9846  110.535    238.582     37.7593     238.582     
1 1 1 25 18 17 o 4  43.7339 4.66034 42.2293     9.21428  29.6169     10.1245  29.0733    355.755     0.74595     175.755     
1 1 1 25 18 18 o 19 116.983 2.84908 247.596     16.1712  243.916     17.1602  75.4465    164.064     22.0966     344.064     
1 1 1 25 18 19 o 10 88.1221 3.19737 144.949     12.5397  135.4       15.3364  81.3643    140.488     34.964      140.488     
1 1 1 25 18 20 o 3  34.9987 5.55514 31.5478     9.96139  16.3231     9.33556  14.2309    84.0455     8.49195     84.0455     
1 1 1 25 18 21 o 7  19.2196 5.45493 1.58593     7.70544  5.66668     8.4178   2.34808    218.282     22.7485     218.282     
1 1 1 25 18 22 o 9  64.1016 3.43087 75.1199     10.5615  74.2263     11.2975  39.0851    293.604     14.0288     113.604     
1 1 1 25 18 23 o 3  70.5632 3.23492 93.2107     10.9532  87.2585     11.7469  32.6754    91.4736     37.1497     271.474     
1 1 1 25 18 24 o 3  19.27   5.46757 1.75206     7.61235  5.79306     8.55885  0.490488   89.9487     17.8633     89.9487     
1 1 1 25 18 25 o 19 74.2402 3.19869 101.982     11.5043  97.7731     12.1544  66.456     0.885767    26.8822     0.885767    
1 1 1 25 18 26 o 11 74.1302 3.35143 100.392     11.4884  99.265      13.2025  52.4645    41.6465     1.93279     221.647     
1 1 1 25 18 27 o 16 21.4365 5.80117 9.52236     8.99463  2.70675     8.77452  2.2741     107.359     17.1205     287.359     
1 1 1 25 18 28 o 18 26.2454 5.97128 11.6166     8.23527  14.411      9.60559  1.78727    202.744     0.474505    202.744     
1 1 1 25 18 29 o 5  46.0059 4.80878 47.0768     10.4437  33.4172     10.7263  41.7326    30.9134     26.8572     30.9134     
1 1 1 25 18 30 o 8  33.5889 5.48288 20.6449     8.55761  23.4027     9.53387  22.6996    254.967     7.7713      254.967     
1 1 1 25 18 31 o 6  91.4056 2.98758 150.671     12.9714  151.617     14.2939  55.6151    300.018     21.1816     120.018     
1 1 1 25 18 32 o 8  24.7139 5.91162 11.7699     8.17404  10.4517     9.30365  3.00848    80.35       24.2295     260.35      
1 1 1 25 18 33 o 5  84.4871 3.09825 126.512     12.4036  132.581     13.7327  72.8971    86.7259     24.9054     86.7259     
1 1 1 25 18 34 f 0  97.0123 3.11634 182.534     13.9969  159.473     15.9549  70.1007    141.771     0           0           
1 1 1 25 18 35 o 7  28.4061 5.70339 7.75975     8.42249  23.9454     9.64958  16.7024    231.647     3.98004     231.647     
1 1 1 25 18 36 o 4  42.086  5.06331 40.6828     9.47668  28.0075     10.6859  29.5681    150.321     2.35379     150.322     
1 1 1 25 18 37 o 6  18.5295 5.28999 8.40854     7.88098  -7.92621    9.3127   0.377964   234.406     21.6201     234.406     
1 1 1 25 18 38 o 15 32.5458 5.8203  24.4452     9.02428  18.0011     10.1879  20.7277    14.5177     0.184073    194.517     
1 1 1 25 18 39 o 3  62.6585 3.93972 73.2981     11.4882  73.1635     12.9369  42.0139    77.2115     4.46767     257.212     
1 1 1 25 18 40 o 7  42.6238 4.95478 35.087      9.57507  35.6086     10.8217  23.7893    117.807     11.0268     297.807     
1 1 1 25 18 41 o 7  49.2605 4.17142 48.294      10.0168  43.7447     10.1341  38.6921    301.597     9.7248      301.597     
1 1 1 25 18 42 o 6  42.7792 5.40904 47.0531     9.88752  26.8002     11.7027  40.0004    42.4734     25.7115     42.4734     
1 1 1 25 18 43 o 16 37.8066 5.28778 32.0929     9.62373  25.3035     9.68468  18.9087    290.418     13.2894     110.418     
1 1 1 25 18 44 o 13 44.7794 4.87938 34.3853     10.6739  44.6705     10.2988  28.1985    341.981     4.65834     161.981     
1 1 1 25 18 45 o 10 21.9525 5.8517  10.2408     8.97303  6.18949     8.69116  0.919419   84.7668     29.323      84.7668     
1 1 1 25 18 46 o 4  66.7568 3.61049 78.4674     11.818   88.8249     12.1352  58.9838    352.689     25.8294     352.689     
1 1 1 25 18 47 o 18 52.3402 4.23516 52.5449     10.8992  52.8281     10.9186  35.48      62.29       0.517375    242.29      
1 1 1 25 18 48 o 19 20.4888 5.87978 9.24258     10.1146  1.32729     9.02374  5.65235    180.456     2.7302      0.455831    
1 1 1 25 18 49 o 2  45.1746 5.61943 41.9394     12.2767  41.8368     12.2382  38.1287    325.65      18.5772     325.65      
1 1 1 25 18 50 o 12 45.7655 5.55181 33.4862     12.9618  52.8079     10.6287  33.7895    153.462     7.53838     153.462     
1 1 1 25 18 51 o 10 39.6147 5.79238 31.3957     12.0083  34.0065     10.1874  31.2809    278.14      12.9771     278.14      
1 1 1 25 18 52 o 17 68.531  3.94638 96.0147     14.3453  83.0118     12.543   58.3477    111.551     23.2972     111.551     
1 1 1 25 18 53 o 4  38.0685 5.96981 15.6603     13.1779  46.2416     10.5179  27.882     240.277     7.06258     240.277     
1 1 1 25 18 54 o 19 47.1189 5.27113 44.5733     12.6683  45.6591     11.3176  39.7261    347.052     17.8804     347.052     
1 1 1 25 18 55 o 11 21.7618 6.05729 14.3015     10.9288  0.131816    9.37428  9.34797    178.096     2.53165     358.096     
1 1 1 25 18 56 o 6  51.8907 5.3519  65.0483     13.5171  46.7243     13.1814  40.9602    220.304     13.3128     220.304     
1 1 1 25 18 57 o 10 45.1594 6.5482  52.6987     15.6763  39.5098     13.0226  41.1869    55.3937     29.1087     55.3937     
1 1 1 25 18 58 o 8  28.976  7.83105 20.2398     16.4219  22.0266     15.3549  14.7124    216.294     2.94824     36.2942     
1 1 1 25 18 59 o 4  42.3712 7.43644 48.8723     17.4558  40.877      14.0015  32.6864    267.656     14.5538     267.656     
1 1 1 25 18 60 o 1  27.0956 7.11252 34.8979     16.3703  0.3125      11.9492  10.6001    63.2369     2.5646      63.2369     
1 1 1 25 18 61 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 18 62 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 19 0  o 16 15.6643 6.63466 4.86812     9.29809  4.86812     9.29809  29.3089    180         80.5268     180         
1 1 1 25 19 1  o 19 124.047 3.0448  287.165     18.4135  266.362     19.3169  98.319     58.2911     11.3163     58.2911     
1 1 1 25 19 2  o 5  60.4521 3.81205 63.3187     11.6673  70.0038     11.1211  52.9335    345.777     20.3147     345.777     
1 1 1 25 19 3  o 15 63.8681 3.57213 70.181      11.2052  78.0592     11.4613  33.1936    141.212     27.0306     321.212     
1 1 1 25 19 4  o 13 75.0907 3.27988 99.565      11.74    104.202     12.8196  77.676     61.2155     48.207      61.2155     
1 1 1 25 19 5  o 7  60.7485 3.62155 62.5784     10.3118  71.807      11.5449  51.6934    76.1826     17.0153     76.1826     
1 1 1 25 19 6  o 17 84.2672 3.32873 118.326     12.1756  138.698     15.8054  87.6605    17.1788     53.448      17.1788     
1 1 1 25 19 7  o 15 21.5247 5.98904 5.19104     8.70628  5.94772     10.2349  9.65262    321.25      45.792      321.25      
1 1 1 25 19 8  o 14 98.9444 3.15259 172.294     14.7073  180.675     16.4603  87.821     34.9298     29.4614     34.9298     
1 1 1 25 19 9  o 1  62.1108 3.74571 71.3554     11.0822  69.29       11.9747  36.1156    141.48      18.0799     321.48      
1 1 1 25 19 10 o 4  54.5937 3.96707 50.238      10.3286  59.2397     11.0592  47.6501    298.894     19.6066     298.894     
1 1 1 25 19 11 o 19 41.2445 5.33842 24.0821     9.95341  41.7497     11.2369  26.7024    13.7607     1.92393     193.761     
1 1 1 25 19 12 o 5  69.4604 3.30069 88.761      11.5064  86.0109     11.3391  64.1402    54.0724     28.679      54.0724     
1 1 1 25 19 13 o 2  24.1273 5.58181 14.9421     7.90644  4.74792     8.6151   0.00353027 103.728     29.268      103.736     
1 1 1 25 19 14 o 16 84.1023 3.1158  125.006     13.1069  130.477     13.0599  59.2517    347.627     5.26405     167.627     
1 1 1 25 19 15 o 15 57.2136 3.71389 53.9844     9.97564  66.018      11.084   35.3648    40.3814     11.5442     220.381     
1 1 1 25 19 16 o 3  32.6456 5.41329 19.8646     8.37852  21.3449     9.0271   10.4272    45.8553     22.482      225.855     
1 1 1 25 19 17 o 10 18.476  5.33352 6.05337     7.71515  -2.60665    8.63096  4.02247    121.983     26.5633     121.983     
1 1 1 25 19 18 o 14 72.4467 3.74419 100.883     11.9696  90.9624     14.6755  48.3018    316.286     9.04214     136.286     
1 1 1 25 19 19 o 5  43.3816 4.71705 39.0835     9.78987  31.9548     9.96076  23.6662    116.116     12.9586     296.116     
1 1 1 25 19 20 o 9  36.8725 5.31365 25.0401     9.39509  27.3673     9.57694  15.4911    57.7489     19.1705     237.749     
1 1 1 25 19 21 o 13 62.0768 3.67204 71.3923     10.9647  69.6626     11.6489  38.8884    289.876     11.8242     109.876     
1 1 1 25 19 22 o 2  35.1541 5.33908 28.1424     8.60518  19.7823     9.67138  11.5527    99.4021     24.7446     279.402     
1 1 1 25 19 23 o 12 87.0415 3.05579 145.136     12.8079  129.289     13.6627  62.3834    290.897     2.5754      110.897     
1 1 1 25 19 24 o 14 81.7888 3.11331 124.939     12.185   117.59      13.1781  70.098     113.559     21.5541     113.559     
1 1 1 25 19 25 o 1  41.1273 4.81463 30.6801     9.15227  33.6282     10.0051  32.3466    173.148     11.0846     173.148     
1 1 1 25 19 26 o 9  47.658  4.22906 41.6322     9.46795  43.0757     10.281   11.2673    273.506     45.5936     93.5063     
1 1 1 25 19 27 o 2  92.4805 3.19718 157.067     14.5886  153.45      14.9482  65.4256    247.557     4.12052     67.5574     
1 1 1 25 19 28 f 0  17.5598 5.40004 -1.20106    8.63367  0.30888     9.10271  13.286     7.75927     0           0           
1 1 1 25 19 29 o 14 37.6963 5.31844 30.6347     9.37278  24.6459     9.98058  23.1516    137.021     3.949       317.021     
1 1 1 25 19 30 o 14 84.3588 3.14717 132.254     13.1657  126.508     13.3397  66.8901    354.597     11.704      354.597     
1 1 1 25 19 31 o 2  59.514  3.81427 67.8904     11.021   63.0304     11.445   44.4075    192.866     4.26925     192.866     
1 1 1 25 19 32 o 15 124.673 2.80941 284.319     17.5902  277.975     17.4703  106.608    261.321     31.585      261.321     
1 1 1 25 19 33 o 10 56.2152 3.98911 51.6346     10.7839  66.5045     11.2887  43.3854    195.376     7.38022     195.376     
1 1 1 25 19 34 o 16 20.5629 5.59541 11.4467     8.5877   -4.36146    9.61343  7.09725    260.688     5.11118     80.6881     
1 1 1 25 19 35 o 11 26.7734 6.08451 18.8472     9.05951  7.69164     10.6603  16.298     71.9189     4.04017     71.9189     
1 1 1 25 19 36 o 15 44.1965 4.81611 35.7882     10.0172  39.7127     10.6349  26.5689    322.794     8.39197     142.794     
1 1 1 25 19 37 o 9  27.5971 6.08981 18.5103     9.10214  11.7111     10.022   6.71545    243.235     4.30286     243.235     
1 1 1 25 19 38 o 10 21.8479 5.84392 5.94938     9.1852   9.37333     8.51225  9.55321    292.489     0.313957    112.489     
1 1 1 25 19 39 o 4  28.9374 5.87742 21.979      9.43431  12.4369     8.91041  18.8035    328.175     2.27356     328.175     
1 1 1 25 19 40 o 14 23.9177 5.95195 13.2267     9.14788  8.44667     8.7034   4.5119     306.737     21.4231     126.737     
1 1 1 25 19 41 o 11 50.2173 4.38184 49.2899     11.1313  47.8562     10.4508  38.8474    144.917     8.35371     144.917     
1 1 1 25 19 42 o 16 62.7744 3.77543 79.3649     11.5485  69.3365     11.8956  59.4704    132.298     31.9618     132.298     
1 1 1 25 19 43 o 1  51.772  4.30515 44.5454     10.9493  59.1783     10.6582  29.0933    118.333     13.9254     298.333     
1 1 1 25 19 44 o 10 48.0939 4.77019 42.6296     11.6327  48.4394     10.5354  45.7865    292.62      28.8399     292.62      
1 1 1 25 19 45 o 7  39.4808 5.841   23.6665     11.343   42.1982     11.1452  26.1339    64.7066     0.238886    64.7068     
1 1 1 25 19 46 o 8  21.8896 6.12854 11.3269     10.4067  3.04314     9.96342  7.19773    350.437     7.31803     170.437     
1 1 1 25 19 47 o 17 32.7115 6.40716 25.5407     11.1139  21.0841     10.6639  22.6207    259.989     8.32818     259.989     
1 1 1 25 19 48 f 0  20.3372 5.99202 9.15691     10.8836  -0.997157   9.8285   7.81256    356.03      0           0           
1 1 1 25 19 49 o 15 18.6792 5.75754 2.50057     10.2701  -0.329537   10.0232  4.06851    268.993     2.56917     88.9933     
1 1 1 25 19 50 o 9  32.9264 6.6155  17.4833     12.109   30.0469     11.5189  25.2904    198.552     13.424      198.552     
1 1 1 25 19 51 o 4  19.8938 5.9369  -2.81966    10.9673  7.95983     10.1378  3.11191    51.0828     16.7753     231.083     
1 1 1 25 19 52 o 5  24.7951 6.55886 8.70654     11.6758  15.0582     10.7105  11.0017    296.648     7.13805     116.648     
1 1 1 25 19 53 o 6  33.4265 6.6692  33.3403     13.1994  18.1803     10.4466  25.8991    211.625     15.9516     211.625     
1 1 1 25 19 54 o 11 37.1528 6.71478 37.7944     13.8808  25.9601     11.3128  28.3579    11.5258     10.5986     11.5258     
1 1 1 25 19 55 o 9  23.9639 6.98676 11.6754     15.5353  9.75264     11.6561  9.79686    23.1673     2.018       23.1673     
1 1 1 25 19 56 o 2  21.7018 6.67669 11.9744     15.2862  0.304655    11.7526  4.73187    31.4315     0.232336    211.431     
1 1 1 25 19 57 o 11 21.4649 6.66621 6.59684     15.8756  4.80448     11.698   5.55005    46.2861     3.18155     226.286     
1 1 1 25 19 58 o 19 24.6118 7.1608  6.49604     17.7639  16.7582     12.563   8.70738    166.773     1.94147     346.773     
1 1 1 25 19 59 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 20 0  f 0  31.5772 7.27941 23.1629     10.198   23.1629     10.198   65.0126    180         0           0           
1 1 1 25 20 1  o 1  27.1157 5.99481 6.71449     9.61398  19.9979     9.58677  10.0059    245.546     11.2694     65.546      
1 1 1 25 20 2  o 2  24.1476 5.96147 3.66299     9.3539   15.0647     9.36014  6.89956    263.323     10.2634     83.3229     
1 1 1 25 20 3  f 0  101.844 3.02246 191.641     14.6038  182.719     16.0953  79.6142    315.128     0           0           
1 1 1 25 20 4  o 13 47.7501 4.32361 51.1118     9.94438  34.4364     9.89578  37.7307    197.777     9.32313     197.777     
1 1 1 25 20 5  o 3  51.745  4.07135 47.6308     10.5523  51.2641     10.1681  31.2421    321.565     11.9011     141.565     
1 1 1 25 20 6  o 16 27.1342 5.64049 18.3909     8.13284  9.17638     8.89167  3.63708    125.284     27.7304     305.284     
1 1 1 25 20 7  o 14 83.0884 3.06623 115.451     12.1192  134.503     13.3355  78.0293    325.301     34.089      325.301     
1 1 1 25 20 8  o 16 32.0568 5.54383 24.4284     8.71771  15.5502     9.19209  12.9246    240.697     16.3061     60.697      
1 1 1 25 20 9  o 2  20.2245 5.57608 6.13574     7.60437  4.04299     8.79561  1.92177    185.647     13.7688     5.64667     
1 1 1 25 20 10 o 5  20.8469 5.29361 13.1274     7.92758  -4.8036     8.59174  1.98152    230.731     16.7836     50.7306     
1 1 1 25 20 11 o 1  88.1935 3.31214 148.405     13.6552  133.997     15.3374  67.7228    278.287     4.8449      278.287     
1 1 1 25 20 12 o 8  36.3967 5.85921 15.7734     9.18348  37.8715     12.2326  26.1896    256.16      7.70857     256.16      
1 1 1 25 20 13 o 15 41.7759 5.17377 37.3689     9.74424  29.4897     10.9185  35.5688    43.0183     22.435      43.0183     
1 1 1 25 20 14 o 10 23.3518 5.82373 14.1594     8.52048  1.58271     9.94426  4.39378    210.897     17.667      30.8975     
1 1 1 25 20 15 o 11 40.532  5.25894 33.414      9.45494  29.685      11.0059  32.8803    106.107     13.9106     106.107     
1 1 1 25 20 16 o 13 37.2988 5.60336 29.5602     9.42466  24.6036     10.8602  20.8595    205.685     8.69643     25.6845     
1 1 1 25 20 17 o 13 73.5912 3.7016  101.739     12.6256  96.5993     14.3712  38.0385    82.9762     32.3619     262.976     
1 1 1 25 20 18 o 17 39.0553 5.25909 30.4792     9.74108  28.3443     10.0823  24.3861    7.28815     4.21362     187.288     
1 1 1 25 20 19 o 12 65.0238 3.57511 79.3251     10.6126  75.4737     12.3658  52.5121    202.49      11.0345     202.49      
1 1 1 25 20 20 o 9  35.4846 5.61937 24.1159     9.67473  25.1973     9.81421  20.253     205.424     6.64904     25.4235     
1 1 1 25 20 21 o 2  66.7529 3.46109 76.6585     11.0771  86.3402     11.9224  42.2394    92.3278     12.8382     272.328     
1 1 1 25 20 22 o 17 25.9816 5.84758 8.29167     8.37709  17.2095     9.19236  8.72415    251.451     13.9533     71.4513     
1 1 1 25 20 23 o 13 24.2512 5.76265 4.13153     8.30461  16.4979     9.18994  9.5428     41.3025     2.09003     221.303     
1 1 1 25 20 24 o 9  36.6485 5.38693 27.7657     8.97456  24.608      10.1441  27.9276    270.651     9.73409     270.651     
1 1 1 25 20 25 o 2  15.281  4.89255 -3.03473    7.54816  -4.17508    8.55613  0.84388    157.999     10.2327     157.999     
1 1 1 25 20 26 o 9  91.4388 3.07692 153.887     13.7301  149.89      14.3689  84.2727    129.098     35.0998     129.098     
1 1 1 25 20 27 o 16 41.4082 5.20929 33.0706     9.29513  33.3361     11.4411  19.5771    45.6599     19.0109     225.66      
1 1 1 25 20 28 o 12 37.5321 5.63595 24.2504     10.3864  31.5858     10.1784  31.9184    314.577     17.6905     314.577     
1 1 1 25 20 29 o 12 56.2007 4.36561 70.8004     10.8803  48.8876     12.4326  27.0151    55.0766     27.0947     235.077     
1 1 1 25 20 30 o 10 73.9904 3.53923 110.163     11.9397  91.875      13.7856  59.5052    129.419     11.8145     129.419     
1 1 1 25 20 31 o 18 49.7577 4.44036 44.7028     10.4411  49.3949     11.2159  20.1274    317.065     31.1406     137.065     
1 1 1 25 20 32 o 12 30.9755 5.56306 30.0233     9.06645  7.52032     10.3098  17.3284    325.279     6.27714     145.279     
1 1 1 25 20 33 o 19 21.3141 5.86595 7.75509     8.46989  5.41634     9.66408  7.99672    193.533     7.29403     13.5333     
1 1 1 25 20 34 o 10 22.19   6.05263 9.63136     8.54941  4.78175     10.9779  2.84984    229.722     34.8298     229.722     
1 1 1 25 20 35 o 1  80.8992 3.28809 125.063     13.5087  116.559     13.0401  58.2906    89.9587     0.338303    269.959     
1 1 1 25 20 36 o 6  30.7462 5.89179 17.0481     9.34477  22.0987     9.36783  16.4241    90.7667     7.73861     270.767     
1 1 1 25 20 37 o 8  33.077  5.82068 26.8589     9.96404  18.6847     9.39701  19.2905    49.8784     5.42018     229.878     
1 1 1 25 20 38 o 8  19.7156 5.71055 7.17037     8.80138  0.695737    9.59446  6.3404     267.957     1.7564      87.9568     
1 1 1 25 20 39 f 0  44.081  4.85404 41.0928     10.5031  35.7922     10.2225  24.6923    104.559     0           0           
1 1 1 25 20 40 o 3  36.4321 5.99187 22.4219     11.0216  33.6757     10.6595  19.1714    143.179     10.8844     323.179     
1 1 1 25 20 41 o 10 105.965 3.22196 212.656     17.2926  203.812     16.8478  91.4592    275.029     31.3197     275.029     
1 1 1 25 20 42 o 8  40.8652 5.88068 39.2451     11.5559  30.7277     11.7023  25.5968    314.295     3.91403     134.295     
1 1 1 25 20 43 o 17 19.0096 5.73673 7.07895     10.2183  -3.77316    9.67796  4.10533    260.563     4.26769     80.563      
1 1 1 25 20 44 o 12 34.9652 6.35297 28.5482     11.4581  24.6066     10.9482  17.152     85.067      11.5232     265.067     
1 1 1 25 20 45 o 16 19.5648 5.83219 -2.24728    10.4465  7.4028      9.77589  5.03444    181.52      6.32612     1.5201      
1 1 1 25 20 46 o 1  39.9543 5.98707 50.1615     12.1714  19.6397     11.6951  31.3781    253.302     11.0188     253.302     
1 1 1 25 20 47 o 17 20.1277 5.97302 -1.14625    10.7564  7.85323     10.178   6.64863    145.815     0.951903    325.815     
1 1 1 25 20 48 o 14 48.5987 5.37847 49.5125     12.9279  46.8168     12.4138  36.0721    193.861     5.97993     193.861     
1 1 1 25 20 49 o 17 45.5137 6.05631 36.8065     13.0784  51.7361     13.4553  35.5352    284.84      10.1909     284.84      
1 1 1 25 20 50 o 1  54.8245 5.63342 55.1258     15.1916  70.2949     14.4546  42.9142    110.916     11.1303     110.916     
1 1 1 25 20 51 o 8  24.9398 6.74218 17.6828     12.2322  6.90849     11.8954  8.82707    147.352     12.794      327.352     
1 1 1 25 20 52 o 2  26.7054 6.74515 23.6037     12.3083  7.1659      11.9257  14.544     60.3813     1.48414     240.381     
1 1 1 25 20 53 o 8  30.3141 7.27861 26.1728     13.4797  19.3561     13.102   18.2454    161.472     1.20982     161.472     
1 1 1 25 20 54 o 4  22.5271 6.93877 4.201       15.7524  9.63235     13.9448  7.44775    192.778     1.35887     12.7782     
1 1 1 25 20 55 o 11 25.2202 8.0568  31.6749     26.9763  -0.0444256  14.2867  5.11451    98.9373     1.15151     98.9373     
1 1 1 25 20 56 f 0  22.2585 7.26494 5.50862     26.4476  4.16226     11.8624  2.20643    64.605      0           0           
1 1 1 25 20 57 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 21 0  o 10 37.7249 5.75999 29.1481     9.55223  29.1481     9.55223  36.1768    180         21.3422     180         
1 1 1 25 21 1  o 19 20.0271 5.69127 4.50236     8.75511  4.11694     8.71287  0.912428   264.577     1.08673     84.5767     
1 1 1 25 21 2  o 15 24.1898 5.92467 5.72887     9.24386  14.1443     8.88708  7.73709    229.059     11.0965     49.0589     
1 1 1 25 21 3  o 13 28.3131 5.98098 9.75505     9.3842   21.0105     9.58341  13.2293    165.394     7.74909     345.394     
1 1 1 25 21 4  o 16 67.3851 3.62595 86.419      12.2294  79.9225     12.0665  26.8744    285.996     46.4477     105.996     
1 1 1 25 21 5  o 6  32.908  5.89547 17.9688     9.84544  24.7949     9.76399  19.8189    271.233     10.7602     271.233     
1 1 1 25 21 6  o 19 35.6169 5.6657  31.3643     10.0149  18.7418     9.91633  26.4633    279.811     9.2978      279.811     
1 1 1 25 21 7  o 18 40.4899 5.41696 26.8752     10.223   36.9197     10.9426  19.0542    156.535     19.0661     336.535     
1 1 1 25 21 8  o 5  71.8224 3.48599 90.116      12.3728  98.4005     12.5571  48.9584    83.9237     8.35243     263.924     
1 1 1 25 21 9  o 3  26.891  5.82201 10.0684     8.20269  17.8446     9.22187  13.1396    102.804     2.6426      282.804     
1 1 1 25 21 10 o 8  28.3961 5.96466 14.2166     8.89159  17.2852     9.35239  12.6003    99.4933     10.0589     279.493     
1 1 1 25 21 11 o 8  64.1921 3.4508  71.6617     10.4567  79.0825     11.5851  50.9877    231.613     8.22373     231.613     
1 1 1 25 21 12 o 1  66.94   3.3705  84.579      10.7682  79.0112     11.6328  57.8256    295.132     18.019      295.132     
1 1 1 25 21 13 o 6  43.3537 4.70183 39.4762     9.50243  31.9263     10.0998  19.0865    218.909     23.8766     38.9086     
1 1 1 25 21 14 o 7  57.2751 3.77164 60.1283     10.3492  60.7774     11.043   39.5329    105.972     4.16962     285.972     
1 1 1 25 21 15 o 12 54.0978 3.96171 48.3003     10.2049  60.4657     10.921   39.9675    333.725     2.04959     333.725     
1 1 1 25 21 16 o 17 37.5665 5.99385 25.8325     10.5264  30.2316     11.5185  29.932     111.064     13.007      111.064     
1 1 1 25 21 17 o 9  48.6607 4.70191 34.464      10.518   56.4212     11.4245  30.3428    225.971     8.98537     45.9709     
1 1 1 25 21 18 o 15 83.9715 3.33353 121.736     13.5503  135.706     14.395   80.6177    308.345     37.9891     308.345     
1 1 1 25 21 19 o 5  54.9379 4.39253 52.4193     11.3361  60.9158     12.4326  48.7739    5.34247     19.5539     5.34247     
1 1 1 25 21 20 o 17 42.3564 5.33358 35.1055     10.2193  34.5391     11.5487  36.1311    192.297     27.9678     192.297     
1 1 1 25 21 21 o 2  39.1158 5.98459 22.9375     11.3013  38.6773     11.6429  19.4639    256.953     15.8941     76.9526     
1 1 1 25 21 22 o 17 21.6583 6.08396 3.81104     9.18589  8.25372     10.586   6.39815    105.928     0.858711    285.928     
1 1 1 25 21 23 o 12 30.1928 6.1674  13.8237     9.64215  22.8489     10.3695  6.6601     188.779     28.1407     8.77916     
1 1 1 25 21 24 o 11 29.9205 5.94085 21.2235     8.95403  14.4333     9.9435   8.53009    4.88193     23.8542     184.882     
1 1 1 25 21 25 o 16 36.8653 5.53729 25.1711     9.42194  28.8887     10.4155  22.8371    118.09      5.27009     298.09      
1 1 1 25 21 26 o 18 25.3622 6.10758 9.59211     8.71231  15.0311     9.96685  1.13206    48.1694     32.0145     228.169     
1 1 1 25 21 27 o 17 31.9771 5.55699 31.8257     9.15724  8.71849     10.3806  13.8773    206.944     16.168      26.9437     
1 1 1 25 21 28 o 19 75.7428 3.60646 98.0973     12.6646  114.888     14.5741  60.8084    233.139     11.0302     233.139     
1 1 1 25 21 29 o 5  62.6842 4.23339 86.4826     12.6189  62.9973     13.1983  50.435     252.033     10.3098     252.033     
1 1 1 25 21 30 f 0  19.1524 5.63913 3.79548     8.32966  2.57978     9.63377  13.5964    318.4       0           0           
1 1 1 25 21 31 o 18 79.2051 3.38969 101.301     12.6072  132.044     14.1566  68.8524    166.159     22.5581     166.159     
1 1 1 25 21 32 o 10 45.6411 4.63827 34.6049     10.2772  46.7417     10.0572  27.5516    43.0669     9.70658     223.067     
1 1 1 25 21 33 o 11 20.7518 5.62337 -0.0864599  8.76053  11.5637     8.68952  8.33552    292.221     5.09022     112.221     
1 1 1 25 21 34 o 16 35.5833 5.61699 31.7488     9.96657  20.7448     9.68982  15.279     152.699     18.7444     332.699     
1 1 1 25 21 35 o 16 50.5177 4.59202 44.8319     11.7625  54.8397     10.6003  43.5076    224.204     16.4737     224.204     
1 1 1 25 21 36 o 17 37.8283 6.02531 34.0314     11.4076  26.394      10.9405  24.3078    211.39      2.82283     31.3901     
1 1 1 25 21 37 o 7  41.4936 5.4861  38.1054     10.9559  32.4159     10.9951  18.1397    244.597     21.7462     64.5968     
1 1 1 25 21 38 o 4  24.1447 6.30981 13.2401     10.2859  8.99088     10.0289  12.0626    243.867     0.828703    63.8674     
1 1 1 25 21 39 o 1  42.4647 5.95855 36.5052     11.8395  39.2867     12.6289  31.115     284.582     4.81699     284.582     
1 1 1 25 21 40 o 17 44.8603 5.6717  42.8689     12.0541  40.4778     12.4907  36.8263    33.9985     13.5503     33.9985     
1 1 1 25 21 41 o 19 54.8013 4.83105 64.6566     12.8136  54.7235     13.0127  51.6302    105.569     28.9092     105.569     
1 1 1 25 21 42 o 5  30.9837 6.12404 32.9409     11.1705  7.69203     11.1832  14.1727    221.412     11.9229     41.412      
1 1 1 25 21 43 o 2  56.2252 4.79015 59.125      13.0923  66.2242     13.3275  54.8088    346.395     33.1248     346.395     
1 1 1 25 21 44 o 9  19.4811 5.87791 6.93686     10.4031  -2.54077    10.3693  5.30831    213.499     0.669689    33.4996     
1 1 1 25 21 45 o 2  16.6205 5.37854 -2.1431     10.2106  -5.54036    9.95318  3.63542    110.859     6.3417      290.859     
1 1 1 25 21 46 o 9  19.7226 6.04545 5.97974     11.5515  -1.72131    10.7327  7.20036    325.03      1.24054     145.03      
1 1 1 25 21 47 o 1  25.4514 6.61211 -0.150604   13.0011  22.1506     12.0128  13.988     6.57374     6.37286     6.57374     
1 1 1 25 21 48 o 4  38.7519 6.70268 23.1794     13.9272  45.9767     13.0647  30.1928    334.238     10.0939     334.238     
1 1 1 25 21 49 o 3  21.733  6.35359 14.7883     12.5554  -2.77685    11.114   7.56314    359.939     9.38571     179.939     
1 1 1 25 21 50 o 10 54.3695 6.78912 73.44       20.4951  62.6491     14.895   45.4656    252.474     17.7632     252.474     
1 1 1 25 21 51 o 8  37.3311 7.86064 47.6377     17.9431  27.3209     13.9527  25.5251    359.336     4.29519     359.336     
1 1 1 25 21 52 o 1  24.6975 7.47097 12.4677     16.8025  12.6691     16.0799  10.0407    130.2       4.72646     310.2       
1 1 1 25 21 53 o 6  21.5098 7.2884  -10.6593    16.5346  7.42805     26.0971  0.480138   145.624     0.138665    325.624     
1 1 1 25 21 54 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 21 55 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 22 0  o 14 44.3164 5.06672 38.3199     10.3706  38.3199     10.3706  47.9593    1.0784e-05  29.8672     1.0784e-05  
1 1 1 25 22 1  o 11 36.375  5.55903 30.7249     9.8917   21.4984     9.84154  28.6979    89.5398     11.2587     89.5398     
1 1 1 25 22 2  o 14 91.0879 3.06459 146.005     13.9505  155.319     13.9364  89.7735    332.76      43.8962     332.76      
1 1 1 25 22 3  o 2  71.4407 3.39224 98.0868     12.1285  88.6424     12.0009  48.8709    69.8976     8.5758      249.898     
1 1 1 25 22 4  o 6  63.5712 3.70619 72.3294     11.8939  76.5361     11.484   56.3031    150.074     19.6464     150.074     
1 1 1 25 22 5  f 0  18.2793 5.45919 -3.33657    8.73902  4.97636     8.89838  28.9318    345.503     0           0           
1 1 1 25 22 6  o 18 115.03  2.86681 242.294     16.5302  236.528     16.4692  94.113     132.37      15.0637     132.37      
1 1 1 25 22 7  o 13 47.9115 4.51859 42.7882     10.4978  43.861      10.6605  37.5738    59.5409     6.86977     59.5409     
1 1 1 25 22 8  o 10 18.5805 5.59278 1.43041     9.12376  1.13029     9.13678  1.75726    286.208     14.071      106.208     
1 1 1 25 22 9  o 8  32.0585 5.74496 7.74187     10.384   32.603      10.1552  10.2812    245.189     23.8547     65.1885     
1 1 1 25 22 10 o 13 35.7469 5.97786 32.8874     11.0298  18.6647     10.3746  28.8494    87.5135     14.3181     87.5135     
1 1 1 25 22 11 o 19 58.5379 4.00062 60.3076     10.8251  67.144      12.3592  42.6563    30.7333     0.510298    210.733     
1 1 1 25 22 12 o 8  20.7216 5.74986 1.19412     8.34278  9.48287     9.47144  6.20467    173.443     5.60386     353.443     
1 1 1 25 22 13 o 19 44.7145 4.794   36.6353     9.89647  39.8146     10.9183  21.004     124.015     22.8166     304.015     
1 1 1 25 22 14 o 12 23.981  5.92572 3.93167     8.40768  16.1838     9.91908  9.78781    310.616     8.67868     130.616     
1 1 1 25 22 15 o 4  22.737  6.07116 13.4249     9.67039  -0.74179    10.8331  9.27567    156.693     5.81563     336.693     
1 1 1 25 22 16 o 17 30.599  6.04513 19.4606     9.49065  18.1987     9.77577  13.3502    355.616     14.9413     175.616     
1 1 1 25 22 17 o 14 27.4933 5.80328 20.5656     8.65904  8.19689     9.72509  8.91       10.0555     5.35126     10.0555     
1 1 1 25 22 18 o 15 68.0673 3.48924 83.3154     11.3025  87.4401     12.3358  52.0565    49.2541     3.62182     49.2541     
1 1 1 25 22 19 o 6  52.8888 4.1761  54.8839     10.4533  50.4494     11.2216  38.6831    10.0781     0.399405    10.0781     
1 1 1 25 22 20 o 14 29.2384 5.5287  4.06704     8.93867  29.6699     10.011   21.5184    230.516     10.0921     230.516     
1 1 1 25 22 21 o 14 43.8593 5.13449 41.3963     10.8175  33.9844     10.8835  17.7019    21.6948     28.2188     201.695     
1 1 1 25 22 22 f 0  98.3147 3.03505 177.895     14.5799  175.387     15.2409  58.5347    197.988     0           0           
1 1 1 25 22 23 o 18 28.8348 6.46315 20.1401     9.9483   13.2437     11.5639  16.0478    276.147     5.7248      96.1472     
1 1 1 25 22 24 o 2  18.2089 5.63629 0.471222    9.11062  -0.640396   10.4944  3.74078    201.882     12.0249     21.8824     
1 1 1 25 22 25 o 17 53.1534 4.81436 59.6993     11.6171  50.0614     13.0772  41.5247    308.36      6.34853     308.36      
1 1 1 25 22 26 o 14 28.7455 6.51423 17.971      9.94027  16.2471     11.4204  19.4468    321.837     3.18132     321.837     
1 1 1 25 22 27 o 12 25.4546 5.98853 21.3445     9.83068  -0.946789   11.3182  11.5991    341.296     9.60971     161.296     
1 1 1 25 22 28 o 14 59.2497 4.16612 69.3465     12.1418  64.5538     12.2493  44.384     194.48      2.77766     194.48      
1 1 1 25 22 29 o 13 25.2135 6.34767 15.8272     10.5789  9.02275     9.84486  3.60638    4.79211     26.6325     184.792     
1 1 1 25 22 30 o 6  22.1425 5.95326 11.7175     9.42428  4.5528      9.20831  4.68574    230.686     1.73071     230.686     
1 1 1 25 22 31 o 9  94.99   3.37151 167.005     15.8528  169.055     16.1436  93.225     41.348      47.7262     41.348      
1 1 1 25 22 32 o 11 34.6902 6.23488 27.7168     11.0807  23.9008     10.6649  28.5926    322.9       13.6104     322.9       
1 1 1 25 22 33 o 11 18.1256 5.43761 9.33848     9.78058  -14.4598    9.82611  4.66475    147.017     5.96815     327.017     
1 1 1 25 22 34 o 15 17.259  5.44022 2.42826     9.79355  -6.05339    9.61495  2.65554    311.004     3.0281      131.004     
1 1 1 25 22 35 o 15 35.1355 6.49159 21.2399     12.006   32.9376     11.5711  21.9472    18.808      2.94849     198.808     
1 1 1 25 22 36 o 15 22.2174 6.1674  1.63466     10.3398  13.2246     10.5637  3.57904    159.855     20.0273     339.855     
1 1 1 25 22 37 o 12 28.5464 6.84633 16.2748     10.9705  19.613      12.3799  17.5942    350.381     4.67867     350.381     
1 1 1 25 22 38 o 17 35.1354 6.50435 23.7006     11.7639  30.8265     11.5739  23.78      4.0947      1.99302     4.09469     
1 1 1 25 22 39 o 18 20.1747 6.00803 2.52256     10.3788  5.80677     10.3904  3.94677    46.95       0.314953    226.95      
1 1 1 25 22 40 o 12 19.2976 5.9078  0.495238    10.8346  3.51479     10.2789  1.69692    274.115     27.0708     274.115     
1 1 1 25 22 41 o 10 66.0051 4.72155 78.4292     15.5015  93.7508     15.1126  53.2509    87.1169     12.8527     87.1169     
1 1 1 25 22 42 o 19 25.709  6.87463 9.18637     12.8949  16.6573     11.8862  14.3537    190.676     1.99742     10.6757     
1 1 1 25 22 43 o 19 22.0113 6.38974 13.5623     12.0099  -2.56912    11.8773  5.11643    217.271     17.0491     37.2711     
1 1 1 25 22 44 o 8  32.1873 7.15517 20.1921     13.131   28.336      12.9517  24.9421    102.88      14.929      102.88      
1 1 1 25 22 45 f 0  48.8957 6.95498 55.3264     18.0859  53.755      14.7267  29.7122    17.8678     0           0           
1 1 1 25 22 46 o 16 32.0877 6.8792  48.9453     16.3616  -9.7501     16.3925  24.6876    110.874     12.0424     110.874     
1 1 1 25 22 47 o 11 53.2985 7.64717 62.4937     20.7045  76.6237     18.6306  47.1177    224.736     22.5485     224.736     
1 1 1 25 22 48 o 8  19.5849 6.41028 3.809       15.3357  -9.97775    14.7532  4.85145    15.3224     8.57636     195.322     
1 1 1 25 22 49 o 5  32.3118 8.33403 35.7464     17.6389  24.7653     18.0418  20.0461    185.863     2.15627     185.863     
1 1 1 25 22 50 o 12 33.3074 8.32134 18.4157     18.5187  46.991      18.8707  21.2386    19.0729     4.22244     19.0729     
1 1 1 25 22 51 o 8  27.2067 7.67249 33.2724     17.2182  -1.35795    18.8272  12.2459    145.929     1.87676     145.929     
1 1 1 25 22 52 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 23 0  o 8  56.4986 4.33719 59.9545     11.9137  59.9545     11.9137  67.2335    360         48.3964     360         
1 1 1 25 23 1  o 6  49.8265 4.82718 58.1858     11.1716  37.8714     11.6367  37.43      215.195     2.13861     215.195     
1 1 1 25 23 2  o 11 80.282  3.29733 109.727     13.1919  126.755     13.1659  71.2987    269.827     22.3617     269.827     
1 1 1 25 23 3  o 3  56.8675 4.14407 70.6948     11.5436  51.3048     11.4565  48.3644    198.932     13.1618     198.932     
1 1 1 25 23 4  f 0  34.884  5.70683 14.2912     10.2203  35.2276     10.1444  5.17614    174.14      0           0           
1 1 1 25 23 5  o 12 27.8592 6.22218 16.6017     9.61105  14.2511     9.87677  17.6278    280.581     0.875707    280.581     
1 1 1 25 23 6  o 1  21.1257 5.90073 7.99183     9.27449  3.6785      9.34146  1.95653    159.416     31.9165     159.416     
1 1 1 25 23 7  o 1  25.4374 6.18775 14.9614     9.53772  9.19157     9.83828  13.6582    272.62      3.82127     92.62       
1 1 1 25 23 8  o 4  40.3231 5.32728 32.4897     10.3642  31.546      10.3739  38.0215    91.9602     21.9473     91.9602     
1 1 1 25 23 9  o 13 57.4191 4.42758 68.1785     11.8981  56.9386     12.9071  28.6625    62.0406     28.2126     242.041     
1 1 1 25 23 10 o 19 57.2012 4.28118 61.1565     12.5658  62.4153     11.5606  39.9448    177.611     4.81213     357.611     
1 1 1 25 23 11 o 19 18.7724 5.62691 5.29601     9.24262  -3.02388    9.61206  12.657     306.858     50.8491     306.858     
1 1 1 25 23 12 o 11 55.0407 4.35231 58.4722     12.1497  56.4576     11.4473  41.8304    355.832     2.64952     355.832     
1 1 1 25 23 13 o 19 103.275 2.96091 191.626     14.8244  197.614     15.7572  87.2268    245.094     19.0936     245.094     
1 1 1 25 23 14 o 5  21.5168 6.13305 4.98576     8.80141  7.13256     11.5013  1.06098    225.173     26.1756     45.1735     
1 1 1 25 23 15 o 16 26.4556 6.26051 12.6498     9.21143  15.1507     10.3173  16.3774    358.601     0.452024    358.601     
1 1 1 25 23 16 o 7  61.1917 3.9227  64.9508     11.3708  75.9078     12.4304  53.1097    285.18      16.1552     285.18      
1 1 1 25 23 17 o 8  26.5366 6.16695 17.5033     9.11593  9.83256     10.5379  8.11305    74.3401     19.9092     254.34      
1 1 1 25 23 18 f 0  70.6069 3.69043 96.5149     12.4025  89.7042     13.4403  56.4613    247.39      0           0           
1 1 1 25 23 19 o 2  75.4107 3.58565 104.37      12.8122  107.528     14.1121  59.7423    167.267     7.36589     167.267     
1 1 1 25 23 20 o 3  21.5881 5.82714 11.7674     8.85264  1.24967     9.70784  9.89955    60.6139     4.54262     240.614     
1 1 1 25 23 21 o 8  68.3564 3.95565 95.637      13.3547  81.1901     13.4173  44.9527    176.474     11.4668     356.474     
1 1 1 25 23 22 o 16 55.3988 4.27872 60.8834     11.0414  56.8092     12.211   43.0991    30.5871     5.2934      30.5871     
1 1 1 25 23 23 o 5  30.9308 6.17015 17.9914     9.57692  22.5848     10.4195  18.8363    161.867     4.04514     341.867     
1 1 1 25 23 24 o 6  34.241  5.79784 33.5524     9.72195  15.6342     10.7834  20.6335    245.641     6.21121     65.6409     
1 1 1 25 23 25 o 3  38.7514 5.29031 35.5273     9.96077  25.7408     9.80459  26.8521    101.136     0.691736    281.136     
1 1 1 25 23 26 o 17 63.6427 3.98784 82.4188     12.633   72.1805     12.4981  42.6655    75.9347     8.08439     255.935     
1 1 1 25 23 27 f 0  24.9138 6.52201 8.11776     11.886   15.0386     10.318   26.1146    106.881     0           0           
1 1 1 25 23 28 o 2  50.3218 5.34631 49.1355     12.7093  53.5367     13.426   37.5454    70.848      2.96628     70.848      
1 1 1 25 23 29 o 15 32.0081 7.28549 28.2103     14.6315  18.8038     11.9953  18.2635    221.133     6.06981     41.1332     
1 1 1 25 23 30 o 5  22.1213 6.44837 8.78312     11.9049  4.6336      11.2664  9.42118    316.915     3.70903     136.915     
1 1 1 25 23 31 o 13 46.9309 6.13063 57.6142     14.2964  36.7905     13.3617  40.7095    236.13      16.5796     236.13      
1 1 1 25 23 32 o 3  19.1737 5.91936 9.08129     12.0688  -11.0438    10.6726  3.07408    352.608     14.5771     172.608     
1 1 1 25 23 33 o 10 22.5899 6.67464 11.0347     12.5955  1.26614     13.2387  8.53634    322.019     0.463496    142.019     
1 1 1 25 23 34 o 1  52.7022 5.96779 59.3314     16.4102  57.5968     13.9288  41.0177    198.652     7.74685     198.652     
1 1 1 25 23 35 o 19 38.0925 6.97695 27.3027     12.5101  38.9892     14.4719  26.3964    27.1548     1.57093     27.1548     
1 1 1 25 23 36 o 10 45.8444 6.37752 47.8034     15.3843  43.1777     12.8566  27.9941    346.406     8.47637     166.406     
1 1 1 25 23 37 o 14 56.6945 5.2878  58.4631     14.2     72.4928     15.0359  50.6961    170.403     21.4026     170.403     
1 1 1 25 23 38 o 6  25.6246 6.77088 21.4206     12.9007  3.2246      12.0133  7.79921    62.7693     4.67316     62.7693     
1 1 1 25 23 39 o 5  27.8505 7.09275 16.6157     12.7982  17.6034     12.5049  17.9879    190.177     2.10197     190.177     
1 1 1 25 23 40 o 17 22.816  6.99802 -5.10464    15.2937  12.9318     15.4388  7.71689    227.157     3.09047     227.157     
1 1 1 25 23 41 f 0  40.4161 8.07364 44.0858     17.2487  38.1052     16.9662  10.5974    93.2138     0           0           
1 1 1 25 23 42 o 14 25.1945 7.55251 11.5116     16.5971  11.1857     16.4676  10.0996    47.8347     5.11184     47.8347     
1 1 1 25 23 43 o 17 35.9031 8.36968 33.1222     17.3921  36.6097     17.572   29.3106    359.821     15.8307     359.821     
1 1 1 25 23 44 o 13 53.0283 7.55163 62.428      19.1511  75.4206     19.5983  38.3752    240.195     3.30163     240.195     
1 1 1 25 23 45 o 14 26.3096 7.75387 20.291      17.1363  11.9272     17.0677  12.7882    296.227     4.41809     296.227     
1 1 1 25 23 46 o 4  28.8086 7.92783 33.2561     17.4308  10.0793     17.6309  16.6641    18.872      1.82433     18.872      
1 1 1 25 23 47 o 8  22.609  7.13859 1.71323     17.0175  11.8514     16.3794  6.3673     191.058     0.647986    11.0576     
1 1 1 25 23 48 o 17 23.2089 7.1902  -2.70941    16.6594  18.8119     16.6803  7.48682    106.504     2.1604      286.504     
1 1 1 25 23 49 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 23 50 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 24 0  o 9  16.2129 6.80695 6.20626     9.62587  6.20626     9.62587  3.16941    180         3.25695     360         
1 1 1 25 24 1  o 5  20.623  5.92182 3.04262     9.68043  7.04695     9.57964  0.793671   197.518     29.1165     197.518     
1 1 1 25 24 2  o 16 28.2305 6.34089 14.385      10.1218  18.3965     10.1392  20.3964    239.745     6.7349      239.745     
1 1 1 25 24 3  o 14 52.0159 4.47819 50.6544     11.5672  53.3473     11.2763  46.1922    43.2956     16.1436     43.2956     
1 1 1 25 24 4  o 19 25.8224 6.30035 13.2876     9.94013  13.0353     9.85175  15.1111    40.9765     2.35397     220.977     
1 1 1 25 24 5  o 1  25.5842 6.29897 10.0339     9.77058  15.4999     10.2015  14.6774    192.262     2.91769     12.2617     
1 1 1 25 24 6  o 11 82.4669 3.35258 122.963     13.7826  128.776     13.8057  82.3141    295.493     40.8848     295.493     
1 1 1 25 24 7  o 19 17.227  5.39789 0.413083    9.26009  -2.82788    9.29387  3.68351    315.904     2.30695     135.904     
1 1 1 25 24 8  o 8  47.4586 5.28531 60.4144     11.3508  31.0253     11.8423  48.2658    117.749     29.6235     117.749     
1 1 1 25 24 9  o 18 74.0626 3.67186 96.3486     13.1405  109.009     13.9418  72.7552    339.289     34.9528     339.289     
1 1 1 25 24 10 o 5  42.841  5.76368 54.1793     12.3085  23.2538     11.4231  28.3076    359.653     5.65879     179.653     
1 1 1 25 24 11 o 16 52.2983 4.49259 55.4201     11.5558  50.2992     11.4852  46.7833    310.12      17.0609     310.12      
1 1 1 25 24 12 o 8  42.0648 5.44817 42.626      10.951   29.3565     11.0208  30.0436    359.694     0.709937    179.694     
1 1 1 25 24 13 f 0  25.1533 6.67278 18.5356     11.9264  1.96642     12.5488  10.6418    23.1821     0           0           
1 1 1 25 24 14 o 19 55.1406 4.39459 59.3023     11.9226  57.964      11.9402  35.2024    96.4807     11.4309     276.481     
1 1 1 25 24 15 o 1  52.3512 4.51457 62.6979     10.826   44.2323     11.732   48.6863    217.138     21.3118     217.138     
1 1 1 25 24 16 o 4  49.8334 4.68268 50.8653     11.2827  46.419      11.4852  32.4487    100.846     8.40068     280.846     
1 1 1 25 24 17 o 1  21.4136 5.96196 6.85811     8.83762  7.49562     9.95201  6.63971    113.445     42.7726     113.445     
1 1 1 25 24 18 o 15 21.8247 6.01422 4.21222     8.89521  11.257      10.2527  5.20097    248.784     40.3805     248.784     
1 1 1 25 24 19 o 15 74.7492 3.67462 106.077     13.0525  104.568     14.2593  54.4323    332.919     2.66135     152.919     
1 1 1 25 24 20 o 3  27.2545 6.45561 17.269      9.79832  13.8937     11.1988  14.5127    139.465     6.70187     319.465     
1 1 1 25 24 21 o 5  22.3667 6.4617  3.00901     13.0371  9.89416     10.5383  6.05724    29.5627     16.3472     209.563     
1 1 1 25 24 22 o 19 31.1169 6.66459 26.3273     11.6938  16.402      11.2925  22.6971    246.752     5.43185     246.752     
1 1 1 25 24 23 o 18 79.7073 4.2224  138.807     16.5147  106.838     16.6692  76.5043    51.253      35.297      51.253      
1 1 1 25 24 24 o 2  16.868  5.41051 2.72572     10.3835  -12.4319    10.2602  3.14821    223.656     5.56835     43.6565     
1 1 1 25 24 25 o 19 61.7066 4.89702 64.9612     14.6657  87.1361     14.745   56.7859    288.89      24.0883     288.89      
1 1 1 25 24 26 o 4  26.8053 6.65747 17.739      11.044   12.7012     11.3107  11.9363    284.747     10.6797     104.747     
1 1 1 25 24 27 o 18 33.0523 6.70659 25.6124     11.8109  23.4297     11.577   23.5064    321.212     4.28247     321.212     
1 1 1 25 24 28 o 8  22.4825 6.28374 13.3528     10.889   2.31691     10.8337  9.12076    184.346     5.93178     4.34564     
1 1 1 25 24 29 o 19 24.0058 6.7567  13.2736     13.3012  7.6919      11.0671  11.1763    61.3967     3.23069     241.397     
1 1 1 25 24 30 o 4  27.2783 6.80661 16.7851     11.5649  15.5789     11.6203  7.48678    140.06      4.33035     140.06      
1 1 1 25 24 31 o 12 35.6686 6.76137 37.8745     12.8845  19.9814     12.7211  28.4466    129.207     10.7222     129.207     
1 1 1 25 24 32 o 17 28.3674 6.82239 21.4454     11.8261  14.0455     11.6681  19.2272    307.356     8.75028     307.356     
1 1 1 25 24 33 o 18 53.0694 6.20906 72.9414     15.0249  48.0032     16.0513  49.0752    9.92078     23.367      9.92078     
1 1 1 25 24 34 f 0  36.3677 9.19217 32.2141     21.5828  39.1177     21.0477  20.0913    120.657     0           0           
1 1 1 25 24 35 o 14 33.6372 9.10877 25.0757     21.3032  35.0143     21.8859  21.71      234.055     0.801596    54.0549     
1 1 1 25 24 36 o 11 24.0915 7.68726 15.0433     20.7428  -12.808     19.9801  7.21657    95.3212     16.3697     275.321     
1 1 1 25 24 37 o 6  43.6284 9.42368 57.6718     22.3544  49.7684     22.8834  33.8575    312.616     8.35197     312.616     
1 1 1 25 24 38 o 13 22.955  7.5672  -16.5406    22.8426  7.23973     21.0468  11.5182    184.452     0.0754095   4.45224     
1 1 1 25 24 39 o 13 31.7671 8.6983  34.6286     22.2408  22.066      17.1477  22.4016    191.273     13.5762     191.273     
1 1 1 25 24 40 o 4  18.9947 6.30152 -5.30365    15.255   -5.90335    15.0908  4.74336    281.439     10.7545     101.439     
1 1 1 25 24 41 o 10 22.4979 7.08072 10.9086     16.3639  -0.12255    16.1571  8.76338    180.432     0.996759    180.432     
1 1 1 25 24 42 o 1  23.9553 7.3948  9.81804     16.455   11.3018     17.0665  10.6336    20.7455     4.05505     200.746     
1 1 1 25 24 43 o 14 23.5826 7.27176 19.8227     16.977   -3.31665    16.9582  8.00012    327.754     1.0893      327.754     
1 1 1 25 24 44 o 14 22.2409 7.12635 2.73683     17.1934  8.968       17.1655  6.98141    234.57      2.19987     54.5696     
1 1 1 25 24 45 o 9  19.9443 6.57463 -10.2782    16.5293  5.80778     16.2284  3.96107    144.705     5.53879     324.705     
1 1 1 25 24 46 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 24 47 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 25 0  o 5  83.4808 4.95551 129.293     20.3831  129.293     20.3831  62.354     180         3.21286     8.64824e-06 
1 1 1 25 25 1  o 2  42.3286 6.0311  37.3432     11.3384  37.3432     11.3384  50.1386    29.9999     41.6239     29.9999     
1 1 1 25 25 2  o 5  21.3742 7.72161 13.5444     10.4363  13.5444     10.4363  2.90443    60          26.4275     240         
1 1 1 25 25 3  o 17 100.782 3.15032 184.926     15.84    184.926     15.84    92.8791    270         31.3649     270         
1 1 1 25 25 4  o 17 38.1574 6.78811 32.1779     11.2262  32.1779     11.2262  32.4963    300         6.58987     300         
1 1 1 25 25 5  o 2  44.9769 5.5612  41.0019     11.3887  41.0019     11.3887  54.9901    150         42.1812     150         
1 1 1 25 25 6  o 1  71.7691 3.76359 95.5791     13.3613  95.5791     13.3613  80.0225    180         50.1797     180         
1 1 1 25 25 7  o 11 30.336  7.8406  23.6521     10.9871  23.6521     10.9871  27.8603    30          18.1397     30          
1 1 1 25 25 8  o 12 16.2679 6.91383 6.29431     10.165   6.29431     10.165   3.64784    240         11.2248     60          
1 1 1 25 25 9  o 18 15.0092 6.60703 4.07927     10.0466  4.07927     10.0466  1.36463    90          13.9322     270         
1 1 1 25 25 10 o 7  56.1162 4.8728  61.0758     13.1504  61.0758     13.1504  53.9311    120         22.1105     120         
1 1 1 25 25 11 o 8  42.3303 6.52738 38.3171     12.1304  38.3171     12.1304  33.0542    150         1.46345     150         
1 1 1 25 25 12 o 8  45.8749 7.36929 46.1489     14.7688  46.1489     14.7688  32.1927    180         5.63105     8.65198e-06 
1 1 1 25 25 13 o 11 19.1774 7.65984 10.6666     11.2757  10.6666     11.2757  8.23256    210         2.02917     30          
1 1 1 25 25 14 o 7  30.3477 8.2831  24.6305     11.9453  24.6305     11.9453  3.31125    240         39.6225     60          
1 1 1 25 25 15 o 4  16.638  7.1516  6.44658     11.1339  6.44658     11.1339  4.21327    90          6.39462     270         
1 1 1 25 25 16 o 7  87.6656 3.59889 141.699     15.6879  141.699     15.6879  75.1352    300         16.8842     300         
1 1 1 25 25 17 o 16 28.7352 8.15499 22.4986     11.4122  22.4986     11.4122  2.19032    330         48.0547     330         
1 1 1 25 25 18 o 18 17.6203 7.28047 8.43268     10.7092  8.43268     10.7092  3.92317    180         13.9315     360         
1 1 1 25 25 19 o 2  11.5992 5.58506 -4.12636    9.95632  -4.12636    9.95632  4.71143    30          19.449      30          
1 1 1 25 25 20 o 6  15.938  6.92021 5.53609     10.6619  5.53609     10.6619  2.22596    240         5.55776     60          
1 1 1 25 25 21 o 10 27.1049 9.29099 22.9979     14.7458  22.9979     14.7458  19.8074    270         7.75042     270         
1 1 1 25 25 22 o 9  26.3552 8.4706  20.4897     12.1024  20.4897     12.1024  18.2329    300         7.27113     300         
1 1 1 25 25 23 o 3  31.5813 8.19714 26.1851     11.9819  26.1851     11.9819  17.6023    150         12.2658     330         
1 1 1 25 25 24 o 14 17.6813 7.35223 8.51766     11.0389  8.51766     11.0389  3.85815    2.00846e-08 3.67587     180         
1 1 1 25 25 25 o 11 35.2132 7.84485 30.2938     12.1601  30.2938     12.1601  21.3415    210         10.3065     30          
1 1 1 25 25 26 o 15 10.4246 5.17989 -9.68578    10.4417  -9.68578    10.4417  9.25121    240         29.1808     240         
1 1 1 25 25 27 o 17 29.4867 9.65269 26.9461     15.7456  26.9461     15.7456  24.5379    270         14.0012     270         
1 1 1 25 25 28 o 12 14.5319 6.97943 -4.27051    15.3446  -4.27051    15.3446  1.15395    300         3.04986     120         
1 1 1 25 25 29 o 3  25.3366 9.61403 21.2839     16.7863  21.2839     16.7863  17.1004    150         1.75179     330         
1 1 1 25 25 30 o 1  16.3738 7.65079 0.994721    16.2856  0.994721    16.2856  1.28474    3.66804e-06 0.488964    180         
1 1 1 25 25 31 o 9  22.402  9.03557 16.1665     15.8992  16.1665     15.8992  14.5545    210         1.73052     210         
1 1 1 25 25 32 o 5  15.5033 7.30354 -0.365818   15.3505  -0.365818   15.3505  0.358067   59.9998     0.274143    240         
1 1 1 25 25 33 o 10 34.9618 10.9147 39.3642     20.0851  39.3642     20.0851  29.5371    270         7.4934      270         
1 1 1 25 25 34 o 11 27.0689 9.97105 25.4045     17.6271  25.4045     17.6271  11.503     300         16.9343     120         
1 1 1 25 25 35 o 15 28.712  10.0446 28.1233     17.3701  28.1233     17.3701  23.4885    150         13.7934     150         
1 1 1 25 25 36 o 1  13.913  6.77967 -6.27398    15.6862  -6.27398    15.6862  0.365874   180         1.56886     8.85676e-06 
1 1 1 25 25 37 o 11 15.9604 7.49476 1.56305     15.9473  1.56305     15.9473  0.376446   210         0.490249    30          
1 1 1 25 25 38 o 16 14.3589 7.01374 -6.18168    17.0335  -6.18168    17.0335  0.172863   240         12.3167     240         
1 1 1 25 25 39 o 17 26.6144 11.0555 30.9969     24.9163  30.9969     24.9163  7.11392    90          3.51529     90          
1 1 1 25 25 40 o 19 18.8233 8.96221 5.5481      24.2421  5.5481      24.2421  4.19441    120         11.3882     300         
1 1 1 25 25 41 o 18 13.0434 6.70409 -36.2304    24.6913  -36.2304    24.6913  1.16622    330         6.36936     330         
1 1 1 25 25 42 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 25 25 43 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 0  0  o 17 358.98  6.27873 2289.68     112.798  2289.68     112.798  389.254    180         250.755     180         
1 1 1 26 0  1  o 4  129.623 2.6151  298.529     16.9563  298.529     16.9563  79.2761    60          30.3136     240         
1 1 1 26 0  2  o 18 60.4359 2.87519 65.6157     8.61619  65.6157     8.61619  0.443219   120         30.3915     120         
1 1 1 26 0  3  o 9  49.7278 3.09087 44.8413     7.55968  44.8413     7.55968  2.55676    180         10.9982     180         
1 1 1 26 0  4  o 14 92.2504 2.81706 151.684     12.968   151.684     12.968   27.2764    240         6.72492     240         
1 1 1 26 0  5  f 0  70.6937 3.08805 89.5993     10.8435  89.5993     10.8435  24.7678    120         0           0           
1 1 1 26 0  6  o 5  209.9   2.98459 781.916     31.3661  781.916     31.3661  237.934    1.59224e-06 169.447     1.59224e-06 
1 1 1 26 0  7  o 14 97.3082 2.65699 168.58      12.9129  168.58      12.9129  56.3491    60          13.5569     60          
1 1 1 26 0  8  o 18 106.032 2.82647 200.129     14.9705  200.129     14.9705  54.2833    300         43.1125     120         
1 1 1 26 0  9  o 13 217.428 3.22005 839.168     35.0516  839.168     35.0516  178.296    1.55281e-06 37.6046     1.55281e-06 
1 1 1 26 0  10 o 8  304.811 4.03793 1649.32     61.632   1649.32     61.632   219.501    60          7.95192     240         
1 1 1 26 0  11 o 7  598.93  6.66321 6375.54     199.884  6375.54     199.884  470.473    120         63.2264     120         
1 1 1 26 0  12 o 4  200.251 3.15775 711.948     31.6538  711.948     31.6538  148.901    0           4.52362     0           
1 1 1 26 0  13 f 0  256.579 3.2423  1168.22     41.6603  1168.22     41.6603  211.699    60          0           0           
1 1 1 26 0  14 o 12 258.224 3.49192 1183.54     45.1505  1183.54     45.1505  179.001    300         19.6368     120         
1 1 1 26 0  15 o 1  40.144  3.84933 30.1106     7.34246  30.1106     7.34246  43.8584    180         131.558     180         
1 1 1 26 0  16 f 0  285.058 3.14248 1441.62     44.8672  1441.62     44.8672  174.887    240         0           0           
1 1 1 26 0  17 o 11 8.1976  3.96381 -3.30247    5.12953  -3.30247    5.12953  37.9814    120         77.0066     120         
1 1 1 26 0  18 o 12 78.2506 2.82425 109.388     11.009   109.388     11.009   35.3029    180         184.251     180         
1 1 1 26 0  19 o 1  227.112 3.05352 915.414     34.7254  915.414     34.7254  128.082    240         74.4633     60          
1 1 1 26 0  20 o 16 299.417 3.25262 1590.62     48.7796  1590.62     48.7796  223.968    300         12.5162     300         
1 1 1 26 0  21 o 3  54.3031 3.19852 53.3606     8.56037  53.3606     8.56037  3.964      180         63.633      180         
1 1 1 26 0  22 o 12 580.81  5.25278 5990.99     152.835  5990.99     152.835  484.237    240         125.804     240         
1 1 1 26 0  23 o 11 264.121 2.8728  1237.58     38.0047  1237.58     38.0047  231.005    300         79.2864     300         
1 1 1 26 0  24 o 9  48.0418 3.10894 41.9381     7.33331  41.9381     7.33331  19.9374    180         90.1389     180         
1 1 1 26 0  25 o 4  263.535 2.89281 1232.16     38.1842  1232.16     38.1842  171.998    240         36.8679     60          
1 1 1 26 0  26 o 9  41.1888 3.42149 31.3065     6.8073   31.3065     6.8073   39.828     300         123.516     300         
1 1 1 26 0  27 o 4  71.44   2.56206 91.1669     9.11846  91.1669     9.11846  27.6627    180         23.7538     8.34019e-06 
1 1 1 26 0  28 o 17 251.363 2.86194 1121.06     36.0304  1121.06     36.0304  189.436    60          17.1932     60          
1 1 1 26 0  29 o 16 148.233 2.39585 390.104     17.7768  390.104     17.7768  92.7348    300         27.4639     120         
1 1 1 26 0  30 o 7  48.3285 3.27655 42.5466     7.75738  42.5466     7.75738  30.5619    8.49903e-06 119.202     8.49903e-06 
1 1 1 26 0  31 o 10 224.876 2.72959 897.326     30.7406  897.326     30.7406  189.256    240         56.523      240         
1 1 1 26 0  32 o 5  397.878 3.74764 2809.68     74.6954  2809.68     74.6954  350.942    120         133.173     120         
1 1 1 26 0  33 o 4  88.5071 2.46361 139.512     10.8887  139.512     10.8887  34.3717    8.77115e-08 55.7399     180         
1 1 1 26 0  34 o 14 665.442 5.85734 7874.02     195.263  7874.02     195.263  568.935    60          190.177     60          
1 1 1 26 0  35 o 13 9.89048 4.69798 -2.71383    6.58855  -2.71383    6.58855  55.2561    120         113.135     120         
1 1 1 26 0  36 o 13 115.575 2.4209  237.436     13.9939  237.436     13.9939  68.2514    180         27.3327     8.73234e-06 
1 1 1 26 0  37 o 3  188.189 2.56074 628.639     24.13    628.639     24.13    104.068    60          58.3025     240         
1 1 1 26 0  38 o 12 307.743 3.05066 1680.85     47.0272  1680.85     47.0272  197.919    120         38.96       300         
1 1 1 26 0  39 o 8  65.6363 3.00713 77.3751     9.79485  77.3751     9.79485  22.5055    3.51405e-05 9.60706     3.51405e-05 
1 1 1 26 0  40 o 3  10.2512 4.84396 -2.39591    6.84173  -2.39591    6.84173  2.45418    59.9997     5.11443     59.9997     
1 1 1 26 0  41 f 0  72.9073 2.95446 95.2267     10.7129  95.2267     10.7129  79.8675    300         0           0           
1 1 1 26 0  42 o 18 212.005 2.72295 798.121     28.9083  798.121     28.9083  126.528    180         43.8412     8.66251e-06 
1 1 1 26 0  43 o 12 99.5971 2.66985 176.736     13.2823  176.736     13.2823  98.9312    60          62.4491     60          
1 1 1 26 0  44 o 1  189.567 2.75837 638.465     26.1795  638.465     26.1795  145.518    300         26.8206     300         
1 1 1 26 0  45 o 19 23.5386 6.75972 13.7681     7.81284  13.7681     7.81284  28.8199    8.67652e-06 78.3845     8.67652e-06 
1 1 1 26 0  46 o 16 202.105 2.84205 725.945     28.7594  725.945     28.7594  167.656    240         55.0206     240         
1 1 1 26 0  47 o 10 15.4338 6.17791 5.61737     7.35578  5.61737     7.35578  6.07488    300         14.0496     300         
1 1 1 26 0  48 o 5  88.2787 2.88237 139.284     12.6895  139.284     12.6895  44.2939    9.19174e-09 33.2023     180         
1 1 1 26 0  49 o 6  91.2712 2.90985 148.888     13.2478  148.888     13.2478  79.9847    60          34.7572     60          
1 1 1 26 0  50 o 13 79.5294 3.08749 113.439     12.22    113.439     12.22    46.5825    120         15.892      300         
1 1 1 26 0  51 o 8  120.744 3.01062 260.144     18.1659  260.144     18.1659  83.1096    6.2281e-07  0.99234     6.22811e-07 
1 1 1 26 0  52 o 2  30.8441 6.753   21.2937     9.13841  21.2937     9.13841  2.56799    240         36.988      240         
1 1 1 26 0  53 o 1  53.379  3.76808 52.271      9.83193  52.271      9.83193  37.8265    120         23.317      120         
1 1 1 26 0  54 o 16 51.9911 4.2075  50.1166     10.5911  50.1166     10.5911  29.5785    2.57565e-11 11.1604     180         
1 1 1 26 0  55 o 17 70.6842 3.51537 90.379      12.3083  90.379      12.3083  61.6737    240         27.7821     240         
1 1 1 26 0  56 f 0  88.1851 3.19316 139.652     14.0267  139.652     14.0267  53.0962    120         0           0           
1 1 1 26 0  57 o 17 13.1345 5.77695 2.16939     7.66452  2.16939     7.66452  14.5377    8.65116e-06 38.6147     8.65116e-06 
1 1 1 26 0  58 o 13 38.5699 5.32939 29.582      9.17588  29.582      9.17588  26.8717    240         13.2578     240         
1 1 1 26 0  59 o 13 86.9963 3.15084 136.107     13.6542  136.107     13.6542  60.088     300         3.99053     300         
1 1 1 26 0  60 o 16 16.6226 6.77132 6.52774     9.0586   6.52774     9.0586   0.291248   180         1.67183     180         
1 1 1 26 0  61 o 9  39.7928 5.20475 31.2705     9.33438  31.2705     9.33438  17.4287    240         17.7698     60          
1 1 1 26 0  62 o 9  12.6349 5.67407 1.1775      7.82324  1.1775      7.82324  6.78905    120         19.8074     120         
1 1 1 26 0  63 o 12 50.3997 4.09039 47.3818     9.97875  47.3818     9.97875  0.194843   359.997     0.168996    359.997     
1 1 1 26 0  64 o 1  8.28641 4.16638 -10.0318    7.45186  -10.0318    7.45186  1.86625    240         4.35715     240         
1 1 1 26 0  65 o 3  14.5606 6.24497 3.93403     8.45035  3.93403     8.45035  5.19011    300         22.4916     300         
1 1 1 26 0  66 o 6  54.7363 4.29744 56.0521     11.4169  56.0521     11.4169  54.0758    360         37.0083     360         
1 1 1 26 0  67 o 3  73.9827 3.51778 99.7368     12.905   99.7368     12.905   46.2064    240         3.67801     60          
1 1 1 26 0  68 o 15 98.581  3.06984 175.368     15.0988  175.368     15.0988  74.7503    300         21.9376     300         
1 1 1 26 0  69 o 5  40.4796 7.29771 35.8096     12.7973  35.8096     12.7973  21.4441    360         9.27754     180         
1 1 1 26 0  70 o 16 22.8786 8.17784 15.1193     11.6351  15.1193     11.6351  8.11146    60          0.0541322   240         
1 1 1 26 0  71 f 0  71.6244 4.54194 96.0447     15.9868  96.0447     15.9868  41.0153    120         0           0           
1 1 1 26 0  72 o 19 17.0029 7.25653 6.43207     11.2928  6.43207     11.2928  0.770377   360         6.68102     180         
1 1 1 26 0  73 o 13 18.7117 7.49501 9.56696     10.8363  9.56696     10.8363  1.51676    60          4.14975     240         
1 1 1 26 0  74 o 11 12.1841 5.80749 -3.35928    10.2324  -3.35928    10.2324  5.35944    300         17.7508     300         
1 1 1 26 0  75 o 2  45.9936 6.62884 44.1147     13.5165  44.1147     13.5165  33.0553    360         8.24787     360         
1 1 1 26 0  76 o 12 25.2845 8.56262 18.6623     12.4778  18.6623     12.4778  12.1478    240         4.91353     60          
1 1 1 26 0  77 o 8  51.4304 6.27947 53.933      14.7389  53.933      14.7389  47.2748    300         30.4856     300         
1 1 1 26 0  78 o 17 16.1886 7.12428 4.98746     11.6731  4.98746     11.6731  0.916486   360         3.49081     180         
1 1 1 26 0  79 o 15 31.9915 9.15118 28.789      14.3354  28.789      14.3354  20.9165    60          6.41362     60          
1 1 1 26 0  80 o 7  27.3971 9.01218 23.0102     13.7352  23.0102     13.7352  9.44363    300         2.55795     300         
1 1 1 26 0  81 o 13 11.859  5.79464 -6.66069    11.6516  -6.66069    11.6516  1.33195    360         3.84354     360         
1 1 1 26 0  82 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 1  0  o 10 74.9101 2.82985 100.316     10.5537  100.316     10.5537  18.8592    360         4.75535     180         
1 1 1 26 1  1  o 6  131.105 2.56256 313.126     16.3684  296.963     17.2291  77.9421    179.787     19.8269     359.787     
1 1 1 26 1  2  o 17 351.908 3.89532 2198.42     67.0105  2197.09     70.3404  181.308    8.96103     150.416     188.961     
1 1 1 26 1  3  o 12 325.931 3.67203 1861.15     58.5328  1908.88     61.4179  228.013    312.663     17.055      132.664     
1 1 1 26 1  4  o 12 165.499 2.98173 502.443     24.671   469.694     24.7427  76.0173    144.47      81.324      324.47      
1 1 1 26 1  5  o 8  35.5893 4.46307 21.6263     7.12171  24.7448     8.22398  74.3287    233.756     184.007     233.756     
1 1 1 26 1  6  o 2  39.8144 4.07977 26.7121     7.83195  30.8023     7.94855  9.8717     127.983     32.2202     127.983     
1 1 1 26 1  7  o 17 293.704 4.01151 1532.35     55.2907  1529.88     62.5659  237.547    218.733     51.3288     218.733     
1 1 1 26 1  8  o 11 145.05  3.1673  390.171     22.2568  357.291     23.6192  71.3269    148.933     59.3466     328.933     
1 1 1 26 1  9  o 19 271.025 3.84677 1286.97     48.9887  1320.45     55.3852  171.234    321.291     49.3006     141.291     
1 1 1 26 1  10 f 0  401.977 4.85857 2856.95     91.6169  2884.56     103.805  304.117    239.753     0           0           
1 1 1 26 1  11 o 17 472.969 5.57275 3982.92     123.585  3972.82     140.048  421.159    297.572     153.583     297.572     
1 1 1 26 1  12 o 6  360.796 4.30869 2332.64     73.4615  2290.44     82.0281  306.52     117.382     90.3687     117.382     
1 1 1 26 1  13 o 4  619.054 6.17364 6773.31     181.785  6869.16     200.912  496.052    264.013     88.5679     264.013     
1 1 1 26 1  14 o 15 83.5743 2.83891 137.807     11.6219  111.23      11.9449  11.963     248.347     5.21218     248.347     
1 1 1 26 1  15 o 13 135.112 2.69217 318.559     17.3635  329.476     19.0432  58.3976    0.200573    70.1336     180.201     
1 1 1 26 1  16 o 13 222.466 2.88127 890.251     31.4796  865.431     32.7304  163.814    133.371     11.4156     133.371     
1 1 1 26 1  17 o 17 142.556 2.46431 371.618     16.8395  349.496     18.268   95.7096    225.894     2.60648     45.8942     
1 1 1 26 1  18 f 0  292.884 3.36192 1520.06     47.1153  1524.18     51.4834  209.593    85.729      0           0           
1 1 1 26 1  19 o 17 208.59  2.86905 789.106     30.7331  754.604     29.2527  94.7803    143.598     107.689     323.598     
1 1 1 26 1  20 o 17 88.0469 2.52809 130.47      10.7891  145.126     11.4767  44.4968    199.29      11.0895     19.2902     
1 1 1 26 1  21 o 19 103.057 2.44618 204.691     12.3918  173.064     12.7395  69.3281    83.0884     31.6867     83.0884     
1 1 1 26 1  22 o 19 373.105 3.73534 2510.89     69.8292  2432.15     69.8427  337.519    71.1627     140.024     71.1627     
1 1 1 26 1  23 o 14 251.417 2.95131 1114.19     36.3365  1128.6      38.0243  139.887    43.6275     78.7727     223.627     
1 1 1 26 1  24 o 7  224.139 2.87093 910.389     32.9552  872.231     31.544   170.161    32.0085     24.8328     32.0084     
1 1 1 26 1  25 o 7  116.572 2.47904 244.015     14.45    238.427     14.48    62.4892    128.737     28.5819     308.737     
1 1 1 26 1  26 o 14 63.4872 2.86142 73.4714     9.04629  70.1367     9.06238  6.01491    225.542     53.5623     45.542      
1 1 1 26 1  27 o 7  291.903 3.18336 1525.76     46.5593  1498.55     46.5731  209.439    265.703     4.13978     265.703     
1 1 1 26 1  28 f 0  128.587 2.49247 300.843     16.0243  286.194     16.0599  56.1914    267.031     0           0           
1 1 1 26 1  29 o 15 26.0042 4.99075 15.0977     6.67697  9.63526     6.85609  29.8985    259.069     70.7562     259.069     
1 1 1 26 1  30 o 4  151.822 2.75932 416.425     20.9914  402.018     20.9575  104.108    306.177     2.44358     306.177     
1 1 1 26 1  31 o 5  142.928 2.50183 356.398     17.4893  368.344     18.3507  107.936    77.6049     25.7951     77.6049     
1 1 1 26 1  32 o 16 311.462 3.29126 1733.23     51.3607  1711.17     51.3819  280.095    284         121.786     284         
1 1 1 26 1  33 o 3  150.237 2.49092 390.038     18.7385  410.868     18.7608  109.034    115.495     15.5366     115.495     
1 1 1 26 1  34 o 6  284.561 3.30463 1410.44     49.1432  1465.55     44.9184  247.468    233.341     96.2151     233.341     
1 1 1 26 1  35 o 9  108.946 2.77963 209.7       14.6563  212.144     15.6352  86.864     256.64      42.6913     256.64      
1 1 1 26 1  36 o 19 208.183 2.77554 777.805     28.3069  760.787     29.5762  173.438    49.9155     58.9991     49.9155     
1 1 1 26 1  37 f 0  62.062  3.223   75.147      9.60563  62.7105     10.171   75.1609    205.426     0           0           
1 1 1 26 1  38 o 4  362.283 3.63115 2300.92     64.4504  2366.55     67.3991  256.328    329.15      3.12897     329.15      
1 1 1 26 1  39 o 3  38.2897 4.6474  25.9477     8.49481  27.7947     8.6977   8.53797    338.468     52.7632     338.468     
1 1 1 26 1  40 o 10 183.238 2.65677 582.5       23.7903  610.104     25.006   149.949    34.9517     48.2041     34.9517     
1 1 1 26 1  41 o 2  67.8348 3.16324 93.4325     10.1829  71.6213     10.9305  38.2654    214.731     1.13807     34.731      
1 1 1 26 1  42 o 16 71.1364 3.05116 85.7531     10.501   94.9574     11.1532  25.9515    237.73      38.1228     57.7301     
1 1 1 26 1  43 o 17 113.278 2.71296 238.55      15.3216  218.257     15.4086  75.6406    180.045     0.488556    180.045     
1 1 1 26 1  44 o 15 158.933 2.93371 440.46      19.9357  458.505     26.4278  101.34     67.4209     14.4304     247.421     
1 1 1 26 1  45 o 4  139.918 2.57959 341.441     17.5609  355.057     18.584   100.869    310.563     12.7441     310.563     
1 1 1 26 1  46 o 15 89.5033 2.81309 142.615     12.2357  143.006     12.9278  42.2116    127.905     33.4916     307.905     
1 1 1 26 1  47 o 17 118.481 2.66433 249.364     15.3505  250.639     16.2381  88.9406    163.425     20.4887     163.425     
1 1 1 26 1  48 o 18 96.7526 2.72368 157.427     12.756   176.675     13.606   72.4666    230.567     19.943      230.567     
1 1 1 26 1  49 o 16 32.0541 5.08079 24.7501     7.62438  13.8593     8.48654  0.0252715  194.44      19.5676     194.441     
1 1 1 26 1  50 o 14 81.8857 3.0265  123.361     12.0993  116.573     12.6242  67.6001    196.514     38.553      196.514     
1 1 1 26 1  51 o 1  19.9502 5.47041 5.18888     7.90442  4.23506     7.72486  9.23341    106.504     27.1244     106.504     
1 1 1 26 1  52 o 9  134.061 2.83495 327.643     18.9696  314.319     19.0713  68.1169    177.837     44.2866     357.837     
1 1 1 26 1  53 o 3  118.974 2.77097 246.418     16.5005  259.438     16.4883  70.2182    53.346      19.1152     233.346     
1 1 1 26 1  54 o 11 29.4976 5.56925 20.756      8.757    12.2293     8.2921   6.54945    156.702     0.716388    336.702     
1 1 1 26 1  55 o 12 65.7753 3.48298 75.1635     11.5184  81.148      11.2489  53.0638    62.2438     23.4735     62.2438     
1 1 1 26 1  56 o 16 33.1706 5.78003 20.5843     9.39445  21.5603     9.6971   8.32761    332.2       21.2267     152.2       
1 1 1 26 1  57 o 13 83.0271 3.38802 134.865     13.5807  114.386     14.3368  81.2587    231.001     58.3339     231.001     
1 1 1 26 1  58 o 14 134.924 2.89455 317.57      18.4144  336.135     20.6692  108.479    249.725     38.2622     249.725     
1 1 1 26 1  59 o 10 35.7669 5.38897 18.7504     9.12     30.7379     9.70208  20.1114    9.80661     4.11512     9.80661     
1 1 1 26 1  60 o 19 73.2343 3.5471  98.6887     12.5193  96.1187     13.331   45.3216    38.2313     3.96058     218.231     
1 1 1 26 1  61 o 4  102.327 3.1095  185.399     15.4277  192.435     16.3879  74.2141    96.0929     14.8701     96.0929     
1 1 1 26 1  62 o 9  47.5602 4.69668 46.0304     10.6386  38.7957     11.0163  35.5809    213.739     15.4782     213.739     
1 1 1 26 1  63 o 5  20.1114 5.6698  5.32027     8.2928   3.53911     8.95133  1.14119    247.833     2.27833     67.8334     
1 1 1 26 1  64 o 12 29.1023 5.55703 27.3603     9.21505  2.78693     10.2495  10.0355    205.477     12.4479     25.4769     
1 1 1 26 1  65 o 18 39.5864 5.11991 31.2441     9.859    29.0645     9.70527  14.8082    77.4494     19.1211     257.449     
1 1 1 26 1  66 o 11 55.9521 4.13223 65.2525     11.0368  51.7264     11.5545  21.6406    46.0756     27.8084     226.076     
1 1 1 26 1  67 o 8  63.4113 3.75723 70.9002     11.5314  77.9837     12.1291  50.3366    78.6999     21.3427     78.6999     
1 1 1 26 1  68 f 0  67.7798 3.76375 78.2813     12.6724  92.3944     12.6057  44.2293    151.072     0           0           
1 1 1 26 1  69 f 0  48.1462 5.73833 45.7906     12.7506  46.5114     13.9346  22.3907    249.186     0           0           
1 1 1 26 1  70 o 8  23.5945 6.3665  3.65331     10.9314  13.4425     10.6881  2.93326    115.131     19.4493     295.131     
1 1 1 26 1  71 o 19 34.1014 6.63686 27.126      13.1281  22.1024     10.2896  12.6981    100.625     14.0294     280.625     
1 1 1 26 1  72 o 17 20.8845 6.34674 6.10269     13.4425  -0.567296   10.3817  3.42955    23.5631     4.27388     203.563     
1 1 1 26 1  73 o 15 34.1806 6.89385 8.00715     14.8527  39.7205     13.7239  11.4694    284.704     16.1683     104.704     
1 1 1 26 1  74 o 6  20.3631 6.06603 5.97633     10.3246  0.0102761   11.0794  1.17301    153.612     0.45148     333.612     
1 1 1 26 1  75 o 11 18.3383 5.7269  2.43586     10.2618  -5.00073    10.7133  2.7542     159.927     2.76178     339.927     
1 1 1 26 1  76 o 10 75.8256 4.21427 101.139     15.1497  118.234     16.6289  57.198     71.1489     21.4526     71.1489     
1 1 1 26 1  77 o 18 34.832  6.6343  13.6722     12.1149  40.1107     13.3831  19.5588    158.316     0.550972    158.316     
1 1 1 26 1  78 o 7  26.5464 6.85116 18.6116     11.8835  10.1896     12.3456  10.6268    258.617     2.1011      258.617     
1 1 1 26 1  79 o 10 18.8899 5.94905 2.58687     11.6228  -2.53496    11.2089  1.53559    240.939     6.0227      60.9387     
1 1 1 26 1  80 o 9  22.3579 6.63555 12.8697     13.0878  0.0836163   12.751   3.19325    126.679     3.28858     306.679     
1 1 1 26 1  81 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 2  0  o 8  301.02  3.71302 1608.24     55.9738  1608.24     55.9738  242.966    180         42.4612     180         
1 1 1 26 2  1  o 17 200.205 2.99668 722.122     30.7664  699.806     29.3656  142.827    121.73      0.207101    121.73      
1 1 1 26 2  2  o 3  273.536 3.10495 1334.33     43.4901  1320.09     41.6238  225.647    180.856     56.3021     180.856     
1 1 1 26 2  3  o 6  374.038 4.12868 2487.05     77.4014  2480.59     77.3792  333.586    76.5195     122.637     76.5195     
1 1 1 26 2  4  o 2  24.6993 4.98347 9.69499     6.41675  12.4876     6.57521  15.8014    278.832     36.711      278.832     
1 1 1 26 2  5  o 1  270.998 3.46791 1282.55     48.3559  1323.76     45.7518  229.209    125.993     67.8064     125.993     
1 1 1 26 2  6  o 9  125.549 2.80815 274.831     16.7309  284.867     18.5426  58.2574    194.462     56.2013     14.4624     
1 1 1 26 2  7  o 18 128.533 2.8134  283.974     18.1852  302.731     17.9944  59.3369    71.5495     58.758      251.549     
1 1 1 26 2  8  o 5  313.095 3.68737 1710.63     54.969   1769.13     60.6863  219.311    240.435     16.112      60.4348     
1 1 1 26 2  9  o 19 238.288 3.09022 997.828     34.2451  1016.69     39.4228  133.771    143.919     76.3126     323.919     
1 1 1 26 2  10 o 16 166.991 2.5855  484.525     21.1016  504.574     22.1745  99.4435    355.92      36.417      175.92      
1 1 1 26 2  11 o 17 332.573 3.50585 1966.82     55.911   1958.63     60.8354  315.915    97.9973     151.729     97.9973     
1 1 1 26 2  12 o 7  251.598 3.04729 1119.26     37.5699  1126.55     39.2607  191.887    35.5533     22.5714     35.5533     
1 1 1 26 2  13 o 6  461.924 4.42347 3821.43     102.379  3758.89     102.413  349.614    84.9072     26.044      84.9072     
1 1 1 26 2  14 o 13 223.612 2.95571 876.38      33.091   897.593     33.1502  156.185    79.1386     6.9647      259.139     
1 1 1 26 2  15 o 5  222.053 2.76166 863.878     30.0011  885.233     31.4595  163.305    268.314     10.3884     268.314     
1 1 1 26 2  16 o 7  224.947 2.93463 907.901     33.0469  887.364     33.1132  143.699    328.257     34.0255     148.257     
1 1 1 26 2  17 o 6  31.2986 4.67643 18.7374     6.81204  17.3845     7.39355  57.864     201.142     142.165     201.142     
1 1 1 26 2  18 o 6  334.024 3.78783 1998.26     58.6833  1963.44     67.7197  294.923    247.483     109.451     247.483     
1 1 1 26 2  19 o 11 162.961 2.94315 462.916     24.1298  479.688     23.9099  83.9676    152.365     60.3108     332.365     
1 1 1 26 2  20 o 13 55.6712 3.39691 58.5064     8.36468  52.4076     10.1697  3.10696    160.692     11.9148     340.692     
1 1 1 26 2  21 o 2  185.563 2.73621 623.346     23.7146  598.319     26.9936  112.75     61.0947     35.5204     241.095     
1 1 1 26 2  22 o 17 93.3957 2.64308 158.169     11.4582  151.784     13.1354  44.5598    124.449     26.227      304.449     
1 1 1 26 2  23 o 18 290.579 3.26133 1501.07     44.2814  1495.91     50.4873  171.018    250.29      74.5061     70.2898     
1 1 1 26 2  24 o 12 134.041 2.65681 324.281     16.6192  313.65      18.921   60.692     202.747     62.1486     22.7465     
1 1 1 26 2  25 o 18 28.5575 5.04285 15.2024     6.66199  14.9089     7.74301  44.0784    165.052     106.665     165.052     
1 1 1 26 2  26 o 4  118.929 2.53632 252.641     14.4835  249.559     15.683   84.8439    336.286     18.1125     336.286     
1 1 1 26 2  27 o 3  353.104 3.62613 2219.09     61.4736  2208.83     66.7374  277.392    100.304     50.4358     100.304     
1 1 1 26 2  28 o 4  205.891 2.73734 751.556     27.132   752.536     29.3151  144.16     98.4208     0.0509648   278.423     
1 1 1 26 2  29 o 15 96.8917 2.67521 166.084     12.7371  167.515     13.1905  61.4048    40.0338     8.02324     40.0338     
1 1 1 26 2  30 o 1  76.6518 2.91343 110.617     10.0181  98.6819     12.0377  12.2149    124.267     70.8376     304.267     
1 1 1 26 2  31 o 15 149.187 2.4835  395.058     17.5077  394.555     19.5686  88.5688    308.606     27.1794     128.606     
1 1 1 26 2  32 o 19 75.89   2.76692 103.819     9.83804  101.13      11.0801  33.7092    331.844     17.1304     151.844     
1 1 1 26 2  33 o 2  53.5573 3.45562 51.1649     8.76595  51.5785     9.56307  9.2643     305.027     78.7581     305.027     
1 1 1 26 2  34 o 2  169.47  2.63427 500.064     21.7512  519.365     22.9939  138.626    151.118     45.2805     151.118     
1 1 1 26 2  35 o 5  132.583 2.67539 301.632     16.7508  323.049     18.7609  123.729    120.731     77.4402     120.731     
1 1 1 26 2  36 o 16 178.479 2.61991 560.743     22.3475  570.107     24.4866  150.056    294.019     54.2763     294.019     
1 1 1 26 2  37 o 4  64.3201 3.16422 78.8151     9.76693  69.0629     10.4113  30.6969    69.183      11.6052     249.183     
1 1 1 26 2  38 o 13 152.967 2.54382 409.295     18.6213  421.543     20.3631  99.7274    134.617     11.1681     314.617     
1 1 1 26 2  39 o 15 201.053 2.66062 706.437     25.5727  729.427     28.0198  137.307    237.862     4.97136     57.8616     
1 1 1 26 2  40 f 0  164.587 2.57604 473.226     20.2541  489.052     22.2231  124.345    201.176     0           0           
1 1 1 26 2  41 o 9  95.7399 2.72667 162.821     12.6855  163.446     13.4165  72.1777    354.76      21.7082     354.76      
1 1 1 26 2  42 o 6  157.28  2.64162 440.319     20.2812  438.827     21.3453  131.167    45.4751     48.3581     45.4751     
1 1 1 26 2  43 o 1  237.759 2.916   978.244     33.8219  1033.11     35.6733  211.21     116.436     94.0474     116.436     
1 1 1 26 2  44 o 17 66.8601 3.249   80.7273     9.8774   79.2619     11.6633  44.7103    336.365     14.986      336.365     
1 1 1 26 2  45 o 2  38.4897 4.54504 21.8913     7.98422  33.1443     8.8582   6.55087    97.5854     9.94477     277.585     
1 1 1 26 2  46 o 3  80.3726 2.85839 111.837     10.8609  118.825     12.0872  55.687     296.517     9.93081     296.517     
1 1 1 26 2  47 o 14 112.962 2.62381 221.114     14.0943  233.706     15.5676  83.2381    316.779     16.5845     316.779     
1 1 1 26 2  48 o 16 64.6869 3.20546 81.8016     9.67064  68.576      10.775   31.1413    93.8883     17.8557     273.888     
1 1 1 26 2  49 o 5  120.702 2.60391 254.935     14.9479  264.543     16.5023  83.14      17.4006     5.22546     17.4006     
1 1 1 26 2  50 o 3  151.744 2.7294  405.823     19.7439  415.457     21.7206  115.826    45.8451     26.9357     45.8451     
1 1 1 26 2  51 o 11 59.2334 3.35692 54.6427     9.2924   72.3344     10.4475  35.5118    239.609     2.3701      59.609      
1 1 1 26 2  52 o 13 231.577 3.30674 935.101     36.2741  985.621     40.451   164.939    326.292     14.6976     326.293     
1 1 1 26 2  53 o 8  45.0059 4.35175 39.2632     9.30268  35.2582     9.74975  9.95207    213.957     37.2278     33.9574     
1 1 1 26 2  54 o 12 34.8677 5.43894 21.5188     8.59241  24.7147     9.91327  15.764     255.452     5.54041     75.4519     
1 1 1 26 2  55 o 2  65.9667 3.54119 83.0197     11.7056  74.5791     11.5149  50.3084    298.49      16.545      298.49      
1 1 1 26 2  56 o 5  21.2184 5.64067 3.33656     8.54908  8.78651     8.05703  0.915347   37.3999     7.23391     217.4       
1 1 1 26 2  57 o 2  54.3248 4.06518 54.8903     10.7087  53.3369     11.0772  39.4185    87.407      11.7658     87.407      
1 1 1 26 2  58 o 5  90.8017 3.00128 147.067     12.9325  149.832     14.2822  70.6755    76.208      22.609      76.208      
1 1 1 26 2  59 o 12 28.295  5.74347 23.7255     8.96789  3.87947     10.6012  9.83383    257.148     7.70502     77.1478     
1 1 1 26 2  60 f 0  87.576  3.47712 124.803     13.856   154.217     16.5805  54.9583    290.858     0           0           
1 1 1 26 2  61 o 19 21.7951 5.94015 -0.729497   8.81723  12.0125     10.388   2.12379    224.49      13.9726     44.4899     
1 1 1 26 2  62 o 17 63.2083 3.67097 73.5058     11.6127  72.584      11.4391  48.064     164.004     16.3601     164.004     
1 1 1 26 2  63 o 19 93.357  3.17607 163.408     14.4182  152.51      15.1606  73.2157    238.583     25.4833     238.583     
1 1 1 26 2  64 o 13 70.262  4.25595 95.1278     14.4508  88.0721     15.1664  49.5326    133.015     9.13425     133.015     
1 1 1 26 2  65 o 4  26.1661 6.17605 16.8973     9.20136  7.52799     10.7159  10.565     217.098     5.94308     37.0981     
1 1 1 26 2  66 o 8  20.9038 5.93074 9.19376     10.1789  0.328553    9.17947  5.45756    199.67      6.0339      19.6701     
1 1 1 26 2  67 o 4  20.4799 5.65936 10.3267     8.76315  -1.68028    9.22999  5.36135    329.192     4.52936     149.192     
1 1 1 26 2  68 o 4  28.2072 6.3293  7.26422     11.921   22.401      10.0125  9.97155    281.536     11.6534     101.536     
1 1 1 26 2  69 o 17 16.8544 5.306   -1.25125    9.79318  -2.01149    8.22584  2.38089    85.8932     20.0213     85.8932     
1 1 1 26 2  70 f 0  48.3292 5.09306 45.6884     12.4925  45.8014     11.3852  30.7156    286.863     0           0           
1 1 1 26 2  71 o 5  25.0205 6.5543  4.1702      13.5184  15.414      9.92801  8.25402    261.143     0.471066    81.1428     
1 1 1 26 2  72 o 7  40.0616 7.23944 27.3088     17.1348  42.1953     13.1587  23.137     207.218     0.688566    207.218     
1 1 1 26 2  73 o 14 23.6346 6.75426 12.0809     13.3653  3.80476     11.5492  7.49836    65.0171     5.68678     245.017     
1 1 1 26 2  74 o 16 34.1525 7.29383 33.0695     14.6355  18.218      12.9784  12.6983    298.914     14.2381     118.914     
1 1 1 26 2  75 o 14 24.2424 6.86855 7.20144     13.8907  10.7407     11.7142  7.86965    340.515     1.99541     340.515     
1 1 1 26 2  76 o 11 17.0233 5.49763 -4.02978    10.1492  -3.70535    10.7329  1.43097    164.896     2.83144     344.896     
1 1 1 26 2  77 o 18 23.6875 6.51503 14.9721     11.1818  3.01021     12.1226  7.00614    176.039     0.50632     176.039     
1 1 1 26 2  78 o 17 20.854  6.35068 -0.252616   12.8158  7.06651     11.6482  3.33546    207.898     3.42833     27.8985     
1 1 1 26 2  79 o 1  39.6216 6.96919 51.3888     14.1848  22.8671     15.3189  25.3055    12.8318     10.648      12.8318     
1 1 1 26 2  80 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 3  0  o 9  277.36  3.65285 1365.6      50.7337  1365.6      50.7337  241.403    2.61702e-06 73.7558     2.61702e-06 
1 1 1 26 3  1  o 15 361.085 4.06923 2327.35     69.8897  2302.64     77.1581  244.54     257.828     38.6785     77.8278     
1 1 1 26 3  2  o 11 371.69  4.14185 2407.82     73.2662  2498.92     80.9638  226.554    57.1802     90.7583     237.18      
1 1 1 26 3  3  o 6  605.016 5.85296 6563.45     181.71   6464.59     173.165  474.408    262.112     60.0243     262.112     
1 1 1 26 3  4  o 12 222.369 2.85641 877.861     31.1903  876.217     32.4585  145.973    338.405     28.0853     158.405     
1 1 1 26 3  5  o 19 65.2154 2.6787  82.2048     8.60515  69.4252     8.76428  1.05545    48.6477     73.0217     228.648     
1 1 1 26 3  6  o 8  38.1697 3.70503 21.9011     6.98204  31.2035     6.52223  19.7121    336.545     62.3588     336.545     
1 1 1 26 3  7  o 4  98.5562 2.33741 172.857     11.4896  171.977     11.5665  63.5622    87.0932     29.1667     87.0932     
1 1 1 26 3  8  o 8  148.662 2.37468 393.367     17.9637  390.364     17.4169  98.3204    79.4354     9.40416     259.435     
1 1 1 26 3  9  o 6  165.219 2.41789 494.187     20.3399  473.975     19.701   139.162    285.456     50.9135     285.456     
1 1 1 26 3  10 o 10 67.9257 2.6682  79.4075     8.79353  84.7955     9.30265  7.92265    14.6742     61.5199     194.674     
1 1 1 26 3  11 o 19 155.872 2.4826  427.727     18.9387  433.972     19.8418  120.007    61.8218     25.6009     61.8218     
1 1 1 26 3  12 f 0  73.1168 2.67461 94.513      9.23463  95.6255     10.2763  146.048    136.845     0           0           
1 1 1 26 3  13 o 4  149.304 2.60641 411.887     18.5303  379.4       20.3132  65.028     238.774     79.618      58.7738     
1 1 1 26 3  14 o 4  118.766 2.52177 240.356     13.6779  260.582     16.2795  67.6158    312.052     23.4658     132.052     
1 1 1 26 3  15 o 11 298.112 3.22311 1570.56     46.0676  1583.37     50.1649  215.435    98.7963     0.203103    98.7964     
1 1 1 26 3  16 o 11 103.93  2.64345 194.236     12.7283  189.425     14.6666  72.5191    120.645     26.609      120.645     
1 1 1 26 3  17 o 14 182.799 2.67213 598.205     24.419   587.183     24.5359  88.0872    221.399     83.4407     41.3994     
1 1 1 26 3  18 o 18 165.536 2.47186 479.48      20.0431  492.483     20.9678  120.986    71.0494     12.4777     71.0493     
1 1 1 26 3  19 o 15 136.328 2.59333 335.99      17.82    323.809     17.582   101.917    114.585     21.9635     114.585     
1 1 1 26 3  20 o 11 159.996 2.57071 452.806     19.9623  455.242     21.2452  76.3197    221.448     71.7706     41.4481     
1 1 1 26 3  21 o 7  325.486 3.41734 1900.19     53.3114  1860.98     58.0184  194.851    169.937     79.7741     349.937     
1 1 1 26 3  22 o 16 114.178 2.54005 233.13      14.1088  229.774     14.9053  87.6406    152.786     38.8546     152.786     
1 1 1 26 3  23 o 3  229.784 2.79517 926.579     30.7016  946.916     33.6355  206.428    318.001     90.0317     318.001     
1 1 1 26 3  24 o 2  60.2028 3.04997 63.3063     8.2506   65.9955     9.97783  9.19813    253.751     33.5316     73.7512     
1 1 1 26 3  25 o 8  143.65  2.57918 364.557     16.9024  367.777     20.0868  94.6072    286.368     6.54693     106.368     
1 1 1 26 3  26 o 4  168.107 2.63625 504.766     20.2916  497.874     23.9494  139.119    22.8387     48.4295     22.8387     
1 1 1 26 3  27 o 9  189.417 2.82266 658.172     23.5741  615.388     29.4659  142.551    224.872     21.0486     224.872     
1 1 1 26 3  28 o 3  316.35  3.5347  1774.72     53.4076  1779.83     58.5558  237.247    315.675     23.2542     315.675     
1 1 1 26 3  29 o 17 223.297 3.1182  858.429     31.5368  912.19      38.1143  183.691    318.946     54.2096     318.946     
1 1 1 26 3  30 o 5  137.368 2.78719 330.894     17.5823  339.413     20.6638  71.9214    35.7441     44.5151     215.744     
1 1 1 26 3  31 o 4  37.3789 4.60054 29.0155     7.25244  22.2736     9.04064  16.0165    278.204     59.063      278.204     
1 1 1 26 3  32 o 11 103.081 2.76457 185.588     12.994   192.171     15.4485  36.3612    210.012     65.8751     30.0124     
1 1 1 26 3  33 o 3  143.968 2.58664 372.358     16.968   363.629     20.1562  100.479    307.046     3.73406     307.046     
1 1 1 26 3  34 o 9  69.2627 3.07587 80.0307     9.73275  91.2346     11.5197  24.4502    21.3189     36.4273     201.319     
1 1 1 26 3  35 o 8  202.741 2.73983 715.059     25.4132  744.68      30.146   154.296    79.5944     24.8411     79.5944     
1 1 1 26 3  36 o 14 130.431 2.56226 296.535     15.7218  308.008     17.7153  73.6577    279.684     31.9748     99.6836     
1 1 1 26 3  37 o 15 92.552  2.69826 153.204     11.714   151.57      13.2076  64.1426    58.6366     8.9267      58.6366     
1 1 1 26 3  38 o 1  110.799 2.63533 211.618     13.9519  225.069     15.2727  48.9893    304.947     52.9394     124.947     
1 1 1 26 3  39 o 12 94.2302 2.67954 153.184     11.9188  162.898     13.3312  48.4406    66.9929     28.5121     246.993     
1 1 1 26 3  40 o 11 159.207 2.56661 445.776     19.5335  454.852     21.3965  144.666    92.3969     72.6084     92.3969     
1 1 1 26 3  41 o 1  38.5945 4.81475 25.2195     8.6607   29.7264     9.2852   4.23481    184.101     17.7999     4.10081     
1 1 1 26 3  42 o 4  97.505  2.69045 173.481     12.4067  165.151     13.7594  78.9844    267.331     32.3199     267.331     
1 1 1 26 3  43 o 4  36.812  4.78334 30.5707     7.77819  19.8918     8.94013  9.60754    148.017     59.5917     148.017     
1 1 1 26 3  44 o 14 206.635 2.70685 739.923     26.766   779.771     29.2892  130.903    241.624     24.1502     61.6244     
1 1 1 26 3  45 o 13 84.7084 2.85146 123.876     11.6205  132.341     12.5224  46.073     106.677     18.9822     286.677     
1 1 1 26 3  46 o 15 78.9099 2.88543 105.995     10.7197  116.633     12.0288  57.3277    217.633     16.0008     217.633     
1 1 1 26 3  47 f 0  20.0334 5.33251 2.90461     6.86432  7.74861     7.84574  29.5608    186.498     0           0           
1 1 1 26 3  48 o 7  65.6559 3.1497  67.9468     9.66724  87.3013     10.9333  42.3844    42.8648     5.41433     42.8648     
1 1 1 26 3  49 o 4  94.4796 2.97852 153.481     13.5455  165.956     14.5941  71.7604    297.014     19.5814     297.014     
1 1 1 26 3  50 o 8  36.7607 5.00145 29.8828     8.61235  20.9193     9.05966  4.85875    219.493     32.9219     39.4933     
1 1 1 26 3  51 o 17 50.986  3.94659 51.1749     9.56083  43.569      10.1453  21.2274    122.547     22.7975     302.547     
1 1 1 26 3  52 o 12 143.516 2.84965 358.415     19.3834  378.591     21.5558  106.429    192.759     18.5598     192.759     
1 1 1 26 3  53 o 11 23.6249 5.78985 12.364      7.91792  5.08738     9.49114  2.09861    75.2791     4.51017     255.279     
1 1 1 26 3  54 o 9  152.969 2.79961 411.678     19.5686  426.232     23.2273  123.284    42.5512     40.5087     42.5512     
1 1 1 26 3  55 o 16 47.0903 4.35159 42.9047     9.46748  39.0258     10.4621  24.5147    137.452     9.6987      317.452     
1 1 1 26 3  56 o 18 62.6265 3.56301 74.8619     10.186   67.7008     11.802   31.088     67.3667     19.3189     247.367     
1 1 1 26 3  57 o 4  98.5793 3.0221  177.715     14.492   172.266     15.27    84.3345    247.725     39.1067     247.725     
1 1 1 26 3  58 o 2  56.3491 3.88057 65.5475     10.7325  51.2156     10.749   38.6       215.474     6.08598     215.474     
1 1 1 26 3  59 o 7  49.8261 4.06389 44.0067     9.59948  47.6002     10.3279  25.6875    88.7894     11.489      268.789     
1 1 1 26 3  60 o 10 103.534 2.98923 199.122     14.4571  187.549     16.3614  80.0059    238.364     24.1344     238.364     
1 1 1 26 3  61 o 1  26.693  6.10877 14.6408     8.27677  11.531      10.6865  9.37615    344.451     0.0553335   344.451     
1 1 1 26 3  62 o 11 43.8826 5.22388 34.5611     9.86275  39.1691     12.2773  30.9996    34.4709     9.55038     34.4709     
1 1 1 26 3  63 o 16 26.7644 6.3651  16.4885     9.43726  9.17802     11.4391  8.64012    273.573     3.29252     273.573     
1 1 1 26 3  64 o 11 68.5115 3.81468 103.747     12.6932  70.8998     12.8386  41.3436    353.703     5.5291      173.703     
1 1 1 26 3  65 o 17 39.378  5.52528 35.2189     10.6661  26.1569     10.3647  11.203     61.3865     26.66       241.386     
1 1 1 26 3  66 o 1  47.7946 4.72785 46.2026     10.7077  41.3783     11.2376  33.8594    14.6811     8.93895     14.6811     
1 1 1 26 3  67 o 6  42.2129 5.42601 33.5446     11.3213  37.0243     10.7522  26.3155    25.2515     1.60283     25.2515     
1 1 1 26 3  68 o 1  27.1728 6.33611 18.4023     10.6136  11.1614     9.61577  12.9849    310.533     0.527517    130.533     
1 1 1 26 3  69 f 0  45.5259 5.42398 34.2588     11.8958  48.6192     11.7101  24.7745    139.64      0           0           
1 1 1 26 3  70 o 18 60.7089 5.01105 85.1812     16.8812  59.7131     13.1148  45.2014    154.312     15.8228     154.312     
1 1 1 26 3  71 o 11 36.44   6.70837 23.9101     14.0693  32.4649     11.2218  16.8848    43.1083     8.05087     223.108     
1 1 1 26 3  72 o 15 70.894  4.70622 101.119     16.777   92.8015     16.2653  52.0301    78.0141     16.1247     78.0141     
1 1 1 26 3  73 o 11 26.0773 6.91533 19.4616     13.5223  5.18545     11.6563  8.54413    165.352     3.5511      165.352     
1 1 1 26 3  74 o 10 23.958  6.60378 20.1728     13.6081  -7.21653    12.0349  8.93032    252.402     5.1787      72.4017     
1 1 1 26 3  75 o 11 19.4722 6.17733 -1.99279    13.661   -0.680367   11.3434  4.27228    268.838     5.31858     88.838      
1 1 1 26 3  76 o 12 46.9233 6.67004 52.9686     15.6936  43.1461     14.6068  33.6152    9.55418     12.9248     9.55418     
1 1 1 26 3  77 o 16 42.6478 7.55466 47.7365     17.7287  38.5937     14.5134  24.1162    123.677     0.532439    303.677     
1 1 1 26 3  78 o 18 18.3135 5.8836  -6.02447    12.0185  1.33228     11.7527  0.621348   294.255     3.45366     114.255     
1 1 1 26 3  79 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 3  80 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 4  0  o 14 43.0756 3.7738  34.3904     7.81033  34.3904     7.81033  76.1848    180         210.973     180         
1 1 1 26 4  1  o 8  448.067 4.63173 3565.4      96.2732  3570.13     111.2    339.401    97.6625     21.5168     97.6625     
1 1 1 26 4  2  o 17 163.373 2.79048 477.259     22.2984  469.602     23.3722  117.149    163.573     5.45046     163.573     
1 1 1 26 4  3  o 9  156.646 2.50061 438.924     19.5748  431.377     19.6834  99.4824    325.631     20.818      145.631     
1 1 1 26 4  4  o 7  268.151 3.01124 1296.37     39.5657  1255.06     41.3101  235.519    246.56      84.2756     246.56      
1 1 1 26 4  5  o 8  190.408 2.71182 648.64      25.1994  637.451     26.5238  138.432    1.83653     6.27727     1.83653     
1 1 1 26 4  6  o 9  107.138 2.46304 205.079     12.6174  202.458     13.763   68.8921    85.0463     43.3047     85.0463     
1 1 1 26 4  7  o 3  273.302 3.07442 1315.3      42.0633  1335.16     42.152   201.787    78.1935     7.57745     78.1935     
1 1 1 26 4  8  o 6  103.557 2.4367  197.629     12.7711  183.267     12.4807  57.039     336.322     36.0198     336.322     
1 1 1 26 4  9  o 1  174.762 2.54837 536.85      23.1218  546.464     21.4689  136.425    47.4556     28.0778     47.4556     
1 1 1 26 4  10 o 4  332.365 3.24425 1972.47     55.0182  1948.05     53.0482  260.952    282.427     38.5774     282.427     
1 1 1 26 4  11 o 18 413.066 3.8421  3011.9      82.4738  3047.48     76.4394  345.698    283.482     88.7674     283.482     
1 1 1 26 4  12 o 12 425.46  3.99036 3209.51     88.2439  3220.17     81.7827  297.072    123.142     27.4284     303.142     
1 1 1 26 4  13 o 4  163.127 2.56228 472.898     21.7185  471         20.1482  140.481    263.576     57.827      263.576     
1 1 1 26 4  14 o 11 228.733 2.87982 933.134     32.9016  923.187     33.1176  153.525    185.694     21.2281     5.69357     
1 1 1 26 4  15 o 19 334.089 3.47946 1980.01     58.1982  1982.55     58.312   260.688    304.228     37.0611     304.228     
1 1 1 26 4  16 o 10 95.2181 2.467   160.076     11.4389  161.942     12.0602  11.1788    287.09      105.537     107.09      
1 1 1 26 4  17 o 6  111.76  2.49188 225.358     12.9788  218.154     14.8053  84.4733    350.172     49.3975     350.172     
1 1 1 26 4  18 o 11 185.11  2.61537 604.441     23.1759  611.147     25.3118  150.115    214.367     41.5072     214.367     
1 1 1 26 4  19 o 10 109.542 2.58963 218.023     13.3698  208.187     14.9357  34.8734    116.327     78.6251     296.327     
1 1 1 26 4  20 o 15 150.446 2.57834 403.16      19.842   399.786     19.0313  122.971    245.709     42.8256     245.709     
1 1 1 26 4  21 o 16 171.372 2.6748  525.823     22.4455  516.144     23.4751  69.357     290.998     103.917     110.998     
1 1 1 26 4  22 o 15 109.53  2.59988 222.393     14.2746  203.895     14.2087  83.3424    287.101     38.0046     287.101     
1 1 1 26 4  23 o 7  154.511 2.44312 412.843     18.8509  434.151     18.9781  143.287    73.1777     82.5826     73.1777     
1 1 1 26 4  24 o 18 164.059 2.48999 482.061     20.3721  472.791     20.5678  122.572    33.4237     18.2549     33.4237     
1 1 1 26 4  25 o 12 345.056 3.42869 2138.33     60.4209  2090.08     58.1565  246.755    68.3147     2.62049     248.315     
1 1 1 26 4  26 o 19 49.1357 3.45419 44.4321     8.34483  42.1713     8.43302  0.388818   110.661     35.4788     110.66      
1 1 1 26 4  27 o 13 187.864 2.58244 626.476     24.6462  625.816     23.9749  103.711    91.4005     57.6294     271.4       
1 1 1 26 4  28 o 3  181.467 2.56779 586.914     23.2133  581.606     23.4875  105.936    134.908     43.3166     314.908     
1 1 1 26 4  29 o 3  280.189 3.02802 1407.43     40.7876  1380.16     44.1451  215.415    204.378     31.9403     204.378     
1 1 1 26 4  30 o 6  102.575 2.64792 193.809     12.8316  180.261     14.2421  65.2468    166.87      3.45606     346.87      
1 1 1 26 4  31 o 4  38.2954 4.27281 21.7421     7.5111   32.2276     8.25722  26.7595    176.553     93.706      176.553     
1 1 1 26 4  32 o 7  148.104 2.57517 382.393     17.9175  396.566     20.2567  131.262    71.3566     61.0081     71.3566     
1 1 1 26 4  33 o 1  125.958 2.69226 289.964     15.0555  273.998     18.5931  110.197    122.305     52.1332     122.305     
1 1 1 26 4  34 o 6  126.315 2.61349 279.308     15.6844  287.752     17.3473  52.1174    249.191     70.9872     69.1907     
1 1 1 26 4  35 o 5  83.4043 2.83389 126.163     10.8788  121.567     12.6362  52.3965    289.073     1.75468     109.073     
1 1 1 26 4  36 o 9  46.2159 3.95942 41.6892     8.32715  35.6311     9.4339   4.7254     87.1827     40.0676     267.183     
1 1 1 26 4  37 o 2  119.223 2.60222 255.563     14.554   249.9       16.4236  98.6344    254.174     37.8086     254.174     
1 1 1 26 4  38 o 4  142.623 2.62067 362.411     17.505   360.666     19.8553  110.363    260.341     25.1747     260.341     
1 1 1 26 4  39 f 0  46.003  4.11743 45.2393     8.31963  32.0567     9.64575  53.8954    173.424     0           0           
1 1 1 26 4  40 o 5  100.772 2.79815 194.124     13.4075  168.071     14.6253  34.0509    101.465     69.1717     281.465     
1 1 1 26 4  41 o 15 135.064 2.60907 316.931     16.0911  332.34      19.1272  92.9257    279.175     0.841239    279.175     
1 1 1 26 4  42 o 1  48.5572 3.7815  38.6664     8.34348  46.7369     9.77442  15.2251    76.3923     24.5699     256.392     
1 1 1 26 4  43 o 4  49.2204 3.76804 35.9683     8.34861  52.3855     9.91364  14.1332    292.022     29.2037     112.022     
1 1 1 26 4  44 o 19 116.702 2.53392 243.581     14.3134  241.557     15.2702  75.4589    100.228     7.03691     280.228     
1 1 1 26 4  45 o 2  48.6796 3.8448  44.9168     8.53685  41.0122     9.7619   3.38613    241.479     52.9206     61.4788     
1 1 1 26 4  46 f 0  72.3387 3.16714 90.4499     11.4316  97.1741     11.4058  78.1671    96.7405     0           0           
1 1 1 26 4  47 o 19 35.0029 5.03026 20.2048     8.56024  25.744      8.48012  3.33477    306.421     27.0011     126.421     
1 1 1 26 4  48 o 1  83.4937 2.9516  121.617     12.2661  127.954     12.3517  57.5674    234.845     5.46236     234.845     
1 1 1 26 4  49 o 16 28.3551 5.64572 15.6781     8.59679  14.5131     8.12782  0.956812   140.217     31.243      140.217     
1 1 1 26 4  50 o 9  71.4871 3.29963 98.9213     11.3588  85.19       12.034   47.8106    74.309      1.33349     74.309      
1 1 1 26 4  51 o 7  65.1927 3.28329 70.091      10.0183  83.3677     11.3073  34.7558    25.1371     16.3812     205.137     
1 1 1 26 4  52 o 12 58.277  3.55982 68.0111     9.47392  55.3704     10.8084  36.8774    192.498     1.26347     12.4975     
1 1 1 26 4  53 o 2  18.4546 5.33684 3.6504      7.18988  1.1845      8.58842  7.40208    108.417     30.6855     108.417     
1 1 1 26 4  54 o 13 112.421 2.74794 223.734     15.0212  229.503     15.8918  79.8251    206.614     8.80799     206.614     
1 1 1 26 4  55 o 3  71.5881 3.14298 93.7488     11.0721  91.2903     11.3601  58.9118    141.36      25.3546     141.36      
1 1 1 26 4  56 o 9  81.7953 3.00312 125.964     12.0842  115.297     12.4141  68.7597    342.685     30.7323     342.685     
1 1 1 26 4  57 o 1  155.54  2.68879 408.137     20.3808  460.724     21.5145  135.661    33.2334     63.3473     33.2334     
1 1 1 26 4  58 o 10 16.8846 5.17962 -3.66101    7.92127  1.90084     8.48276  0.59074    73.4053     5.56271     73.4053     
1 1 1 26 4  59 o 19 17.6188 5.32612 3.14678     8.13383  -3.70304    8.96386  4.29788    95.4846     23.4087     95.4846     
1 1 1 26 4  60 o 14 94.5824 3.02693 162.468     13.8102  160.81      14.7861  73.539     100.289     23.0413     100.289     
1 1 1 26 4  61 o 14 22.4126 5.90321 8.11518     8.51717  7.55599     9.24654  3.88875    277.029     14.3166     97.029      
1 1 1 26 4  62 o 11 19.0078 5.45363 6.70471     8.25557  -1.19321    8.49648  1.29806    300.528     14.7819     120.528     
1 1 1 26 4  63 o 8  31.1127 6.05914 24.7024     10.4613  14.2041     9.35651  14.7398    354.499     6.42419     174.499     
1 1 1 26 4  64 o 9  33.2608 6.08943 17.7781     9.84857  27.1836     10.8025  20.5377    213.741     3.70044     213.741     
1 1 1 26 4  65 f 0  51.8524 4.53853 44.8467     10.1055  57.9062     13.0215  29.8701    231.913     0           0           
1 1 1 26 4  66 o 11 101.414 3.16929 180.252     15.0171  196.704     17.1147  79.5825    98.2851     28.0921     98.2851     
1 1 1 26 4  67 o 3  60.1448 4.14389 69.5789     13.2905  67.0376     11.303   36.79      170.643     2.52388     350.643     
1 1 1 26 4  68 o 13 23.4568 5.71267 20.1246     10.0566  -6.97166    9.99301  7.33769    347.969     0.104848    347.969     
1 1 1 26 4  69 o 18 92.0962 3.8909  163.24      18.1742  154.736     17.579   68.6789    299.161     20.2116     299.161     
1 1 1 26 4  70 o 6  28.4739 6.69929 7.16295     13.4275  23.4158     11.0875  12.4985    23.7875     2.74223     23.7874     
1 1 1 26 4  71 o 1  69.4111 4.49995 96.4603     16.413   88.3615     14.5418  43.8744    221.629     0.810441    221.629     
1 1 1 26 4  72 o 19 46.6769 6.45633 48.9647     15.1325  42.1302     14.003   33.0767    294.754     10.6723     294.754     
1 1 1 26 4  73 o 8  18.7014 5.99643 3.33818     13.3553  -11.5917    11.2288  3.67628    351.1       5.745       171.1       
1 1 1 26 4  74 o 6  32.638  7.33452 22.0885     14.5497  25.5189     12.6762  14.0435    121.792     9.10687     301.792     
1 1 1 26 4  75 o 13 40.2828 7.12797 35.0215     15.2535  38.2188     13.5507  25.3642    293.085     4.60649     293.085     
1 1 1 26 4  76 o 16 20.9199 6.36261 -6.57947    14.1282  9.418       11.6071  2.44732    218.347     1.18574     38.3471     
1 1 1 26 4  77 o 12 43.167  7.45823 50.6444     17.847   38.8234     14.1758  27.2543    354.165     6.45066     354.165     
1 1 1 26 4  78 o 11 25.6257 7.23803 24.7823     16.5038  2.63268     12.3862  7.07773    220.977     3.59077     40.9773     
1 1 1 26 4  79 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 5  0  o 19 55.8694 2.85233 56.1979     7.88848  56.1979     7.88848  4.86531    180         14.6633     360         
1 1 1 26 5  1  o 3  297.942 3.12308 1561.02     44.806   1589.29     48.4154  171.009    271.736     93.3543     91.7362     
1 1 1 26 5  2  o 12 219.099 2.67983 853.039     30.5447  849.886     28.2638  192.128    190.419     71.6041     190.419     
1 1 1 26 5  3  o 13 251.054 2.8809  1128.53     37.5756  1107.78     34.8882  131.684    184.732     101.947     4.73231     
1 1 1 26 5  4  o 9  163.926 2.48614 495.06      20.7388  458.405     20.1053  54.6787    197.574     125.397     17.5739     
1 1 1 26 5  5  o 18 161.159 2.56694 468.537     20.6329  452.799     20.8219  159.116    253.464     107.808     253.464     
1 1 1 26 5  6  o 18 168.919 2.54781 504.094     21.4672  508.03      21.6686  145.115    29.4724     56.0866     29.4724     
1 1 1 26 5  7  o 9  177.946 2.70357 570.967     24.5462  552.439     23.674   101.08     98.3212     51.7711     278.321     
1 1 1 26 5  8  o 17 325.961 3.42611 1923.48     53.4622  1848.8      58.2555  297.209    262.392     120.939     262.392     
1 1 1 26 5  9  o 9  210.877 2.71332 814.466     27.9816  763.544     29.287   104.882    117.6       94.6321     297.6       
1 1 1 26 5  10 o 5  118.445 2.46408 256.141     13.9338  242.005     15.2127  93.5773    230.675     38.944      230.675     
1 1 1 26 5  11 o 15 353.254 3.49102 2257.96     59.3065  2172.95     64.0939  255.489    295.916     4.43715     115.916     
1 1 1 26 5  12 o 16 448.175 4.22684 3569.89     96.7646  3568.1      93.0689  334.362    345.175     12.9014     345.175     
1 1 1 26 5  13 o 12 401.593 3.74833 2849.23     78.2465  2878.78     72.4852  324.878    95.7593     63.8488     95.7593     
1 1 1 26 5  14 o 1  148.343 2.45178 393.029     18.18    387.537     18.2721  133.006    311.21      69.2742     311.21      
1 1 1 26 5  15 o 16 212.234 2.61194 776.321     28.696   821.947     26.7584  180.029    67.853      59.0402     67.853      
1 1 1 26 5  16 o 11 190.72  2.54725 647.547     25.1641  642.807     23.5055  138.153    52.2839     6.19079     52.2838     
1 1 1 26 5  17 o 19 144.665 2.54565 371.633     18.2328  371.012     18.6597  105.394    208.598     12.7031     208.598     
1 1 1 26 5  18 o 8  87.183  2.66034 134.959     11.8396  135.212     11.3463  31.6068    274.902     47.4966     94.9024     
1 1 1 26 5  19 o 9  65.6582 2.97236 71.1827     9.66864  82.656      9.75169  12.3527    203.144     2.71081     23.144      
1 1 1 26 5  20 o 15 447.548 4.39224 3580.63     100.558  3541.39     96.4416  350.477    57.9567     50.6439     57.9567     
1 1 1 26 5  21 o 5  115.618 2.61075 244.891     14.6868  229.982     15.4809  94.1518    281.541     47.3219     281.541     
1 1 1 26 5  22 o 10 242.481 2.92316 1027.19     34.0007  1059.8      37.0186  178.539    91.7884     10.2513     91.7884     
1 1 1 26 5  23 o 4  349.312 3.50965 2169.04     60.1354  2165.04     62.7113  339.837    273.465     177.747     273.465     
1 1 1 26 5  24 o 3  182.127 2.65328 583.65      24.1745  593.43      24.2586  144.592    235.303     34.277      235.303     
1 1 1 26 5  25 o 18 373.313 3.64477 2518.27     66.754   2434.08     69.5295  297.036    193.062     56.064      193.062     
1 1 1 26 5  26 o 3  80.6196 2.70898 116.694     10.8601  114.513     10.9648  43.2207    44.5906     8.93116     224.591     
1 1 1 26 5  27 o 18 187.674 2.68155 626.056     26.1358  624.099     24.2729  138.493    225.551     12.5883     225.551     
1 1 1 26 5  28 o 14 227.757 2.74379 920.916     31.2094  920.615     31.4245  176.344    67.6856     29.1742     67.6856     
1 1 1 26 5  29 o 3  212.427 2.7783  808.981     28.2041  793.273     30.8607  169.213    317.727     37.7924     317.727     
1 1 1 26 5  30 o 19 113.563 2.59296 235.719     14.317   222.676     15.1146  41.8332    177.245     73.5742     357.245     
1 1 1 26 5  31 o 14 147.74  2.5318  376.543     18.9214  398.736     18.5279  113.569    297.504     21.9418     297.504     
1 1 1 26 5  32 o 5  68.6578 2.8754  81.7135     9.50466  86.3624     10.195   14.8887    227.182     59.6099     47.1822     
1 1 1 26 5  33 o 17 108.64  2.51345 210.733     13.2619  208.824     14.054   96.6502    259.883     52.7355     259.883     
1 1 1 26 5  34 o 14 67.4895 3.03112 83.7839     9.92745  78.831      10.4389  9.72235    121.6       68.9985     301.6       
1 1 1 26 5  35 o 12 126.123 2.59004 276.163     15.2448  289.502     17.4323  75.0627    166.087     24.0323     346.087     
1 1 1 26 5  36 o 16 16.8878 5.01139 -3.39561    6.62642  3.99792     7.9993   9.97198    152.577     23.2297     152.577     
1 1 1 26 5  37 f 0  186.228 2.56884 613.692     23.5886  618.791     24.3563  158.114    66.9594     0           0           
1 1 1 26 5  38 o 4  62.1257 3.14114 64.0342     9.26564  74.2482     10.1701  34.1652    77.3222     5.01845     257.322     
1 1 1 26 5  39 o 4  61.8333 3.19008 70.7704     9.39184  66.1664     10.1862  24.9286    205.898     15.209      205.898     
1 1 1 26 5  40 o 8  79.3564 3.00176 117.236     10.7282  107.758     12.8487  43.9384    262.136     16.2958     82.136      
1 1 1 26 5  41 o 8  116.372 2.51412 240.822     14.0681  241.332     15.2004  76.1366    113.09      6.43961     293.09      
1 1 1 26 5  42 o 15 47.6445 3.87027 35.8116     8.29381  46.8205     9.87113  11.3635    344.218     33.2421     164.218     
1 1 1 26 5  43 o 8  77.8288 3.03737 101.965     11.0946  114.923     12.5174  43.7876    62.4303     13.9564     242.43      
1 1 1 26 5  44 o 10 84.4852 2.99981 121.359     12.1515  134.089     13.1758  57.4445    298.281     4.89724     298.281     
1 1 1 26 5  45 o 12 60.3553 3.72356 74.4937     10.2395  57.5236     11.6375  37.3341    334.926     3.18284     334.926     
1 1 1 26 5  46 o 1  106.38  2.97733 201.522     15.1322  203.169     16.5237  67.9747    214.053     7.89208     34.0526     
1 1 1 26 5  47 o 19 14.9021 4.78423 -7.81021    6.99687  -1.2847     8.54197  18.5082    310.743     46.5219     310.743     
1 1 1 26 5  48 o 10 47.0944 4.49683 39.3499     9.68924  42.1928     10.9863  28.5563    51.2102     0.0396661   51.2111     
1 1 1 26 5  49 o 5  32.9884 5.21022 32.2612     7.88696  8.52324     10.0621  8.44658    171.254     2.89807     171.254     
1 1 1 26 5  50 o 1  26.4691 5.83256 14.5382     7.89572  10.8202     9.49854  3.62148    283.461     19.0867     103.461     
1 1 1 26 5  51 o 3  36.3592 4.99345 20.9029     8.18615  29.2619     9.38223  18.9697    114.57      2.33106     294.57      
1 1 1 26 5  52 o 8  31.415  5.40499 25.8036     8.27671  11.7809     9.24226  9.41035    208.661     58.102      208.661     
1 1 1 26 5  53 o 2  92.269  2.9663  155.728     13.197   150.52      14.1265  71.3057    210         19.5298     210         
1 1 1 26 5  54 o 7  137.443 2.86771 351.463     18.2768  327.368     20.9678  86.6132    352.377     12.6759     172.377     
1 1 1 26 5  55 o 19 28.0316 5.72096 10.1504     8.13802  20.0244     9.21906  8.86471    267.329     11.1541     87.3293     
1 1 1 26 5  56 f 0  149.98  2.82451 390.293     21.1851  418.612     21.2166  95.7857    142.047     0           0           
1 1 1 26 5  57 o 2  48.3085 4.30644 45.1884     9.64174  41.4748     10.6363  30.0944    149.783     0.347869    329.783     
1 1 1 26 5  58 f 0  32.9304 5.88753 18.9602     9.6578   23.5156     9.83645  30.0029    59.2978     0           0           
1 1 1 26 5  59 f 0  40.498  5.2695  35.2564     10.4878  27.8757     10.0915  29.2604    149.792     0           0           
1 1 1 26 5  60 o 18 82.1916 3.35002 122.649     14.37    123.201     13.0717  69.6676    254.637     32.2185     254.637     
1 1 1 26 5  61 o 9  26.5006 5.59253 20.7467     8.47403  4.23646     9.40954  9.58022    176.177     10.3777     356.177     
1 1 1 26 5  62 o 11 36.3782 5.56857 28.5862     8.80843  23.5316     10.8962  26.7228    235.611     13.984      235.611     
1 1 1 26 5  63 o 17 23.279  5.87843 14.317      8.98893  2.96368     9.4256   5.98273    244.015     1.32662     244.015     
1 1 1 26 5  64 o 4  28.8588 6.04566 14.9836     8.57447  18.7481     10.1663  6.43714    128.596     21.5952     308.596     
1 1 1 26 5  65 o 13 41.684  5.44863 40.7123     9.41571  28.5072     11.9902  27.7979    106.157     5.13143     106.157     
1 1 1 26 5  66 o 7  69.9021 3.60508 93.0246     12.5479  88.6221     12.5301  48.8224    257.656     8.24956     257.656     
1 1 1 26 5  67 o 16 75.3763 3.81977 101.997     13.2986  110.675     15.3522  46.446     49.8173     3.6445      229.817     
1 1 1 26 5  68 o 18 63.8118 4.27733 80.8068     13.7025  74.2662     13.321   54.3699    198.808     29.9758     198.808     
1 1 1 26 5  69 o 9  37.0352 6.1302  35.122      11.7289  22.5468     10.8185  24.3552    236.781     14.4391     236.781     
1 1 1 26 5  70 o 12 28.0843 6.69093 17.415      11.2973  15.1468     11.0225  13.6939    293.759     2.94541     293.759     
1 1 1 26 5  71 o 13 48.3903 5.47082 52.4378     12.5929  41.5184     12.8642  29.8576    95.9035     0.518186    95.9035     
1 1 1 26 5  72 o 13 32.0044 7.18987 18.5201     14.557   25.6126     12.0573  16.3069    131.347     3.37051     311.347     
1 1 1 26 5  73 o 10 19.1551 6.07506 -8.25687    13.714   2.5134      11.2     3.41198    84.4083     2.02805     264.408     
1 1 1 26 5  74 o 9  20.6347 6.39197 -2.62964    14.2436  4.98521     11.5334  4.96322    283.795     7.61209     103.795     
1 1 1 26 5  75 o 16 25.0375 6.83023 23.8076     14.3837  -2.6204     12.2154  9.18152    173.327     3.56694     353.327     
1 1 1 26 5  76 f 0  22.9346 6.91993 7.55624     16.0997  7.2499      12.0513  8.76259    235.05      0           0           
1 1 1 26 5  77 o 19 22.5281 7.05544 10.799      18.8731  1.58848     12.1032  3.54098    93.1138     4.10688     273.114     
1 1 1 26 5  78 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 6  0  o 11 116.298 2.50193 240.426     14.5511  240.426     14.5511  108.105    360         71.094      360         
1 1 1 26 6  1  o 6  54.1331 2.98705 53.2489     8.25395  51.3809     7.82453  3.58221    91.6949     27.1822     271.695     
1 1 1 26 6  2  o 19 388.646 3.5679  2672.65     69.4841  2690.87     69.4969  330.57     40.1161     91.4051     40.1161     
1 1 1 26 6  3  o 12 243.474 2.78295 1035.43     33.3098  1067.97     34.604   92.27      15.5566     170.792     195.557     
1 1 1 26 6  4  o 9  121.612 2.33335 263.373     14.18    261.559     14.2345  93.7784    316.851     29.153      316.851     
1 1 1 26 6  5  o 16 166.847 2.46603 488.913     20.6638  498.564     20.5728  138.741    202.883     44.8706     202.883     
1 1 1 26 6  6  o 7  160.17  2.45406 454.048     20.0551  455.947     19.3331  56.2222    327.942     116.828     147.942     
1 1 1 26 6  7  o 6  149.409 2.39735 395.795     18.5415  395.997     17.3383  93.5207    94.283      22.4115     274.283     
1 1 1 26 6  8  o 1  281.341 3.04284 1397.37     45.3381  1411.81     40.2883  237.11     42.986      66.1108     42.9861     
1 1 1 26 6  9  o 1  168.572 2.61726 509.287     21.4845  498.862     22.7046  120.052    54.9908     2.27239     54.9906     
1 1 1 26 6  10 o 6  88.1063 2.58907 136.405     11.2511  139.467     11.5628  31.0642    86.0756     51.066      266.076     
1 1 1 26 6  11 o 12 296.61  3.2511  1599.71     48.253   1523.91     48.3737  191.826    180.468     48.5898     0.46784     
1 1 1 26 6  12 o 3  199.308 2.64153 715.684     25.7368  693.729     26.9918  114.033    164.093     58.3959     344.093     
1 1 1 26 6  13 o 14 170.52  2.55195 518.4       21.6897  513.147     21.9234  121.384    327.847     2.18261     327.847     
1 1 1 26 6  14 o 14 334.123 3.60037 1976.84     56.1951  1988.12     64.1347  257.302    109.611     28.1085     109.611     
1 1 1 26 6  15 o 10 219.879 2.67476 886.55      28.2182  829.309     30.5776  177.633    245.074     40.7747     245.074     
1 1 1 26 6  16 f 0  155.688 2.47193 444.729     18.4143  415.385     20.0508  151.283    286.586     0           0           
1 1 1 26 6  17 o 2  353.073 3.35036 2219.94     59.2484  2206.6      59.3133  232.049    0.0195096   50.1752     180.02      
1 1 1 26 6  18 o 3  110.834 2.47643 227.317     13.52    209.113     13.9175  50.9169    235.707     39.0905     235.707     
1 1 1 26 6  19 o 9  214.486 2.78352 824.172     31.1533  808.487     28.6551  159.244    149.867     11.9202     149.867     
1 1 1 26 6  20 o 6  259.329 2.96775 1225.23     39.2234  1162.43     37.918   183.564    307.759     6.63843     127.759     
1 1 1 26 6  21 f 0  197.525 2.64397 694.111     26.58    690.435     25.76    132.997    339.65      0           0           
1 1 1 26 6  22 o 6  108.799 2.59162 205.6       13.8128  214.984     14.4096  74.6405    295.672     6.66097     295.672     
1 1 1 26 6  23 o 5  181.523 2.58741 580.264     23.3871  589.108     23.6879  110.74     34.2678     36.4939     214.268     
1 1 1 26 6  24 o 10 193.91  2.66013 661.93      25.2552  672.69      26.4399  154.993    261.356     35.4389     261.356     
1 1 1 26 6  25 o 16 200.112 2.74981 704.329     26.2895  717.329     28.8258  142.544    79.8956     0.209952    79.8955     
1 1 1 26 6  26 o 8  92.8027 2.72006 158.182     12.356   148.185     12.8572  65.6397    263.556     13.5016     263.556     
1 1 1 26 6  27 o 2  229.74  2.93847 922.289     33.0582  952.475     34.6049  187.618    102.848     47.4463     102.848     
1 1 1 26 6  28 o 16 132.269 2.57424 308.95      16.968   312.635     17.1266  106.08     31.01       29.9991     31.01       
1 1 1 26 6  29 o 19 312.176 3.61181 1759.39     54.9309  1707.54     57.9815  272.718    70.447      97.8171     70.447      
1 1 1 26 6  30 f 0  134.543 2.61628 306.106     17.4885  337.616     17.738   127.425    317.76      0           0           
1 1 1 26 6  31 o 3  55.2776 3.52059 49.206      9.39588  60.7054     9.85611  12.5529    128.475     41.592      308.476     
1 1 1 26 6  32 o 18 43.7432 4.09509 37.8743     8.64413  31.6546     8.78513  6.53205    304.024     28.7605     124.024     
1 1 1 26 6  33 o 19 27.6552 5.42372 17.8576     7.88452  10.1568     8.01964  15.1431    115.554     50.1542     115.554     
1 1 1 26 6  34 o 13 83.7054 2.87207 132.333     12.0033  117.594     11.9884  68.806     311.753     40.5599     311.753     
1 1 1 26 6  35 o 19 50.4541 3.75007 42.3608     8.79683  49.5278     9.89451  9.01691    70.7845     42.227      250.785     
1 1 1 26 6  36 o 18 115.687 2.53432 236.794     14.2322  239.362     15.1089  80.7457    86.6289     3.10758     86.6289     
1 1 1 26 6  37 o 4  96.2825 2.65334 165.578     12.3325  164.608     13.2057  70.6593    52.766      12.96       52.766      
1 1 1 26 6  38 o 5  47.2327 3.77398 37.036      8.30537  43.7731     9.25514  4.99601    12.0894     47.2315     192.089     
1 1 1 26 6  39 o 13 54.3859 3.59199 52.734      9.21276  53.7886     10.1249  27.1956    303.159     8.36635     123.159     
1 1 1 26 6  40 o 4  127.288 2.6094  276.768     16.1528  300.643     17.1068  129.77     165.858     91.0916     165.858     
1 1 1 26 6  41 o 6  53.0436 3.63509 50.029      9.43038  51.522      9.65393  22.5054    200.944     17.9311     20.944      
1 1 1 26 6  42 o 5  76.5978 3.3066  116.095     11.5909  94.817      13.3175  57.066     40.6723     17.7333     40.6723     
1 1 1 26 6  43 o 15 76.1298 3.13594 112.017     11.3687  95.9657     12.3019  39.3294    273.198     21.3482     93.1976     
1 1 1 26 6  44 o 17 69.3864 3.24396 81.8122     10.7687  91.173      11.6708  51.0003    109.81      15.2964     109.81      
1 1 1 26 6  45 o 11 31.9188 5.28354 21.9721     7.69619  16.3565     9.00888  2.88112    83.8418     41.2478     83.8418     
1 1 1 26 6  46 o 12 92.8684 2.85897 154.174     12.6133  154.449     13.9024  57.1073    272.061     11.9627     92.0609     
1 1 1 26 6  47 o 6  75.1497 3.09454 104.994     11.0926  97.8565     12.0459  45.6381    157.068     9.86672     337.068     
1 1 1 26 6  48 o 5  23.9812 5.04803 18.6096     7.60031  -1.54855    8.15506  1.91856    102.214     17.301      282.214     
1 1 1 26 6  49 o 5  49.1112 3.8119  47.4549     8.93108  40.655      9.4146   33.1883    208.145     24.9711     208.145     
1 1 1 26 6  50 o 14 25.491  5.59818 12.4295     7.54199  11.5406     8.29039  19.4576    73.132      70.3207     73.132      
1 1 1 26 6  51 o 16 55.8421 3.93365 66.2411     10.4579  48.4213     10.9198  45.2603    198.349     20.8129     198.349     
1 1 1 26 6  52 f 0  31.0855 5.19376 8.16602     7.9642   29.7976     9.07575  24.9       254.8       0           0           
1 1 1 26 6  53 o 17 31.0908 5.66    10.0876     8.21382  28.1472     10.3407  14.3475    27.7863     2.10873     27.7863     
1 1 1 26 6  54 o 8  57.4182 4.17119 52.4544     10.8783  69.5785     12.797   40.5504    241.892     7.27115     241.892     
1 1 1 26 6  55 o 3  93.475  3.3282  161.027     14.5545  155.439     16.4238  68.5635    358.92      12.3673     358.92      
1 1 1 26 6  56 o 15 59.1981 4.004   70.0889     11.0753  59.0021     12.162   28.7252    265.346     20.0623     85.3461     
1 1 1 26 6  57 o 18 83.0487 3.40004 130.142     13.4122  120.575     14.6662  46.0476    142.603     18.2869     322.603     
1 1 1 26 6  58 o 11 37.3249 5.60115 38.0601     9.53456  16.8691     11.0351  18.5445    53.707      8.3729      233.707     
1 1 1 26 6  59 o 5  107.767 3.08482 208.857     14.7672  211.968     18.3023  78.1374    345.526     12.9782     345.526     
1 1 1 26 6  60 o 7  38.0513 5.63042 40.3002     9.6375   17.4686     11.353   15.2372    337.782     17.2176     157.782     
1 1 1 26 6  61 o 15 22.7524 6.11943 7.33313     8.54879  8.90207     10.7341  2.20936    138.25      30.9602     138.25      
1 1 1 26 6  62 o 14 31.8735 5.90375 9.03704     8.58746  33.6365     11.8361  13.0232    195.382     12.323      15.3818     
1 1 1 26 6  63 o 19 35.499  5.8528  31.2303     10.1691  19.9982     10.4973  18.0356    193.171     13.6188     193.171     
1 1 1 26 6  64 o 11 39.5383 5.02822 34.4894     9.57458  27.0787     9.55939  20.9964    354.398     6.79403     174.398     
1 1 1 26 6  65 o 14 28.1012 6.19543 15.0752     10.5991  16.9802     8.89022  9.18923    307.866     13.943      127.866     
1 1 1 26 6  66 o 12 62.5486 3.74889 75.9958     12.0267  70.521      11.2582  47.2219    27.6812     15.3791     27.6812     
1 1 1 26 6  67 o 3  63.2322 4.24693 84.6243     13.7402  68.0164     12.8059  48.6807    284.982     18.0758     284.982     
1 1 1 26 6  68 o 4  41.9838 5.78515 33.3377     12.0899  38.7036     11.332   27.2867    42.9982     5.17796     42.9983     
1 1 1 26 6  69 o 12 24.5834 6.56418 9.4823      11.198   12.2094     10.971   9.10717    148.877     4.74805     328.877     
1 1 1 26 6  70 o 18 25.04   6.38347 3.37613     11.4271  17.9595     10.6235  7.98811    123.887     11.0821     303.887     
1 1 1 26 6  71 o 10 18.387  5.79501 -1.50189    11.0128  -0.941092   10.6168  3.00702    313.201     2.39708     133.201     
1 1 1 26 6  72 o 2  15.4325 5.0973  -24.7829    10.5109  0.766164    10.4113  0.468638   20.8095     8.6908      200.809     
1 1 1 26 6  73 o 2  21.0598 6.51789 1.89266     11.2355  3.73394     14.8396  4.03021    283.017     0.509831    103.017     
1 1 1 26 6  74 o 11 21.4303 6.54588 -8.19034    11.4922  14.5254     15.0614  3.04764    256.523     0.905484    76.5226     
1 1 1 26 6  75 o 15 24.7588 7.02439 17.3325     12.5309  2.1349      16.1771  7.76706    35.7868     3.64462     215.787     
1 1 1 26 6  76 o 12 21.6161 6.93718 2.09238     16.6327  0.61192     15.971   2.68596    119.127     4.01231     299.127     
1 1 1 26 6  77 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 7  0  o 1  193.929 2.61752 667.473     25.4177  667.473     25.4177  76.793     180         133.842     360         
1 1 1 26 7  1  o 11 34.6633 4.48957 24.8544     7.93611  19.3709     7.09647  65.4411    130.816     167.473     130.816     
1 1 1 26 7  2  o 12 318.195 3.08628 1807.7      49.2113  1786.11     49.2153  224.051    189.792     18.283      9.79244     
1 1 1 26 7  3  o 13 221.352 2.66196 867.436     29.5266  870.956     29.5308  99.7568    358.627     122.851     178.627     
1 1 1 26 7  4  o 16 223.594 2.57777 889.875     28.8789  883.79      28.8898  200.516    270.986     80.2362     270.986     
1 1 1 26 7  5  o 3  76.4432 2.60741 102.338     10.1319  105.474     9.77593  28.6334    168.123     32.9167     348.123     
1 1 1 26 7  6  o 7  266.215 2.8321  1265.88     37.7785  1249.07     37.7873  194.161    168.896     0.531216    168.896     
1 1 1 26 7  7  o 14 90.4554 2.45405 147.472     11.0746  143.222     11.1303  52.1288    257.17      6.02134     77.1696     
1 1 1 26 7  8  o 2  20.404  4.89667 2.85744     6.24361  9.92831     6.25088  50.3905    162.562     111.459     162.562     
1 1 1 26 7  9  o 1  141.042 2.46069 350.647     18.0278  355.281     16.7067  94.9491    257.101     6.4849      77.1006     
1 1 1 26 7  10 o 12 120.222 2.41811 269.389     14.5546  244.047     14.5274  60.2685    324.269     45.5277     144.269     
1 1 1 26 7  11 o 9  84.9673 2.63445 127.196     11.6495  129.454     10.7013  44.9438    217.919     12.2975     37.9187     
1 1 1 26 7  12 f 0  164.068 2.43884 478.511     20.4015  476.425     19.6987  110.599    229.922     0           0           
1 1 1 26 7  13 o 11 242.715 2.87788 1051.28     37.0091  1039.57     32.9016  189.248    182.941     27.6122     182.941     
1 1 1 26 7  14 o 17 101.829 2.62002 182.962     13.2216  185.454     13.4742  76.9919    62.613      34.7684     62.613      
1 1 1 26 7  15 o 16 40.4649 4.10239 33.227      7.89173  26.3627     8.1408   30.0767    141.75      100.425     141.75      
1 1 1 26 7  16 f 0  84.4472 2.67808 128.259     10.8831  125.325     11.7003  67.05      168.646     0           0           
1 1 1 26 7  17 o 2  68.8204 2.89315 89.1721     9.51167  79.6774     10.2691  28.4028    257.875     3.82939     77.8748     
1 1 1 26 7  18 o 7  40.9182 4.00041 27.3797     7.64666  33.4243     8.31037  3.90457    242.739     25.7603     242.739     
1 1 1 26 7  19 o 17 113.163 2.65105 224.885     14.4749  230.115     15.5436  87.9156    129.739     27.4111     129.739     
1 1 1 26 7  20 o 1  299.23  3.3058  1614.15     48.4571  1566.81     50.6236  155.346    163.815     124.491     343.815     
1 1 1 26 7  21 o 2  46.6253 3.61056 39.7739     8.06129  38.4228     8.51611  2.82692    10.8833     29.7736     190.883     
1 1 1 26 7  22 o 3  142.095 2.53993 367.029     18.3169  349.941     17.8421  92.8217    336.572     13.9424     156.572     
1 1 1 26 7  23 o 19 106.433 2.51432 202.62      13.3276  199.912     13.4548  57.029     115         32.0239     295         
1 1 1 26 7  24 o 11 244.069 2.80209 1076.15     34.1153  1039.41     34.4174  199.801    58.5503     48.608      58.5503     
1 1 1 26 7  25 o 16 203.445 2.5906  738.128     26.2138  731.366     26.6073  178.874    207.469     67.7465     207.469     
1 1 1 26 7  26 o 5  184.961 2.66427 597.412     24.49    617.522     24.9011  136.232    139.836     8.6775      139.836     
1 1 1 26 7  27 f 0  218.291 2.66464 852.458     28.4525  839.904     29.8194  157.813    262.76      0           0           
1 1 1 26 7  28 o 7  55.1679 3.37365 54.8434     8.82327  54.2204     9.62255  22.7771    179.93      13.8171     359.93      
1 1 1 26 7  29 o 4  125.308 2.78879 272.324     17.2128  286.285     17.7703  104.68     300.554     37.3024     300.554     
1 1 1 26 7  30 o 11 97.6667 2.64087 174.04      12.2874  165.42      13.4524  68.994     13.5354     6.77663     13.5354     
1 1 1 26 7  31 o 7  121.462 2.57537 260.575     15.3081  264.08      16.0051  73.2265    270.384     22.7052     90.3838     
1 1 1 26 7  32 o 2  115.897 2.58647 236.683     14.6544  241.143     15.3503  56.6206    233.577     48.3295     53.5773     
1 1 1 26 7  33 o 2  124.686 2.65116 277.991     16.4324  275.189     16.6594  110.636    161.517     51.2231     161.517     
1 1 1 26 7  34 o 17 121.373 2.64515 260.52      15.8849  263.787     16.2546  76.456     215.73      15.6621     35.7295     
1 1 1 26 7  35 o 16 73.5588 3.08007 90.3354     11.2009  103.243     11.377   44.0944    322.37      7.07037     142.37      
1 1 1 26 7  36 o 10 148.914 2.64137 393.564     19.5472  395.6       19.8597  104.729    263.962     1.04378     263.962     
1 1 1 26 7  37 o 3  19.9868 5.44063 9.36823     8.28874  -2.85806    8.2758   2.04559    267.779     5.71338     267.779     
1 1 1 26 7  38 o 14 79.5266 3.16548 109.202     12.6367  117.162     12.4738  45.071     53.152      15.5507     233.152     
1 1 1 26 7  39 o 4  69.908  3.34463 89.3672     11.0658  85.9834     12.1752  49.6362    11.8572     12.7167     11.8572     
1 1 1 26 7  40 o 1  17.5459 5.18128 5.66254     8.28779  -7.30882    8.02315  18.768     257.375     46.7604     257.375     
1 1 1 26 7  41 o 14 88.8453 2.90382 136.08      12.3941  146.209     13.3979  62.2657    245.622     6.61641     245.622     
1 1 1 26 7  42 o 19 67.7741 3.17206 75.8427     10.2267  89.2898     11.2029  30.3254    322.128     28.5863     142.128     
1 1 1 26 7  43 o 7  30.1075 5.33339 20.915      7.53987  13.0044     8.84346  3.84763    319.894     9.36793     139.894     
1 1 1 26 7  44 o 9  20.5077 5.4149  2.68663     7.35868  8.66976     7.88301  4.13864    199.425     19.467      199.425     
1 1 1 26 7  45 o 1  77.4944 2.99925 96.7961     11.4301  119.194     11.7045  77.0771    7.15342     54.5839     7.15342     
1 1 1 26 7  46 o 2  48.2004 4.04218 38.7832     9.07423  46.3267     10.0784  19.4157    87.3082     24.0124     267.308     
1 1 1 26 7  47 o 4  36.807  4.95725 27.7116     8.79446  23.311      8.81016  6.53308    305.729     33.2701     125.729     
1 1 1 26 7  48 o 12 17.2129 5.10756 -3.60908    7.27047  4.49264     8.03999  0.723152   35.0786     4.0708      35.0786     
1 1 1 26 7  49 o 15 88.0238 3.03436 137.798     12.3361  140.973     14.2977  70.233     72.3309     21.8833     72.3309     
1 1 1 26 7  50 o 4  102.878 2.90861 180.062     14.3131  200.661     15.6274  80.7683    84.938      21.985      84.938      
1 1 1 26 7  51 o 12 19.3869 5.52508 6.377       8.00311  -0.709842   9.03996  12.9183    64.5976     47.0402     64.5976     
1 1 1 26 7  52 f 0  40.5561 5.05939 34.9719     9.46414  27.5343     10.2059  26.8597    65.675      0           0           
1 1 1 26 7  53 o 2  79.4152 3.29713 107.979     12.4292  120.7       13.7088  63.409     130.079     21.3375     130.079     
1 1 1 26 7  54 o 15 76.0386 3.33326 102.089     12.6972  107.716     12.5696  53.9112    83.2885     6.79349     83.2885     
1 1 1 26 7  55 o 8  37.9203 5.00549 22.4263     8.48831  32.9081     9.85766  6.90995    77.5717     34.4189     257.572     
1 1 1 26 7  56 o 8  60.9008 3.74616 79.7154     10.9431  57.2        11.3329  38.7329    17.4074     2.23468     197.407     
1 1 1 26 7  57 o 7  63.0194 3.55503 70.5923     10.4199  74.7736     11.8335  52.1835    263.47      22.8805     263.47      
1 1 1 26 7  58 o 13 105.495 2.95389 205.226     15.0864  197.7       16.0453  86.6171    189.817     32.5889     189.817     
1 1 1 26 7  59 o 11 33.7438 5.58353 17.7506     8.57759  27.7151     10.0946  15.2199    174.217     10.8666     354.217     
1 1 1 26 7  60 o 16 141.045 2.80226 345.461     19.3023  375.496     20.276   96.1078    63.2108     3.92171     63.2108     
1 1 1 26 7  61 o 14 34.0086 5.82206 17.1671     9.55937  29.9673     10.3783  15.9017    57.6147     9.7502      237.615     
1 1 1 26 7  62 f 0  28.2372 6.18093 13.2115     9.36991  19.0512     10.0477  24.6638    280.464     0           0           
1 1 1 26 7  63 o 7  45.5193 5.27199 30.2496     11.2864  52.8122     11.3759  28.6714    64.629      0.328354    64.6287     
1 1 1 26 7  64 o 19 51.4547 4.4874  52.9488     11.7498  48.7257     10.9074  33.4062    240.923     1.70328     240.923     
1 1 1 26 7  65 o 12 43.2131 5.45606 37.6482     12.002   37.1678     10.7343  17.0385    174.769     20.085      354.769     
1 1 1 26 7  66 o 12 20.7967 5.92925 5.40956     9.27324  5.96082     9.74989  4.34308    294.408     5.06347     114.408     
1 1 1 26 7  67 o 9  43.5785 6.567   49.1239     12.6566  31.5714     15.2133  33.3302    151.835     17.2749     151.835     
1 1 1 26 7  68 o 3  19.9118 6.26831 -3.04789    11.8486  1.53933     13.3516  4.04165    17.8586     4.73456     197.859     
1 1 1 26 7  69 o 13 34.8828 7.24325 21.8191     12.0973  32.3153     14.9781  18.5829    311.171     3.66898     131.171     
1 1 1 26 7  70 o 18 25.2596 6.8713  7.38894     11.4507  15.891      13.2396  11.6916    326.376     0.434246    146.376     
1 1 1 26 7  71 o 19 25.6837 7.11424 8.68262     11.8445  16.2598     14.7915  8.91858    181.93      9.82147     1.92981     
1 1 1 26 7  72 o 8  20.8743 6.49493 -2.14025    11.4452  6.85229     14.7383  4.78663    350.71      1.2963      170.71      
1 1 1 26 7  73 o 3  26.5799 6.95191 13.3759     12.1721  17.2426     12.4323  8.52485    19.9158     10.8421     199.916     
1 1 1 26 7  74 o 18 31.7925 7.26394 21.1768     13.6674  27.5681     13.0168  15.3103    250.709     2.39642     70.7089     
1 1 1 26 7  75 o 11 44.586  6.82381 54.2299     14.8297  38.3936     14.898   30.8407    267.077     12.4898     267.077     
1 1 1 26 7  76 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 8  0  o 15 221.066 2.75121 867.315     30.4581  867.315     30.4581  143.126    6.00229e-07 41.8589     180         
1 1 1 26 8  1  o 15 231.757 2.72102 965.229     32.1834  940.866     31.0224  170.066    264.773     3.11509     264.773     
1 1 1 26 8  2  o 12 100.223 2.46247 181.525     12.5928  175.289     12.1065  74.9368    44.3872     31.6838     44.3872     
1 1 1 26 8  3  o 1  192.894 2.54018 661.429     24.1609  658.721     24.9417  118.193    195.531     42.639      15.5315     
1 1 1 26 8  4  o 5  132.433 2.40058 316.389     15.8666  306.249     15.9663  90.5638    26.591      2.694       206.591     
1 1 1 26 8  5  o 9  329.504 3.18038 1946.72     52.5104  1908.33     52.5198  282.506    341.434     81.9917     341.434     
1 1 1 26 8  6  o 13 71.2365 2.67159 94.9747     9.48852  85.725      9.498    3.96882    299.537     83.682      119.537     
1 1 1 26 8  7  o 12 306.795 3.23313 1655.84     47.7498  1686.45     51.6239  217.825    182.244     14.2234     2.2438      
1 1 1 26 8  8  o 5  231.78  2.69501 953.683     31.3045  952.766     31.3031  166.884    213.197     3.02768     33.197      
1 1 1 26 8  9  o 17 72.5705 2.71999 95.6262     9.85874  91.8169     9.8517   22.0543    76.909      44.8321     256.909     
1 1 1 26 8  10 o 12 107.648 2.45493 204.358     12.9313  207.216     13.5182  62.5488    73.5807     47.1358     73.5807     
1 1 1 26 8  11 o 8  370.775 3.61264 2450.9      67.0838  2433.89     67.1687  296.942    54.5748     49.8057     54.5748     
1 1 1 26 8  12 o 18 130.263 2.35943 299.106     15.3794  303.297     15.3996  70.0874    38.5574     42.7435     218.557     
1 1 1 26 8  13 o 2  183.613 2.64919 608.283     25.7227  588.304     22.9946  109.528    175.967     45.453      355.967     
1 1 1 26 8  14 o 18 85.4548 2.61074 134.572     11.2062  125.16      11.0945  56.7844    153.317     23.056      153.317     
1 1 1 26 8  15 o 17 72.3331 2.76713 92.9937     10.184   93.2757     9.79798  30.0947    339.226     27.5594     159.226     
1 1 1 26 8  16 o 9  105.825 2.59613 200.489     14.5346  197.47      12.9234  70.7853    307.966     0.688569    127.966     
1 1 1 26 8  17 o 3  108.9   2.6696  204.521     15.1931  217.048     13.8161  61.7024    339.272     26.4328     159.272     
1 1 1 26 8  18 o 11 110.166 2.57273 213.938     14.3702  217.332     13.9921  51.5289    16.9873     50.3823     196.987     
1 1 1 26 8  19 o 19 209.42  2.74921 782.103     28.2628  775.103     29.425   157.662    8.51343     13.2557     8.51345     
1 1 1 26 8  20 o 11 296.432 3.63733 1600.26     55.4668  1525.25     52.6089  236.933    105.991     42.7167     105.991     
1 1 1 26 8  21 o 5  28.5155 4.96162 24.1287     7.45066  5.24203     8.07861  31.092     332.664     88.5203     332.664     
1 1 1 26 8  22 o 1  37.6361 4.77475 29.3381     8.81314  22.8835     8.50742  1.19792    54.541      30.0236     54.5409     
1 1 1 26 8  23 o 11 129.801 2.6474  311.164     16.1278  287.874     18.1205  80.1645    168.613     23.01       348.613     
1 1 1 26 8  24 o 1  114.462 2.6218  242.795     14.2603  223.196     15.664   72.9358    265.596     13.6928     85.5957     
1 1 1 26 8  25 o 11 300.532 3.30433 1615.65     50.6329  1597        48.8931  282.345    11.861      130.46      11.861      
1 1 1 26 8  26 o 19 127.086 2.65121 303.786     16.1034  270.961     17.479   103.167    146.772     29.7987     146.772     
1 1 1 26 8  27 o 11 73.6523 2.99014 104.111     10.9671  89.6753     10.9648  28.8427    64.8985     40.3444     244.899     
1 1 1 26 8  28 o 9  204.32  2.93777 764.254     28.4446  720.536     31.5259  154.296    173.015     16.0873     173.015     
1 1 1 26 8  29 o 8  96.2868 2.71332 163.49      13.0955  166.597     13.0358  87.6077    125.383     53.6255     125.383     
1 1 1 26 8  30 o 14 124.603 2.53045 270.384     15.5231  281.893     16.0477  77.8844    208.067     18.9158     28.0666     
1 1 1 26 8  31 o 4  78.221  2.83723 109.008     10.7701  109.213     11.3908  55.0771    351.328     9.30079     351.328     
1 1 1 26 8  32 o 5  68.3965 3.07092 75.8808     9.80894  91.7315     11.1476  32.1712    129.354     22.6688     129.354     
1 1 1 26 8  33 o 14 30.481  5.43998 18.041      8.03553  16.6746     8.59918  5.20522    211.89      34.205      211.89      
1 1 1 26 8  34 o 19 125.826 2.81895 277.691     17.0015  286.554     18.4926  75.5576    85.6653     25.1746     265.665     
1 1 1 26 8  35 o 14 116.165 2.8923  235.142     16.481   246.221     17.1436  95.0245    97.7695     30.4415     97.7695     
1 1 1 26 8  36 o 8  167.834 2.86819 490.096     23.5752  513.802     24.6761  118.602    329.739     0.620871    329.739     
1 1 1 26 8  37 o 16 63.5356 3.62672 72.8798     11.577   72.4478     11.3211  39.5792    241.817     0.477141    241.816     
1 1 1 26 8  38 o 16 38.5828 5.20641 23.2918     9.54211  32.5769     9.82308  6.85997    123.658     24.5459     303.658     
1 1 1 26 8  39 o 16 131.897 2.76184 309.988     17.7044  310.859     18.7522  103.436    78.1797     24.5075     78.1797     
1 1 1 26 8  40 o 16 22.831  5.46891 2.43194     8.03048  13.5419     7.92424  13.4241    352.417     45.0991     352.417     
1 1 1 26 8  41 o 10 53.0595 3.78367 57.9149     9.89104  44.5699     9.80973  15.0118    139.363     39.1025     319.363     
1 1 1 26 8  42 o 19 89.8128 2.83825 134.706     12.2755  154.272     13.2113  86.0951    243.002     53.2911     243.002     
1 1 1 26 8  43 o 7  80.5925 2.98221 120.685     11.496   112.295     12.4407  60.2938    308.175     11.0836     308.175     
1 1 1 26 8  44 o 17 62.8975 3.35824 72.9374     10.0409  69.814      10.926   27.6292    118.242     29.8897     298.242     
1 1 1 26 8  45 o 9  25.8994 5.28063 1.25039     7.61981  22.3932     9.0152   3.42177    34.9209     19.6041     214.921     
1 1 1 26 8  46 o 1  91.3475 3.28048 146.293     13.2475  154.344     16.573   58.6962    178.013     7.81428     358.013     
1 1 1 26 8  47 o 9  35.0714 5.51401 19.7334     8.96424  27.6001     9.97799  19.099     27.7131     6.41176     27.7131     
1 1 1 26 8  48 o 14 41.2963 4.99248 32.0825     9.43376  32.1501     10.4646  16.8669    292.382     18.7624     112.382     
1 1 1 26 8  49 o 13 91.4857 3.12745 152.205     13.7727  149.685     14.7896  66.0063    269.788     7.65107     269.788     
1 1 1 26 8  50 o 4  93.7238 3.00133 146.666     14.4184  170.327     13.5564  85.4579    276.264     44.824      276.264     
1 1 1 26 8  51 o 19 36.1124 5.38957 22.4022     9.67314  27.8336     9.22333  22.1132    350.779     3.98079     350.779     
1 1 1 26 8  52 o 10 63.5939 3.41238 73.0037     10.3862  74.1198     11.1903  31.3566    176.856     22.2364     356.856     
1 1 1 26 8  53 f 0  93.5661 2.89684 150.309     13.1619  165.558     13.9415  63.3393    344.452     0           0           
1 1 1 26 8  54 o 16 46.3284 4.39646 37.0844     9.29456  43.2143     10.619   14.5634    227.596     31.3816     47.5962     
1 1 1 26 8  55 o 2  17.3084 5.24752 -3.99726    7.53672  3.91996     8.99826  0.425779   122.183     3.7309      302.183     
1 1 1 26 8  56 o 12 89.8177 3.04579 138.686     12.9144  153.898     14.4333  60.8214    264.727     1.16922     264.727     
1 1 1 26 8  57 o 9  105.17  2.98734 197.028     15.3084  204.018     16.1169  86.3225    74.1842     31.6848     74.1842     
1 1 1 26 8  58 o 1  24.2965 6.01299 8.27035     8.42982  13.2201     9.70852  10.3416    53.4803     2.56559     233.48      
1 1 1 26 8  59 o 13 72.8099 3.35423 85.8093     11.6677  109.533     12.6336  46.7679    232.849     2.82697     52.8491     
1 1 1 26 8  60 o 6  51.3804 4.31236 53.2285     10.3587  46.8561     11.2592  41.1511    212.985     17.0365     212.985     
1 1 1 26 8  61 o 19 19.6834 5.65049 6.50328     8.28019  1.33098     9.46879  4.41744    346.659     8.53647     166.659     
1 1 1 26 8  62 o 19 57.8832 4.00676 56.9971     10.8781  69.661      12.0687  38.7115    194.224     2.71291     194.224     
1 1 1 26 8  63 o 14 57.2486 4.75842 64.6833     13.4807  62.1869     13.3004  45.7384    257.305     18.9967     257.305     
1 1 1 26 8  64 o 13 37.7932 5.99649 30.8073     11.2455  28.2979     10.9142  27.7585    83.103      14.6851     83.103      
1 1 1 26 8  65 o 3  56.8562 4.58733 58.3337     13.3073  66.7032     12.1449  32.5557    258.006     7.28014     78.0056     
1 1 1 26 8  66 o 14 15.2467 5.0731  -4.50644    9.95831  -13.9429    10.2619  0.16058    342.5       4.15603     342.5       
1 1 1 26 8  67 o 9  36.7095 6.25192 18.6795     12.1296  38.5514     11.4788  23.8576    301.575     5.21421     301.575     
1 1 1 26 8  68 o 15 25.3966 6.59926 16.3603     11.7343  8.14788     10.5863  9.87874    213.687     7.78979     33.6869     
1 1 1 26 8  69 o 16 35.6292 6.65216 24.25       12.6542  30.8685     11.6712  21.8271    50.6493     2.08729     50.6493     
1 1 1 26 8  70 o 14 25.2511 6.54661 19.1766     11.8332  5.0631      10.8193  3.57352    110.667     21.8513     290.667     
1 1 1 26 8  71 o 3  22.7482 6.74199 2.43881     13.228   10.7397     13.0222  6.62051    249.844     0.19438     249.844     
1 1 1 26 8  72 o 11 28.142  6.98653 22.9992     12.495   12.5719     12.5433  13.4543    227.134     2.28629     227.134     
1 1 1 26 8  73 o 12 38.2399 7.09213 30.7543     13.8721  38.9243     13.815   25.5229    136.815     12.4773     136.815     
1 1 1 26 8  74 o 11 18.9851 6.09105 0.33687     12.252   -1.96057    12.9102  0.69489    94.6142     3.18256     274.614     
1 1 1 26 8  75 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 9  0  o 5  202.921 2.61822 730.856     26.6053  730.856     26.6053  183.462    180         65.2978     180         
1 1 1 26 9  1  o 7  272.674 3.07781 1342.8      42.886   1297.62     41.2325  186.161    69.6066     28.1565     249.607     
1 1 1 26 9  2  o 14 67.811  2.77326 83.8656     9.42836  79.9253     9.33762  17.123     293.175     49.2211     113.175     
1 1 1 26 9  3  o 1  170.914 2.49658 510.692     21.7491  525.944     20.9972  149.441    49.7759     56.0223     49.7759     
1 1 1 26 9  4  o 2  100.861 2.423   184.538     12.2238  176.878     12.2307  47.6396    207.898     42.9639     27.8982     
1 1 1 26 9  5  o 7  111.642 2.41661 231.082     13.4957  211.795     13.4941  67.5496    198.072     18.6991     18.0721     
1 1 1 26 9  6  o 2  198.537 2.56471 702.407     25.544   696.485     25.4913  178.354    278.754     71.2338     278.754     
1 1 1 26 9  7  o 18 440.745 3.94666 3463.57     87.162   3444.91     87.1818  338.083    24.5079     25.0405     24.5079     
1 1 1 26 9  8  o 10 207.953 2.567   779.19      26.723   755.679     26.7748  169.381    59.0681     37.5113     59.0681     
1 1 1 26 9  9  o 9  94.4076 2.54007 164.393     11.9299  152.495     12.0435  66.9164    15.11       44.5268     15.11       
1 1 1 26 9  10 o 12 30.6891 4.95058 14.8687     7.43133  20.1224     7.50756  2.24053    281.928     7.34383     281.928     
1 1 1 26 9  11 o 6  309.173 3.13905 1693.58     47.7144  1702.01     49.5453  258.325    234.678     63.1983     234.678     
1 1 1 26 9  12 o 18 46.5579 3.7318  51.1679     8.47751  28.5711     8.08965  5.62895    287.302     20.9288     107.302     
1 1 1 26 9  13 o 4  38.4318 4.30608 28.3953     8.01987  25.51       7.9991   17.6078    86.6771     74.0681     86.6771     
1 1 1 26 9  14 o 7  26.848  5.13664 12.5222     7.09899  14.0492     7.06984  28.9988    6.19784     78.4651     6.19783     
1 1 1 26 9  15 o 18 93.4626 2.59177 163.695     11.7868  147.116     12.3784  60.529     314.692     4.57625     134.692     
1 1 1 26 9  16 o 11 198.756 2.54238 714.98      24.7593  687.581     25.8471  174.266    270.708     61.7727     270.708     
1 1 1 26 9  17 o 8  58.026  3.17193 64.0207     9.2878   56.4706     9.00345  23.2349    205.873     20.6142     25.8728     
1 1 1 26 9  18 o 2  66.4479 2.97667 79.2079     10.0542  78.2967     9.66636  10.5721    203.212     67.695      23.2122     
1 1 1 26 9  19 o 11 149.034 2.48685 395.524     18.8237  393.075     18.3214  98.7807    129.585     15.9488     309.585     
1 1 1 26 9  20 o 6  172.396 2.7243  525.236     24.1378  530.502     22.9125  123.172    293.163     1.86288     113.163     
1 1 1 26 9  21 o 16 35.3633 4.79188 19.1969     8.52221  27.1479     7.72898  32.3793    156.023     106.853     156.023     
1 1 1 26 9  22 f 0  188.584 2.57033 629.381     24.6888  633.881     23.8843  110.903    255.576     0           0           
1 1 1 26 9  23 o 14 189.922 2.69972 658.485     26.2345  623.478     25.1598  163.707    301.517     54.8459     301.517     
1 1 1 26 9  24 o 13 72.1063 3.04112 96.5399     10.9306  89.1013     10.9337  39.1949    335.737     26.3814     335.737     
1 1 1 26 9  25 o 6  159.904 2.70873 472.382     21.0828  437.065     22.225   151.359    192.547     77.0225     192.547     
1 1 1 26 9  26 o 5  359.205 3.55168 2309.8      63.8404  2287.56     64.0269  305.692    337.227     89.9608     337.227     
1 1 1 26 9  27 o 15 39.6705 4.63995 27.595      8.67723  30.2008     9.12905  1.43339    239.321     38.1744     59.3207     
1 1 1 26 9  28 o 18 157.774 2.58613 447.995     19.765   437.002     21.0899  153.245    294.58      84.7872     294.58      
1 1 1 26 9  29 o 2  96.3339 2.89673 173.37      14.3398  157.679     13.5678  77.3825    166.929     24.8701     166.929     
1 1 1 26 9  30 o 3  112.248 2.79603 235.25      15.7141  213.948     15.6683  58.056     79.0821     41.7033     259.082     
1 1 1 26 9  31 o 18 47.1516 4.47397 38.0789     9.91371  43.0721     10.7004  13.1733    16.8123     3.26875     16.8123     
1 1 1 26 9  32 o 13 115.379 2.88978 241.023     15.919   233.772     17.3866  92.392     73.4647     24.8611     73.4647     
1 1 1 26 9  33 f 0  77.2598 3.26132 105.439     11.8896  108.329     13.2287  66.8581    308.023     0           0           
1 1 1 26 9  34 o 12 90.6232 3.15666 150.728     12.4617  143.098     15.8131  70.1497    163.699     18.6421     163.699     
1 1 1 26 9  35 o 6  78.9683 3.0147  114.443     11.513   108.725     12.2227  66.4674    142.673     33.6364     142.673     
1 1 1 26 9  36 o 6  168.372 2.59693 510.885     22.1571  499.151     21.6685  112.455    141.267     13.1685     321.267     
1 1 1 26 9  37 o 17 131.875 2.71884 316.07      16.8355  304.588     18.953   99.629     228.167     15.3329     228.167     
1 1 1 26 9  38 o 15 94.7957 2.83258 165.45      12.9212  155.87      13.8743  55.1065    254.415     20.4422     74.4152     
1 1 1 26 9  39 o 16 71.9378 3.26371 90.2558     11.5893  95.7307     11.8163  60.4611    193.212     28.3555     193.212     
1 1 1 26 9  40 o 14 96.6534 2.87913 158.805     13.7689  175.756     14.045   61.806     28.8986     10.3412     208.899     
1 1 1 26 9  41 o 3  70.0798 3.5576  94.7518     12.0983  82.6782     12.6287  51.1497    83.8493     7.53338     83.8493     
1 1 1 26 9  42 o 18 27.7482 5.741   9.79967     8.09846  19.1533     9.23859  5.15889    1.3368      0.872491    181.337     
1 1 1 26 9  43 o 16 29.6367 5.78176 6.92187     9.86899  25.2753     9.48808  8.70857    308.805     14.7834     128.805     
1 1 1 26 9  44 o 9  84.8439 3.19603 126.652     13.5202  132.592     13.555   52.2161    345.425     12.3519     165.425     
1 1 1 26 9  45 o 12 22.8504 5.93608 8.98034     8.42882  6.96019     9.49572  1.99069    156.69      15.4392     336.69      
1 1 1 26 9  46 o 17 57.2316 3.83664 55.5345     10.5054  64.2474     11.2351  41.0688    253.017     6.93496     253.017     
1 1 1 26 9  47 o 14 109.691 2.84973 221.093     15.4891  211.427     15.7737  103.15     143.392     56.2914     143.392     
1 1 1 26 9  48 o 12 15.7029 4.87177 -4.44779    7.01612  1.17822     7.84524  3.03512    81.325      13.5952     81.325      
1 1 1 26 9  49 o 11 30.8278 5.67607 17.4881     8.06423  19.3927     9.65347  12.0885    14.322      11.1213     194.322     
1 1 1 26 9  50 o 18 89.1392 2.92075 142.81      12.2163  143.72      13.7623  68.7869    29.6736     16.625      29.6736     
1 1 1 26 9  51 o 10 39.2459 4.91557 19.289      8.55627  41.0258     9.89025  27.1944    179.085     8.51974     179.085     
1 1 1 26 9  52 o 3  99.4423 2.8581  168.849     13.375   188.013     15.0614  87.3576    176.651     40.317      176.651     
1 1 1 26 9  53 o 5  111.858 2.80479 221.227     14.7625  229.926     16.6075  91.977     170.356     32.1114     170.356     
1 1 1 26 9  54 o 4  73.2624 3.44757 89.4463     11.585   106.867     13.61    50.9724    64.4694     3.8532      64.4694     
1 1 1 26 9  55 o 19 27.4655 5.97765 12.4476     8.42071  17.0408     9.6891   14.3896    183.243     2.42321     183.243     
1 1 1 26 9  56 o 17 17.2323 5.22342 3.88972     7.8726   -5.49121    8.99883  0.868648   281.616     1.56875     101.616     
1 1 1 26 9  57 o 13 18.9522 5.54187 4.59564     8.31398  1.03446     8.97503  3.20269    90.0077     2.34565     270.008     
1 1 1 26 9  58 o 7  72.7825 3.44869 90.2417     11.8835  105.239     13.1385  57.0553    48.4678     17.7612     48.4678     
1 1 1 26 9  59 o 6  29.7523 5.97924 13.8312     8.83068  22.4594     10.0513  13.358     323.94      8.73974     143.94      
1 1 1 26 9  60 o 2  69.6594 3.52733 92.3315     11.656   87.7495     12.7381  54.0115    12.2747     16.6628     12.2747     
1 1 1 26 9  61 o 14 56.8403 3.84713 59.827      10.81    61.6323     10.8381  38.9713    69.3813     4.36082     69.3813     
1 1 1 26 9  62 o 18 22.7872 5.94916 7.63337     8.90882  10.7435     9.11117  6.69071    358.776     0.109714    358.776     
1 1 1 26 9  63 o 9  31.9155 6.24941 19.235      10.9314  23.5772     9.91289  11.9221    91.7986     14.1726     271.799     
1 1 1 26 9  64 o 4  39.1086 5.81259 27.2688     11.1991  35.9021     10.8747  21.3198    46.8919     4.70534     226.892     
1 1 1 26 9  65 o 2  14.8117 4.92454 -3.68595    10.1893  -11.4472    8.2908   0.17942    255.68      4.03011     255.68      
1 1 1 26 9  66 o 18 41.1956 6.46329 41.2796     12.7482  30.7598     13.3321  25.0525    298.727     0.248299    118.727     
1 1 1 26 9  67 o 7  52.7847 5.37319 55.48       13.788   56.1265     13.8208  37.0907    134.563     7.75052     134.563     
1 1 1 26 9  68 o 13 21.2201 6.30848 3.82941     11.5761  5.64782     11.2154  4.57917    249.265     33.6943     249.265     
1 1 1 26 9  69 o 6  60.0649 4.91268 81.7344     14.4789  62.2121     14.2778  40.4539    287.513     4.94535     287.513     
1 1 1 26 9  70 o 12 22.1897 6.25781 -4.389      11.8199  15.417      11.3128  5.20543    63.7007     11.9303     243.701     
1 1 1 26 9  71 o 10 37.8576 7.00901 23.4225     13.1776  44.8876     14.5664  21.7904    58.3062     0.0381707   238.307     
1 1 1 26 9  72 o 15 38.0274 7.11336 47.3974     14.4291  23.0011     14.7412  21.0214    198.667     1.12063     18.6668     
1 1 1 26 9  73 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 9  74 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 10 0  o 18 96.8315 2.53256 166.954     12.2514  166.954     12.2514  93.346     360         65.8547     360         
1 1 1 26 10 1  o 15 77.2099 2.75979 105.269     10.3806  106.952     10.9041  46.0267    232.143     25.825      232.143     
1 1 1 26 10 2  o 4  156.559 2.62209 441.13      20.9837  429.083     20.1612  100.813    152.256     24.8575     332.256     
1 1 1 26 10 3  o 14 196.355 2.60176 672.049     26.0698  696.815     25.1004  127.403    133.177     32.3412     313.177     
1 1 1 26 10 4  f 0  98.601  2.62066 174.32      12.955   171.331     12.8975  26.3402    274.561     0           0           
1 1 1 26 10 5  o 1  21.2798 5.20708 10.2217     6.94411  3.51704     7.05304  21.2213    328.729     51.5318     328.729     
1 1 1 26 10 6  o 17 113.174 2.45725 232.975     13.8846  222.151     13.9478  84.9432    318.356     12.7118     318.356     
1 1 1 26 10 7  o 17 209.033 2.58386 772.841     27.0272  778.435     27.1071  167.598    166.262     30.0119     166.262     
1 1 1 26 10 8  o 5  172.833 2.50334 542.238     22.1225  518.306     21.2449  120.997    29.1564     9.0608      209.156     
1 1 1 26 10 9  o 1  46.7752 3.59056 36.8838     8.27656  41.9233     8.25273  9.39861    76.3314     8.74738     256.331     
1 1 1 26 10 10 o 10 102.83  2.6079  189.738     13.3982  186.197     13.4352  77.4941    316.958     13.8745     316.958     
1 1 1 26 10 11 o 8  161.753 2.55268 478.492     21.024   450.669     20.3612  127.915    175.51      22.3685     175.51      
1 1 1 26 10 12 o 14 134.68  2.61818 329.756     18.0317  314.929     17.2792  113.422    179.139     35.9925     179.139     
1 1 1 26 10 13 o 11 170.328 2.62853 519.045     22.8282  511.26      22.0434  162.491    55.0185     80.8382     55.0185     
1 1 1 26 10 14 o 7  200.541 2.60677 713.098     25.6433  715.151     26.7424  168.877    39.2048     46.1934     39.2048     
1 1 1 26 10 15 o 12 227.785 2.70881 921.598     30.8688  921.565     30.9748  237.565    333.982     145.177     333.982     
1 1 1 26 10 16 o 6  149.029 2.42083 385.843     18.0089  402.88      18.1473  95.1005    60.797      24.7368     240.797     
1 1 1 26 10 17 o 2  176.576 2.5086  555.218     22.158   552.166     22.2386  169.197    216.134     85.1577     216.134     
1 1 1 26 10 18 o 9  160.059 2.47936 453.601     19.8453  456.333     19.9298  144.966    198.842     61.224      198.842     
1 1 1 26 10 19 o 9  121.914 2.44519 268.735     14.8409  259.643     15.0007  98.32      154.266     25.4195     154.266     
1 1 1 26 10 20 o 13 263.256 2.93137 1248.3      38.7219  1216.16     38.6206  233.145    111.367     82.6366     111.367     
1 1 1 26 10 21 f 0  99.1408 2.69542 173.913     13.5075  175.956     13.2226  58.432     15.4675     0           0           
1 1 1 26 10 22 o 1  234.032 2.77755 969.298     33.745   978.101     31.3509  195.364    38.156      50.8863     38.156      
1 1 1 26 10 23 f 0  63.7584 3.18684 82.7257     10.7292  63.3541     9.49388  32.8415    12.3127     0           0           
1 1 1 26 10 24 o 14 99.9416 2.77727 180.432     13.4066  175.382     14.3276  50.6324    79.465      39.0929     259.465     
1 1 1 26 10 25 o 13 28.0665 5.24427 20.0053     7.80368  9.16327     7.71677  8.86727    326.815     37.8876     326.815     
1 1 1 26 10 26 o 10 24.8054 5.8317  14.7669     9.38425  6.16667     7.93379  3.55109    286.853     13.1786     286.853     
1 1 1 26 10 27 o 7  38.8377 4.81799 22.5145     8.78038  33.6654     9.18554  0.236159   319.111     42.8559     139.111     
1 1 1 26 10 28 o 12 32.6159 5.54585 19.7881     8.63997  20.098      9.26769  1.3454     116.792     17.9604     296.792     
1 1 1 26 10 29 o 19 114.634 2.71956 231.333     15.287   237.033     15.9147  86.9977    342.145     13.4817     342.145     
1 1 1 26 10 30 f 0  28.8378 5.62577 11.9809     8.79623  18.808      8.28301  67.3447    217.936     0           0           
1 1 1 26 10 31 o 10 16.0857 4.94775 -3.91261    7.38713  0.958542    7.67024  21.2898    323.897     51.0165     323.897     
1 1 1 26 10 32 o 6  118.162 2.7136  255.828     16.0055  242.296     16.0783  60.9714    304.089     44.9365     124.089     
1 1 1 26 10 33 o 17 63.1898 3.30212 67.176      10.3478  76.4513     10.3841  20.9962    102.826     15.2648     102.826     
1 1 1 26 10 34 f 0  82.2529 3.09091 125.103     12.2666  117.275     13.0717  51.7839    309.828     0           0           
1 1 1 26 10 35 o 9  21.404  5.56575 10.8786     7.84663  -0.640134   9.16071  4.05039    317.98      14.1601     317.98      
1 1 1 26 10 36 o 6  119.195 2.92275 255.868     16.3097  252.14      18.4675  64.4757    314.938     39.0402     134.938     
1 1 1 26 10 37 o 9  71.9826 3.22199 94.7145     10.5894  91.4768     12.4196  37.2682    211.896     23.9163     31.8956     
1 1 1 26 10 38 o 6  69.9467 3.25472 78.0324     10.1152  98.5721     12.6136  35.1534    316.169     25.8406     136.169     
1 1 1 26 10 39 f 0  53.9697 4.00651 51.908      9.90733  54.2113     11.4101  52.7041    223.146     0           0           
1 1 1 26 10 40 o 5  75.424  3.37095 108.011     11.9734  97.1802     13.2415  47.9377    59.8362     8.15891     239.836     
1 1 1 26 10 41 o 12 34.6248 5.3567  18.0798     8.81865  27.8591     9.34318  10.508     101.908     21.7853     281.908     
1 1 1 26 10 42 o 3  28.5299 5.87073 15.2655     9.3454   15.5742     8.46889  8.82148    194.45      12.1295     14.4503     
1 1 1 26 10 43 o 9  116.035 2.82741 249.201     16.9806  234.043     15.8566  89.8964    207.214     18.0172     207.214     
1 1 1 26 10 44 f 0  58.2883 3.7693  65.1721     10.9582  58.8634     10.8021  36.3379    148.137     0           0           
1 1 1 26 10 45 f 0  69.5996 3.23489 76.8482     11.0001  99.1219     11.3337  36.2923    36.4121     0           0           
1 1 1 26 10 46 o 15 95.4227 2.88127 160.235     13.3405  167.579     14.1535  69.2973    32.7185     7.05302     32.7185     
1 1 1 26 10 47 o 9  84.9776 3.27957 128.342     13.2455  133.161     14.5687  71.6014    262.158     27.5545     262.158     
1 1 1 26 10 48 o 8  59.5942 3.81936 65.6237     10.8986  64.5674     11.6435  45.7201    41.358      12.6507     41.358      
1 1 1 26 10 49 o 14 96.5182 2.92113 156.144     13.2546  180.322     14.9548  60.1716    208.308     12.2383     28.3077     
1 1 1 26 10 50 o 19 76.2007 3.22584 101.364     11.4992  109.39      13.0208  56.4607    162.512     9.91245     162.512     
1 1 1 26 10 51 o 4  101.929 3.00053 173.816     13.9983  202.355     16.6078  75.5586    28.2814     11.8343     28.2814     
1 1 1 26 10 52 o 18 37.0729 5.59761 26.6673     9.58555  27.0111     10.5781  26.1719    331.576     9.132       331.576     
1 1 1 26 10 53 o 9  40.2343 5.11964 31.1442     9.16943  31.2198     10.6718  21.3811    82.6766     8.88647     262.677     
1 1 1 26 10 54 o 16 24.4588 6.0634  11.1872     8.55295  10.3245     9.87404  8.69585    224.621     2.31072     224.621     
1 1 1 26 10 55 o 19 72.5414 3.37762 93.0432     11.2977  100.046     13.1044  55.6423    29.987      14.1777     29.987      
1 1 1 26 10 56 o 19 65.1026 3.85837 87.5958     11.1965  70.4814     13.2323  57.4934    255.998     29.3561     255.998     
1 1 1 26 10 57 o 8  35.092  5.77632 14.0465     9.5239   37.3874     11.2364  23.6457    328.617     5.04037     328.617     
1 1 1 26 10 58 o 2  60.4202 3.81335 62.7441     11.2144  74.0845     11.5967  46.8569    126.404     14.5217     126.404     
1 1 1 26 10 59 o 3  27.2325 5.95011 10.3747     8.98999  19.5923     9.36693  10.3679    179.807     11.041      359.807     
1 1 1 26 10 60 o 16 74.3141 3.39756 93.8377     12.2276  111.285     12.9205  58.8829    251.424     19.9526     251.424     
1 1 1 26 10 61 o 12 34.9565 5.48624 13.9509     9.54205  37.1476     9.91341  24.9138    338.326     13.75       338.326     
1 1 1 26 10 62 o 13 14.3058 4.70276 -2.79764    8.37717  -9.422      8.04172  3.01861    19.9783     15.4546     19.9783     
1 1 1 26 10 63 o 14 41.0338 5.47027 36.9149     11.4977  31.4527     10.1896  22.9877    212.755     4.71481     32.7547     
1 1 1 26 10 64 f 0  21.467  6.20177 6.26854     11.3528  5.65057     9.77768  4.12922    302.99      0           0           
1 1 1 26 10 65 o 19 26.2979 6.53383 11.499      12.2209  15.5468     9.59226  10.0505    32.7218     4.92272     32.7218     
1 1 1 26 10 66 o 2  66.2093 5.21205 75.3984     18.1165  98.9119     14.4226  36.091     287.055     13.5368     107.055     
1 1 1 26 10 67 o 10 44.4135 6.22237 40.4423     14.1043  43.2819     12.5632  30.176     317.298     5.62069     317.298     
1 1 1 26 10 68 o 12 18.3528 5.76888 -9.26262    11.4336  4.82373     10.8096  3.7187     203.106     6.26569     23.1059     
1 1 1 26 10 69 o 16 31.5638 7.119   23.0797     13.6491  23.5486     11.8459  14.6285    168.925     6.70707     348.925     
1 1 1 26 10 70 o 17 25.6642 6.91723 8.39475     12.7125  19.2119     12.6649  6.53875    281.279     14.1803     101.279     
1 1 1 26 10 71 o 7  24.6214 6.76536 21.0151     12.9173  1.24632     13.0038  7.17407    230.766     1.59722     50.7657     
1 1 1 26 10 72 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 11 0  o 7  99.658  2.65332 176.918     13.2087  176.918     13.2087  78.3429    6.80753e-06 8.18457     6.80752e-06 
1 1 1 26 11 1  o 16 140.338 2.44451 352.527     17.4372  346.751     16.9467  66.6995    266.528     71.049      86.5278     
1 1 1 26 11 2  o 9  178.658 2.60543 567.392     23.271   566.187     23.3829  164.631    274.419     69.8891     274.419     
1 1 1 26 11 3  o 9  397.364 3.69311 2823.67     73.55    2796.73     73.5346  260.065    302.974     70.2553     122.974     
1 1 1 26 11 4  o 1  315.591 3.19127 1787.69     49.5226  1753.67     51.3823  274.306    130.068     81.6296     130.068     
1 1 1 26 11 5  o 4  54.8191 3.25846 59.8396     8.89177  48.0997     8.76968  38.1533    214.225     152.051     214.225     
1 1 1 26 11 6  o 4  127.013 2.47677 289.888     15.726   283.421     15.7719  103.368    114.662     26.0634     114.662     
1 1 1 26 11 7  o 7  143.099 2.54756 374.968     17.8965  352.713     18.5839  153.272    18.5303     108.216     18.5303     
1 1 1 26 11 8  o 12 161.217 2.41832 467.251     19.536   455.702     19.5383  104.565    181.297     25.9222     1.29687     
1 1 1 26 11 9  o 13 132.326 2.52369 309.555     16.4145  312.815     17.0235  73.5369    332.992     44.3798     152.992     
1 1 1 26 11 10 o 1  81.9578 2.69788 128.984     10.9841  110.548     11.0593  36.9837    270.676     39.4017     90.676      
1 1 1 26 11 11 o 17 258.217 2.97847 1198.87     38.5236  1171.81     38.5571  223.385    345.151     67.0006     345.151     
1 1 1 26 11 12 o 10 63.2652 3.26086 71.087      10.5075  72.0731     10.017   29.3349    225.32      15.9901     225.32      
1 1 1 26 11 13 o 10 215.878 2.67328 824.922     28.8426  831.18      28.9995  158.173    119.712     0.222871    299.71      
1 1 1 26 11 14 o 7  190.326 2.54484 632.36      24.2318  654.727     24.3095  127.46     135.38      23.3734     315.38      
1 1 1 26 11 15 o 10 55.4003 3.34218 66.2391     8.99262  44.8567     9.07139  28.6184    1.54616     0.804252    1.54616     
1 1 1 26 11 16 o 10 221.279 2.69552 881.68      30.386   858.866     29.3973  145.798    245.577     32.7847     65.5769     
1 1 1 26 11 17 o 2  25.6618 5.28452 7.02552     7.50737  16.5527     7.52674  22.4684    90.0179     67.2858     90.0179     
1 1 1 26 11 18 o 5  27.3441 5.27129 15.788      7.42305  11.8673     7.50718  24.9924    100.123     77.2281     100.123     
1 1 1 26 11 19 o 9  68.775  3.01177 92.4486     9.9802   76.8795     10.5442  34.6797    76.9889     22.0125     256.989     
1 1 1 26 11 20 o 13 33.2706 5.0487  20.2796     8.43439  20.9152     7.8957   4.59087    277.06      39.485      277.06      
1 1 1 26 11 21 o 11 63.8884 3.07989 72.5808     9.87555  73.4298     9.7265   40.4983    68.5037     1.58811     68.5037     
1 1 1 26 11 22 o 5  48.2414 4.00757 39.7099     9.8775   44.6541     9.00851  18.1601    1.50935     3.01878     1.50935     
1 1 1 26 11 23 o 11 144.651 2.78229 373.176     20.2189  372.067     20.0816  108.76     297.017     9.9156      297.017     
1 1 1 26 11 24 o 8  100.504 2.88275 184.342     14.6391  175.986     14.339   59.6471    259.343     22.3697     79.343      
1 1 1 26 11 25 o 1  116.346 3.13081 267.693     18.4778  216.918     17.869   89.3871    153.901     14.4117     153.901     
1 1 1 26 11 26 o 2  151.632 2.88571 404.989     22.5414  414.819     21.2367  136.876    214.823     57.542      214.823     
1 1 1 26 11 27 o 11 53.4699 3.86917 50.7919     10.3263  52.6103     10.1081  16.6922    259.683     35.6039     79.6828     
1 1 1 26 11 28 o 2  113.013 2.65156 239.984     15.2371  215.75      14.7458  85.1316    93.5668     11.3817     93.5668     
1 1 1 26 11 29 o 9  26.8999 5.45901 9.73088     8.25896  16.7213     7.6178   7.04651    59.2348     34.2362     59.2348     
1 1 1 26 11 30 o 4  87.1011 2.86438 135.553     12.755   135.639     12.1752  50.5537    50.4029     19.3285     230.403     
1 1 1 26 11 31 o 6  59.7074 3.44765 72.5165     10.2145  56.4023     10.113   23.7569    45.6485     31.0569     225.649     
1 1 1 26 11 32 o 10 152.608 2.48312 420.698     18.4836  409.078     19.4676  115.839    121.446     14.2691     121.446     
1 1 1 26 11 33 o 11 50.0173 3.65698 37.8352     8.78837  53.5029     9.08525  1.71818    201.035     70.6218     201.035     
1 1 1 26 11 34 o 17 101.202 2.87751 186.216     13.8566  180.216     15.2119  87.6808    87.549      34.9429     87.549      
1 1 1 26 11 35 f 0  29.6669 5.56539 12.4473     8.46673  20.8547     8.63972  48.2968    7.5017      0           0           
1 1 1 26 11 36 o 13 17.7663 5.2261  1.68306     7.82572  1.47078     7.54657  4.5111     314.778     19.2725     314.778     
1 1 1 26 11 37 o 5  93.9615 2.96661 172.944     14.1124  144.316     13.7014  69.4538    62.0336     7.06373     62.0335     
1 1 1 26 11 38 o 16 121.87  2.79422 265.049     17.5751  266.835     16.4885  107.92     168.989     44.1201     168.989     
1 1 1 26 11 39 o 18 29.2741 5.86221 13.8808     8.75781  18.7753     9.30539  10.0976    228.677     10.6727     48.677      
1 1 1 26 11 40 o 18 69.9634 3.35671 84.3661     11.3638  92.666      12.0375  45.4741    186.133     5.37317     6.13314     
1 1 1 26 11 41 o 2  132.88  2.82558 317.619     16.8084  315.999     20.5707  88.7854    30.7721     9.87499     210.772     
1 1 1 26 11 42 o 14 58.9321 3.996   53.3751     10.5115  74.744      12.8249  52.7344    10.5465     29.1666     10.5465     
1 1 1 26 11 43 o 14 52.9871 4.17508 44.5637     9.5981   59.4954     12.2505  38.6215    328.025     7.54784     328.025     
1 1 1 26 11 44 f 0  42.1641 5.41304 40.3612     9.26127  27.8062     12.1475  30.0098    299.636     0           0           
1 1 1 26 11 45 o 18 72.3815 3.59598 86.4626     11.6916  104.822     14.2586  59.4501    98.9157     20.7164     98.9157     
1 1 1 26 11 46 o 10 75.0612 3.59051 94.7768     12.0841  110.876     14.7796  54.8692    205.216     7.20092     205.216     
1 1 1 26 11 47 o 9  77.4602 3.52111 114.905     12.5865  103.71      14.4007  50.3913    37.366      5.388       217.366     
1 1 1 26 11 48 o 6  79.8539 3.35149 116.392     13.2849  115.371     13.4173  65.952     180.403     23.3193     180.403     
1 1 1 26 11 49 o 12 52.912  4.17605 52.1972     10.5761  51.7243     11.1779  36.1715    8.92218     2.39931     8.92219     
1 1 1 26 11 50 o 4  62.5    3.71833 67.8592     10.9356  75.7583     12.1497  56.8471    92.5362     31.4188     92.5362     
1 1 1 26 11 51 o 4  64.7615 3.6231  70.9442     11.0321  83.3276     12.3047  49.6608    146.266     12.331      146.266     
1 1 1 26 11 52 o 10 95.2393 2.9201  165.749     13.3012  163.156     14.4688  73.4665    324.279     16.8127     324.279     
1 1 1 26 11 53 o 2  111.591 2.92248 218.63      14.8542  233.558     17.7233  81.833     259.947     10.9835     259.947     
1 1 1 26 11 54 o 19 33.0873 5.82359 23.3146     9.03037  20.7793     10.2678  10.3191    166.306     21.64       346.306     
1 1 1 26 11 55 f 0  73.5405 3.67353 105.099     12.6425  95.626      14.1016  42.7895    120.972     0           0           
1 1 1 26 11 56 o 9  36.5308 5.83707 29.3934     9.79541  24.8936     11.1098  24.5657    197.33      4.23946     197.33      
1 1 1 26 11 57 o 17 62.6089 3.87972 66.8794     12.0941  80.6584     11.8776  37.4361    273.022     8.50317     93.0223     
1 1 1 26 11 58 o 6  68.4787 3.53605 96.8222     12.1848  78.2647     11.8364  45.3176    333.464     0.435999    153.464     
1 1 1 26 11 59 o 10 17.1898 5.23165 5.09855     8.69206  -5.76268    8.30038  0.345692   243.695     14.1625     63.6949     
1 1 1 26 11 60 o 10 41.4329 5.16419 33.8078     10.4625  34.7567     10.1937  28.3155    136.331     5.54765     136.331     
1 1 1 26 11 61 o 15 21.7667 5.8375  3.82766     9.04902  11.3662     8.9601   4.67521    37.0554     1.51882     217.055     
1 1 1 26 11 62 o 17 31.597  6.13548 18.4303     10.5404  23.6591     9.68235  13.2769    8.25628     11.1877     188.256     
1 1 1 26 11 63 o 11 55.6547 6.07773 39.9819     16.6881  90.2157     12.207   38.4074    220.385     5.39337     220.385     
1 1 1 26 11 64 o 2  17.3692 5.55799 -0.140943   11.3741  -5.11647    9.24188  3.08241    99.9561     6.86356     279.956     
1 1 1 26 11 65 o 10 30.3699 7.05338 17.3696     13.7326  22.7669     11.5812  19.0979    105.919     5.95383     105.919     
1 1 1 26 11 66 o 4  50.5752 6.24344 70.4603     17.8308  40.5016     12.835   40.1336    162.168     17.381      162.168     
1 1 1 26 11 67 o 10 29.4306 7.24535 25.173      13.6111  14.2136     13.1325  13.2546    270.611     6.93565     90.6108     
1 1 1 26 11 68 o 6  17.2395 5.55449 5.12194     11.5396  -16.9168    10.8486  1.31934    164.479     8.05808     344.479     
1 1 1 26 11 69 o 19 28.5017 7.56175 26.5384     17.0343  14.0015     12.15    12.7761    126.871     2.33595     306.871     
1 1 1 26 11 70 o 1  39.2704 7.8674  39.0054     18.3276  40.8468     14.5264  26.1866    59.6493     11.4466     59.6493     
1 1 1 26 11 71 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 12 0  o 1  107.364 2.5193  205.175     13.5211  205.175     13.5211  65.4072    4.165e-06   29.549      180         
1 1 1 26 12 1  o 17 106.735 2.59108 204.71      14.1196  200.589     13.5572  64.5809    34.163      23.3396     214.163     
1 1 1 26 12 2  o 2  21.8414 5.50658 5.85333     7.4178   8.77985     7.84355  12.5057    334.254     34.1019     334.254     
1 1 1 26 12 3  o 16 275.021 2.96059 1350.93     41.5579  1339.05     40.0423  203.834    102.809     0.0957672   282.81      
1 1 1 26 12 4  o 3  162.913 2.4545  475.815     20.0147  467.058     20.0619  139.9      298.386     42.7195     298.386     
1 1 1 26 12 5  o 8  117.374 2.4685  238.382     14.4715  251.572     14.5297  34.2765    184.538     102.288     4.53791     
1 1 1 26 12 6  o 2  142.754 2.47192 357.218     17.6916  366.821     17.674   101.805    356.684     3.80096     176.684     
1 1 1 26 12 7  o 3  139.821 2.49743 355.98      17.4723  338.979     17.5028  128.08     224.861     55.7845     224.861     
1 1 1 26 12 8  o 14 135.318 2.50596 328.791     17.3525  322.305     16.6037  123.764    31.9474     54.2261     31.9474     
1 1 1 26 12 9  o 1  54.6746 3.40377 52.8422     9.10899  54.4459     9.35372  5.44906    177.76      61.4016     357.76      
1 1 1 26 12 10 o 6  113.348 2.51587 228.038     14.2815  228.98      14.265   63.5717    158.548     35.9247     338.548     
1 1 1 26 12 11 o 7  108.93  2.53926 219.098     13.7798  203.23      13.8863  62.5017    201.79      31.0953     21.7903     
1 1 1 26 12 12 o 12 132.03  2.5654  315.891     17.6285  304.261     16.2815  73.9186    309.968     43.8726     129.968     
1 1 1 26 12 13 o 6  164.073 2.55738 478.496     20.1451  478.455     21.8743  108.656    234.543     22.4623     54.5432     
1 1 1 26 12 14 o 14 93.011  2.67845 157.899     12.3869  150.303     12.5206  71.1175    231.925     13.6558     231.925     
1 1 1 26 12 15 o 17 50.2722 3.54806 42.8044     8.74463  48.2905     8.87351  11.4245    156.645     40.6997     336.645     
1 1 1 26 12 16 o 14 70.3752 2.98797 91.3503     10.693   85.6517     10.2867  42.7033    25.6367     8.33582     205.637     
1 1 1 26 12 17 o 2  87.88   2.87073 139.716     12.5154  135.779     12.6964  79.2425    292.122     43.0434     292.122     
1 1 1 26 12 18 o 4  105.707 2.80086 195.935     15.0288  202.364     14.5792  75.9313    13.4733     2.13074     13.4733     
1 1 1 26 12 19 o 14 85.7946 3.02907 138.874     13.1579  124.219     12.7936  56.345     127.667     6.34977     307.667     
1 1 1 26 12 20 o 4  189.399 3.10329 644.199     29.0102  634.503     29.8854  157.402    246.881     38.9451     246.881     
1 1 1 26 12 21 o 9  50.143  4.25039 41.9964     10.8715  49.5237     9.85637  26.9815    192.737     1.97686     192.737     
1 1 1 26 12 22 o 7  68.9142 3.41432 88.8866     12.1011  81.6066     11.337   43.9486    246.155     32.346      246.155     
1 1 1 26 12 23 o 16 37.5555 4.91465 23.4663     8.74816  29.0333     9.0564   8.59902    116.235     15.205      296.235     
1 1 1 26 12 24 o 19 38.954  4.83992 26.3048     9.27845  29.9614     8.88861  1.84499    3.95428     41.7991     183.954     
1 1 1 26 12 25 o 5  154.048 2.61297 416.091     20.316   429.307     20.0187  128.442    61.479      35.4248     61.479      
1 1 1 26 12 26 o 11 39.0444 4.35477 25.6294     8.1006   30.589      8.34991  11.4294    328.219     10.0411     148.219     
1 1 1 26 12 27 o 15 61.1253 3.39389 72.9538     9.69197  61.7471     10.744   43.6857    166.927     14.2763     166.927     
1 1 1 26 12 28 f 0  143.722 2.51284 376.519     17.6455  359.784     18.4982  77.9093    249.577     0           0           
1 1 1 26 12 29 o 13 107.028 2.67927 220.239     13.5838  189.368     14.913   83.0629    88.8302     15.5732     88.8302     
1 1 1 26 12 30 o 6  106.931 2.77462 199.003     14.752   209.719     14.931   82.8755    179.751     14.9668     179.751     
1 1 1 26 12 31 o 5  71.1706 3.31048 96.2116     12.0661  86.1118     11.417   31.7514    321.943     35.5093     141.943     
1 1 1 26 12 32 o 18 57.8206 3.89766 57.3026     10.951   64.1569     11.3541  19.5115    295.964     40.5248     115.964     
1 1 1 26 12 33 o 7  79.9746 3.25466 116.859     13.4905  113.139     12.481   43.5744    220.277     25.6516     40.2774     
1 1 1 26 12 34 o 17 60.6983 3.95344 55.2099     11.4848  79.8621     12.0441  36.9318    317.513     9.68614     137.513     
1 1 1 26 12 35 o 10 85.3107 2.9781  144.198     12.6804  117.766     12.6092  53.9726    185.953     12.4136     5.9531      
1 1 1 26 12 36 o 19 45.2307 4.38704 46.4153     8.93049  29.9972     9.77525  15.2455    14.3515     30.482      194.352     
1 1 1 26 12 37 o 3  121.301 2.69831 268.237     15.4508  258.918     17.2265  82.2606    236.18      7.98779     56.18       
1 1 1 26 12 38 o 19 60.2276 3.52043 60.6227     10.0349  71.2884     11.031   45.5224    312.768     9.53752     312.768     
1 1 1 26 12 39 o 19 28.3031 5.51425 10.206      8.19177  20.35       8.44541  8.68809    275.824     14.1867     95.8242     
1 1 1 26 12 40 o 5  46.9592 4.17087 41.2632     9.1184   40.2313     10.033   20.7676    212.211     21.5658     32.2106     
1 1 1 26 12 41 o 2  51.503  3.76514 53.4238     9.43719  44.0082     9.60963  46.6147    209.331     33.8882     209.331     
1 1 1 26 12 42 o 5  111.717 2.86421 227.829     15.8815  221.443     16.1292  81.2738    44.0583     5.59787     44.0583     
1 1 1 26 12 43 o 1  24.6144 5.64663 16.3357     8.21548  4.03043     9.02239  7.33501    247.601     7.49186     67.6005     
1 1 1 26 12 44 o 1  51.6233 3.87483 47.1389     9.43796  51.0223     10.3083  35.2144    321.706     1.74093     321.706     
1 1 1 26 12 45 o 4  63.1524 3.46849 72.4761     10.4431  72.9728     11.3213  45.9592    261.343     6.23548     261.343     
1 1 1 26 12 46 o 17 42.478  4.62162 29.126      9.04019  39.2732     9.9613   11.7616    111.131     33.1941     291.131     
1 1 1 26 12 47 o 16 65.4145 3.61151 77.328      11.1956  79.3582     12.2795  37.7793    194.595     13.9083     14.5951     
1 1 1 26 12 48 o 15 82.4371 3.5009  115.981     14.3865  132.452     14.3504  59.1075    82.4473     4.82105     82.4473     
1 1 1 26 12 49 o 16 47.0756 5.28001 34.8773     12.016   51.056      11.6646  29.0167    347.576     4.26685     167.576     
1 1 1 26 12 50 o 10 65.5001 3.92363 76.0476     12.3789  83.0032     13.141   50.248     270.901     11.7633     270.901     
1 1 1 26 12 51 o 16 27.5899 6.33533 6.49896     9.66975  22.8719     11.4915  7.67407    94.9816     18.681      274.982     
1 1 1 26 12 52 o 17 26.8771 6.53464 12.7625     9.99386  15.2044     11.2913  9.30047    97.679      13.718      277.679     
1 1 1 26 12 53 o 11 37.99   5.81502 24.6803     9.68491  33.9892     11.8701  18.811     283.528     11.5828     103.528     
1 1 1 26 12 54 o 2  20.0534 5.77564 2.01458     8.88094  6.82456     9.50568  4.6507     331.658     0.903155    151.658     
1 1 1 26 12 55 o 17 64.4271 3.78828 76.3134     12.2228  79.1932     12.0084  45.4253    337.285     4.53417     337.285     
1 1 1 26 12 56 o 3  29.6065 6.2635  9.68386     10.1212  26.6948     11.1071  14.0031    132.976     7.40157     312.976     
1 1 1 26 12 57 o 7  74.6809 3.57243 110.78      13.3312  97.4983     13.2121  58.8247    126.219     17.969      126.219     
1 1 1 26 12 58 o 15 16.8704 5.2525  1.39977     8.74632  -2.82611    8.59987  1.1969     323.275     7.76694     143.275     
1 1 1 26 12 59 o 8  48.042  4.85586 56.5601     11.2821  35.3026     10.9309  29.8671    359.836     1.98454     179.835     
1 1 1 26 12 60 o 14 37.4948 5.9034  30.8175     10.6222  27.7601     11.0032  14.9975    177.539     17.1953     357.539     
1 1 1 26 12 61 o 15 28.2186 6.38561 16.916      10.5718  16.6021     9.85055  3.68449    102.778     27.2015     282.778     
1 1 1 26 12 62 o 6  32.8026 6.53885 16.7231     13.2432  28.7321     10.4143  21.6921    83.8455     14.1244     83.8455     
1 1 1 26 12 63 o 5  25.2669 6.78636 12.4801     14.0146  11.674      9.86783  12.1654    31.5081     2.05691     211.508     
1 1 1 26 12 64 o 18 61.6644 4.42039 73.5845     14.1923  74.3899     12.6683  41.441     325.101     2.70359     325.101     
1 1 1 26 12 65 o 11 35.343  7.51025 24.1465     16.1487  34.5256     13.6056  25.8805    79.7586     14.1766     79.7586     
1 1 1 26 12 66 o 11 34.5539 7.20951 38.354      15.123   19.3383     12.1272  22.4211    166.998     6.03872     166.998     
1 1 1 26 12 67 o 16 19.4481 6.18003 -13.6209    14.0051  7.37174     12.7963  3.19419    49.5176     5.48774     229.518     
1 1 1 26 12 68 o 4  28.8152 7.516   24.2795     15.1521  17.1763     13.5492  13.3657    225.267     0.918717    225.267     
1 1 1 26 12 69 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 12 70 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 13 0  o 9  12.8885 5.61051 2.31659     7.05003  2.31659     7.05003  29.869     180         65.806      180         
1 1 1 26 13 1  o 11 69.6154 3.13093 87.0868     11.3358  86.1935     10.3791  41.8427    250.228     9.52181     70.2284     
1 1 1 26 13 2  o 10 103.945 2.54386 197.957     13.1983  186.716     13.2538  83.3005    30.6904     19.5808     30.6904     
1 1 1 26 13 3  o 9  20.3081 5.45549 4.73143     7.2169   5.87798     8.10127  10.5073    93.3428     28.5152     93.3428     
1 1 1 26 13 4  o 2  113.776 2.51027 223.395     14.2648  237.369     14.3177  88.724     346.458     14.4592     346.458     
1 1 1 26 13 5  o 19 63.3325 3.12047 68.1268     9.9098   75.507      9.74255  7.30329    13.6822     73.3887     193.682     
1 1 1 26 13 6  o 11 226.151 2.66426 913.519     30.1594  905.638     30.2298  216.212    241.711     98.789      241.711     
1 1 1 26 13 7  o 7  52.9347 3.56852 47.7199     9.04014  53.2143     9.66642  25.7028    37.6987     9.27603     37.6987     
1 1 1 26 13 8  o 13 138.994 2.49597 345.629     17.3469  341.74      17.396   137.389    155.366     75.4987     155.366     
1 1 1 26 13 9  o 10 71.341  3.19806 84.3464     11.4193  97.9994     11.2653  17.5211    21.6775     65.2141     201.678     
1 1 1 26 13 10 o 10 141.166 2.63599 365.61      18.2386  343.985     18.9811  100.503    277.849     4.90697     97.8485     
1 1 1 26 13 11 o 17 94.4587 2.82051 159.039     12.7903  159.151     13.8317  35.9458    56.469      64.0214     236.469     
1 1 1 26 13 12 o 5  37.0067 4.88393 23.9214     8.6924   26.858      8.75006  5.96292    42.8858     22.2043     222.886     
1 1 1 26 13 13 o 1  124.778 3.00086 282.536     19.2427  272.875     18.2318  98.3754    57.1397     16.7758     57.1397     
1 1 1 26 13 14 o 6  74.0383 3.30902 96.2991     12.1415  100.06      12.2871  39.2307    73.2862     24.1498     253.286     
1 1 1 26 13 15 o 9  68.6906 3.53555 85.5859     12.1981  83.8315     11.9769  36.1298    8.96937     21.6668     188.969     
1 1 1 26 13 16 f 0  61.1499 3.66994 69.6194     11.0546  65.0431     11.2082  36.3213    84.5487     0           0           
1 1 1 26 13 17 o 16 25.1792 5.81986 7.11792     8.76647  14.4925     8.58305  22.4857    109.584     70.8483     109.584     
1 1 1 26 13 18 o 12 30.2924 5.52512 15.2948     8.70512  19.1145     8.25571  1.60023    66.4775     27.0033     66.4775     
1 1 1 26 13 19 o 1  88.9136 2.7914  140.249     11.695   142.059     13.0868  87.2058    251.134     60.9274     251.134     
1 1 1 26 13 20 o 9  196.895 2.74459 684.045     26.5805  697.708     27.5809  189.764    62.1577     92.6666     62.1577     
1 1 1 26 13 21 o 10 129.839 2.53603 290.925     16.4889  310.125     16.4688  103.568    180.213     20.4599     180.213     
1 1 1 26 13 22 o 6  42.9877 4.25469 34.2981     8.28605  33.3864     9.47296  13.5778    92.4899     22.2548     272.49      
1 1 1 26 13 23 o 16 112.41  2.69092 227.126     13.991   223.921     16.1837  51.6763    329.039     58.5265     149.039     
1 1 1 26 13 24 o 13 86.9687 2.98053 130.04      13.4632  140.795     12.3518  83.5073    47.7145     54.018      47.7145     
1 1 1 26 13 25 o 9  130.071 2.58873 299.991     16.8082  303.649     16.9071  81.0421    273.639     25.6108     93.6387     
1 1 1 26 13 26 o 9  112.296 2.90619 235.989     15.41    215.242     17.092   107.017    2.93519     56.082      2.93519     
1 1 1 26 13 27 o 1  26.9446 5.77436 18.8037     8.66116  6.72011     9.34394  0.85508    339.582     17.3839     159.582     
1 1 1 26 13 28 o 19 72.2739 3.1898  92.6327     11.6303  95.1017     11.3536  50.8764    171.961     1.7302      171.962     
1 1 1 26 13 29 o 12 78.3263 3.21733 109.568     13.4064  110.952     11.6642  56.2517    249.998     2.5568      249.998     
1 1 1 26 13 30 o 5  108.94  2.84365 213.94      15.6028  210.974     15.3936  90.3545    74.4871     24.7931     74.4871     
1 1 1 26 13 31 o 7  71.4497 3.31378 86.124      12.181   98.0526     11.2963  21.7371    88.9536     58.2215     268.954     
1 1 1 26 13 32 o 2  141.578 2.6433  367.563     18.8178  349.512     18.6529  114.017    325.598     24.1636     325.598     
1 1 1 26 13 33 o 10 92.1525 2.9364  154.741     13.0665  150.21      13.9533  80.5636    69.1124     31.0234     69.1124     
1 1 1 26 13 34 o 12 104.612 2.93661 196.483     15.8205  196.549     14.8937  57.2698    192.952     35.1522     12.9521     
1 1 1 26 13 35 o 3  61.5056 3.46261 72.2681     11.0109  65.0404     10.1643  53.3154    245.077     23.7324     245.077     
1 1 1 26 13 36 o 6  15.5479 4.85284 -4.6757     7.76351  0.211335    7.24726  3.53133    72.7388     14.6041     72.7388     
1 1 1 26 13 37 o 2  129.492 2.63859 303.556     17.7787  297.871     16.4146  110.843    53.6678     37.3198     53.6678     
1 1 1 26 13 38 o 1  57.8018 3.6157  60.3706     10.7948  61.5367     9.90178  53.7428    153.218     44.3942     153.218     
1 1 1 26 13 39 o 14 48.4035 3.9179  43.9969     9.37251  42.2976     9.29085  27.8604    0.530187    9.42976     180.53      
1 1 1 26 13 40 o 4  28.8965 5.58949 18.0403     8.36736  14.2633     8.35619  13.3364    98.6347     3.46381     278.635     
1 1 1 26 13 41 o 17 21.6479 5.65832 8.76409     8.36056  5.76367     7.94625  2.5595     213.198     2.50681     33.1983     
1 1 1 26 13 42 o 15 62.4462 3.50316 68.8023     10.6905  73.5502     11.0557  49.9419    314.555     14.9849     314.555     
1 1 1 26 13 43 f 0  58.4769 3.65696 61.8978     10.7114  63.4097     10.4956  27.5287    254.149     0           0           
1 1 1 26 13 44 o 13 72.2004 3.27573 103.108     12.1742  86.8207     11.3926  72.179     230.151     47.3457     230.151     
1 1 1 26 13 45 o 11 46.2817 4.5608  40.8779     10.2761  39.7447     10.3038  37.5719    31.7788     15.8226     31.7788     
1 1 1 26 13 46 o 13 68.3151 3.48934 81.7162     11.8018  89.1173     11.9151  49.366     6.79712     4.90751     6.79711     
1 1 1 26 13 47 o 10 24.486  6.02491 5.0258      9.57944  15.3725     9.37694  10.6561    85.0202     0.728073    265.02      
1 1 1 26 13 48 o 4  43.906  4.90458 30.0998     10.133   44.5189     10.5063  23.968     196.676     10.7001     16.6761     
1 1 1 26 13 49 o 3  95.5499 3.0454  160.178     14.5151  172.414     14.5608  67.4722    118.34      2.56921     118.34      
1 1 1 26 13 50 o 3  57.3606 4.52004 50.5403     12.6536  75.4603     12.2405  41.1808    296.419     4.89351     296.419     
1 1 1 26 13 51 o 2  29.7415 6.51163 11.7471     11.2767  23.9441     10.9882  4.37052    136.32      29.5567     316.32      
1 1 1 26 13 52 o 1  73.3783 3.81612 88.1894     14.2638  113.606     13.2188  45.9439    43.5635     8.37475     223.563     
1 1 1 26 13 53 o 6  17.271  5.3677  1.37196     9.67898  -2.20223    8.21852  2.39109    59.2044     3.59845     239.204     
1 1 1 26 13 54 o 14 52.2919 4.59699 54.1728     11.8384  51.6049     11.7319  41.8335    204.253     15.053      204.253     
1 1 1 26 13 55 o 15 55.1869 4.33753 53.5749     11.5828  63.4663     11.9528  50.9       11.1576     30.6948     11.1576     
1 1 1 26 13 56 o 6  30.803  6.35581 25.4628     9.56522  13.2485     12.8335  19.1941    4.19359     5.16154     4.19359     
1 1 1 26 13 57 o 15 59.5805 4.15207 62.2872     11.5955  73.638      12.8865  50.3217    250.448     23.0271     250.448     
1 1 1 26 13 58 o 10 49.8785 4.72032 48.1543     10.9595  49.3665     12.023   31.537     101.5       1.66764     281.5       
1 1 1 26 13 59 o 4  46.3765 5.09783 46.4538     10.796   39.3558     11.9041  41.6587    85.0823     28.0147     85.0823     
1 1 1 26 13 60 o 13 20.3844 5.85428 1.81616     9.48612  8.17243     9.5132   2.69769    319.874     16.8622     139.874     
1 1 1 26 13 61 o 17 74.5721 3.8629  115.36      15.4224  95.6711     13.2755  56.7466    291.281     14.6616     291.281     
1 1 1 26 13 62 o 13 58.6195 4.93062 73.5407     16.0031  63.1806     12.3136  49.1632    50.9921     22.5796     50.9921     
1 1 1 26 13 63 o 11 44.5419 6.9526  43.7249     18.5122  45.0209     11.6261  39.1293    202.441     26.4707     202.441     
1 1 1 26 13 64 o 19 22.356  6.70088 12.2379     13.9845  -0.0937168  12.4508  6.02826    235.267     11.395      55.2669     
1 1 1 26 13 65 o 15 32.2711 7.54122 20.1493     15.2504  31.0222     13.9907  19.9726    187.124     8.30807     187.124     
1 1 1 26 13 66 o 10 26.3395 7.2665  6.78654     16.8031  21.097      13.0764  10.9154    353.495     0.475281    173.495     
1 1 1 26 13 67 o 10 21.798  6.95257 21.6725     19.4524  -18.754     13.1861  3.25209    241.749     2.44187     61.7494     
1 1 1 26 13 68 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 14 0  o 13 167.892 3.14432 502.074     26.4136  502.074     26.4136  114.376    180         22.9198     8.56132e-06 
1 1 1 26 14 1  o 3  53.8189 3.89839 48.0638     9.91829  56.8194     10.8122  22.3017    88.0299     25.729      268.03      
1 1 1 26 14 2  f 0  110.673 2.78332 218.84      14.9912  217.927     15.8204  50.7429    262.86      0           0           
1 1 1 26 14 3  o 5  135.398 2.84358 329.784     19.7653  323.857     18.7762  109.579    268.721     21.4372     268.721     
1 1 1 26 14 4  o 3  112.909 2.8862  221.702     17.0382  233.176     15.4832  93.2517    92.9637     23.973      92.9637     
1 1 1 26 14 5  o 11 112.408 2.77067 224.718     15.6072  225.852     15.5605  93.7624    69.9801     25.9122     69.9801     
1 1 1 26 14 6  o 14 97.8539 2.95873 180.41      14.2245  161.758     14.6648  50.7137    64.155      40.071      244.155     
1 1 1 26 14 7  f 0  69.6649 3.29126 98.1743     11.564   76.4977     11.1868  42.9955    22.6194     0           0           
1 1 1 26 14 8  o 17 186.315 2.96368 639.7       28.2448  598.212     27.1022  129.161    140.996     17.4065     320.996     
1 1 1 26 14 9  o 9  79.237  3.38829 105.51      13.6735  119.79      13.0122  40.1805    38.9767     31.7595     218.977     
1 1 1 26 14 10 o 17 77.4914 3.20464 109.657     12.4785  105.434     12.302   32.1709    156.705     45.6329     336.705     
1 1 1 26 14 11 o 1  133.263 2.84421 312.276     19.2922  321.359     18.635   109.163    235.284     24.5106     235.284     
1 1 1 26 14 12 o 14 43.0483 4.76443 29.206      10.3744  39.4269     9.11158  7.54402    98.563      71.9063     98.563      
1 1 1 26 14 13 o 19 79.8209 3.05209 108.938     12.1588  119.219     12.1478  56.0566    307.846     1.31593     307.846     
1 1 1 26 14 14 o 10 133.265 2.57924 316.292     17.72    316.804     16.6814  133.895    96.9208     76.8505     96.9208     
1 1 1 26 14 15 o 5  16.337  4.94878 1.55817     7.36642  -2.38787    7.21858  18.5797    286.676     45.6965     286.676     
1 1 1 26 14 16 o 2  111.973 2.62922 218.517     14.956   228.868     14.4894  90.0141    274.807     19.5487     274.807     
1 1 1 26 14 17 o 14 81.111  2.88211 118.914     11.9437  116.451     11.41    16.2217    73.5062     83.8458     253.506     
1 1 1 26 14 18 o 6  135.99  2.59482 340.613     17.9572  319.209     17.3781  109.25     250.103     21.3146     250.103     
1 1 1 26 14 19 o 15 84.9287 2.79132 134.125     12.0626  123.893     11.6319  35.4768    178.278     50.1619     358.278     
1 1 1 26 14 20 o 6  33.1103 5.26025 20.8576     9.09575  20.4573     7.93475  18.3291    203.222     78.4305     203.222     
1 1 1 26 14 21 o 1  55.1454 4.11118 52.2923     12.1356  58.4026     9.92191  39.0404    339.302     21.232      339.302     
1 1 1 26 14 22 o 6  66.1859 3.39121 87.2353     11.4385  70.9425     10.8624  58.7832    150.918     36.7096     150.918     
1 1 1 26 14 23 o 15 111.026 3.21239 223.305     19.6546  218.762     15.8386  65.2668    125.724     30.2677     305.724     
1 1 1 26 14 24 o 7  52.7891 4.34983 40.4024     11.1535  62.7674     10.7999  21.9513    307.282     28.2103     127.282     
1 1 1 26 14 25 o 3  41.5013 4.85821 37.7952     10.232   26.7811     9.22373  5.76305    336.771     68.5712     336.771     
1 1 1 26 14 26 o 13 40.8619 5.52263 31.3276     11.6822  31.694      10.0748  23.612     69.8596     4.2851      249.86      
1 1 1 26 14 27 o 17 40.3107 4.60245 32.2225     8.96053  28.2263     8.9729   15.8152    270.422     22.0978     90.4218     
1 1 1 26 14 28 o 12 42.8189 4.40744 39.9404     9.01943  28.3434     9.09211  5.28793    112.816     48.5414     292.816     
1 1 1 26 14 29 o 11 18.1374 5.2376  2.85726     7.59201  2.18752     7.47794  3.44638    200.573     20.0244     200.573     
1 1 1 26 14 30 o 2  49.6313 3.8303  49.2766     9.42604  40.9332     9.25825  31.7678    217.959     3.6866      37.959      
1 1 1 26 14 31 o 11 66.9862 3.20447 84.5429     11.1351  77.5764     10.2576  43.2256    182.964     7.82854     2.96399     
1 1 1 26 14 32 o 9  64.673  3.36184 77.152      11.0014  74.3552     10.6389  41.6115    44.0406     7.447       224.041     
1 1 1 26 14 33 o 7  102.362 2.72637 190.715     14.4322  185.467     13.4838  78.4039    265.206     10.3645     265.206     
1 1 1 26 14 34 o 11 67.1501 3.3538  75.2492     11.3566  88.5286     10.9683  48.3662    69.9302     2.88955     69.9302     
1 1 1 26 14 35 o 13 79.5715 2.95411 114.697     12.1172  113.65      11.35    72.2732    153.2       33.344      153.2       
1 1 1 26 14 36 o 16 46.0833 4.20823 35.5485     9.68175  43.4141     9.12066  31.431     251.103     1.75468     251.103     
1 1 1 26 14 37 o 17 34.0224 5.26919 20.7031     9.08525  23.9108     8.39156  13.0583    296.489     17.4749     116.489     
1 1 1 26 14 38 o 15 84.0119 2.9401  130.861     12.7334  124.015     11.9482  68.198     28.0643     18.2935     28.0643     
1 1 1 26 14 39 o 19 58.997  3.56363 75.5859     10.7799  52.6924     9.94432  52.3091    53.0272     25.2275     53.0272     
1 1 1 26 14 40 o 13 40.1163 4.71309 30.732      9.45113  30.2004     8.82827  29.077     215.376     7.89079     215.376     
1 1 1 26 14 41 o 12 57.2264 3.74285 64.5181     10.8151  55.972      10.3911  34.6473    144.124     9.49887     324.124     
1 1 1 26 14 42 o 16 57.9211 3.66871 63.7527     10.9304  59.5043     10.1451  46.3778    144.084     14.1376     144.084     
1 1 1 26 14 43 o 6  31.7629 5.55774 21.2451     8.82091  18.3972     8.79787  19.2484    89.7292     1.36845     89.7292     
1 1 1 26 14 44 o 1  24.2843 5.76308 10.6253     8.21609  11.168      8.32948  10.208     301.499     2.90177     121.499     
1 1 1 26 14 45 o 10 76.1945 3.27355 104.026     12.373   107.99      12.5073  71.56      199.702     38.1797     199.702     
1 1 1 26 14 46 o 19 43.3957 4.58384 32.7122     9.51731  39.1921     9.76349  26.3336    70.2058     5.47354     250.206     
1 1 1 26 14 47 o 4  20.3046 5.61901 3.98873     8.18619  7.15797     8.48993  5.71       351.971     8.65105     171.971     
1 1 1 26 14 48 o 3  18.7324 5.57562 6.18272     8.20789  -6.69854    11.0681  3.87206    190.075     2.33974     10.0754     
1 1 1 26 14 49 o 9  35.9322 5.57551 31.4595     9.3671   20.7201     10.2672  18.3576    9.04924     10.2082     189.049     
1 1 1 26 14 50 o 2  18.0779 5.45609 -3.84287    8.53955  5.43884     9.36314  0.527868   240.978     18.2844     60.9776     
1 1 1 26 14 51 o 9  18.8143 5.47779 5.70227     8.51862  1.03335     8.29485  3.73417    312.692     10.665      132.692     
1 1 1 26 14 52 o 19 64.3582 3.66036 74.7539     11.6152  80.4086     11.7895  36.8727    235.628     14.0025     55.6279     
1 1 1 26 14 53 o 12 67.5643 3.60199 97.14       11.9564  74.3462     12.0444  60.1779    265.168     29.7067     265.168     
1 1 1 26 14 54 o 7  27.1053 6.04493 8.50682     10.199   20.7164     9.332    6.87298    294.974     19.3231     114.974     
1 1 1 26 14 55 o 12 73.0676 3.72575 113.069     14.2986  88.6157     12.7903  55.4782    206.691     12.6034     206.691     
1 1 1 26 14 56 o 13 54.121  4.51421 56.7254     12.4826  57.1224     11.4943  43.7276    311.409     17.1794     311.409     
1 1 1 26 14 57 o 10 51.5565 5.03868 54.7888     12.4099  50.803      12.8771  41.6785    87.2592     16.8223     87.2592     
1 1 1 26 14 58 o 5  86.7242 3.34656 128.39      14.4097  151.816     14.4889  63.7761    232.13      10.6649     232.13      
1 1 1 26 14 59 o 9  27.9124 6.58748 14.5925     11.6205  18.1399     10.2372  10.9353    343.371     11.9112     163.371     
1 1 1 26 14 60 o 7  25.2709 7.035   20.7953     14.92    1.18878     12.3757  12.3607    148.776     2.07313     328.776     
1 1 1 26 14 61 o 9  57.1159 5.67671 61.8056     16.1124  73.3465     15.2003  43.8452    188.778     13.2835     188.778     
1 1 1 26 14 62 o 14 31.3616 7.3465  29.0507     14.4123  17.6288     12.8063  18.6694    249.28      1.28049     249.28      
1 1 1 26 14 63 o 9  27.1148 7.44769 17.8969     15.222   15.2739     13.7673  11.5246    146.223     6.64931     326.223     
1 1 1 26 14 64 o 12 22.5942 6.80348 14.2123     14.8007  0.846437    12.5367  6.8743     13.7357     4.58798     193.736     
1 1 1 26 14 65 o 13 26.9956 7.50531 26.9673     16.8023  8.28619     13.4939  11.111     68.53       0.0310754   68.531      
1 1 1 26 14 66 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 14 67 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 15 0  o 18 155.441 2.69387 430.139     20.9562  430.139     20.9562  161.399    3.99559e-07 89.3494     3.99559e-07 
1 1 1 26 15 1  o 14 69.6736 3.15665 85.1389     10.9759  88.9995     10.9467  58.222     111.127     27.0905     111.127     
1 1 1 26 15 2  o 7  45.2975 4.13306 33.8438     9.03093  41.2315     9.23221  21.1083    227.077     7.84297     47.0766     
1 1 1 26 15 3  o 16 15.5642 4.86781 -4.82292    7.27469  -0.151958   7.80704  7.02143    262.624     17.1679     262.624     
1 1 1 26 15 4  f 0  134.726 2.79595 328.298     18.689   319.655     19.0163  54.7338    248.744     0           0           
1 1 1 26 15 5  o 7  136.711 2.89387 336.127     20.5737  331.404     19.013   127.591    206.145     56.1019     206.145     
1 1 1 26 15 6  o 12 131.02  2.94699 308.097     18.5428  305.268     20.0684  95.9317    114.326     0.203778    294.327     
1 1 1 26 15 7  o 12 39.9558 4.77292 26.8826     9.11805  32.3954     9.28226  3.8791     85.4929     59.0101     85.4929     
1 1 1 26 15 8  o 17 91.9768 2.99597 150.747     13.8988  151.978     13.6434  68.266     247.686     5.62699     247.686     
1 1 1 26 15 9  o 13 129.152 2.70319 306.618     17.689   288.881     17.263   77.714     202.382     34.2869     22.3819     
1 1 1 26 15 10 o 10 135.114 2.61694 335.241     17.4871  316.208     17.8926  113.203    335.106     29.122      335.106     
1 1 1 26 15 11 o 2  61.5552 3.22752 66.339      9.58017  69.9286     10.192   29.8848    266.788     24.1612     86.7878     
1 1 1 26 15 12 o 15 70.4966 3.17143 87.8525     10.9557  90.5755     11.3372  48.0711    123.434     0.406736    303.433     
1 1 1 26 15 13 o 19 55.6291 3.42708 57.4168     9.23478  54.2639     9.65676  37.1204    117.355     4.72959     117.355     
1 1 1 26 15 14 o 9  17.9271 5.18561 1.23248     7.46749  3.1592      7.37214  6.66937    105.42      18.886      105.42      
1 1 1 26 15 15 o 7  39.1886 5.11478 18.3098     9.67066  40.7493     9.28877  13.4514    332.397     17.7983     152.397     
1 1 1 26 15 16 o 8  26.1887 5.68849 16.4115     8.47161  8.40451     8.3265   1.04808    226.982     21.2059     226.982     
1 1 1 26 15 17 o 5  192.94  2.96842 668.298     27.9919  662.565     29.3873  153.635    261.35      22.2138     261.35      
1 1 1 26 15 18 o 19 65.5063 3.56217 75.532      11.4894  79.4195     11.7178  52.7777    6.95272     16.5924     6.95272     
1 1 1 26 15 19 o 10 86.1958 3.09768 129.944     13.6201  136.733     13.0236  86.7792    118.774     53.8192     118.774     
1 1 1 26 15 20 o 16 108.732 3.42001 231.131     17.9816  194.755     18.9829  87.1775    179.768     16.3294     179.768     
1 1 1 26 15 21 o 5  80.2457 3.29064 117.348     13.3744  114.393     12.9788  76.0852    348.905     39.1343     348.905     
1 1 1 26 15 22 o 3  32.4842 5.77011 19.0413     10.2026  21.1461     8.62088  16.5227    237.647     0.44823     237.647     
1 1 1 26 15 23 o 10 71.7287 3.05636 100.456     10.9006  84.9048     10.9068  60.6214    245.202     19.838      245.202     
1 1 1 26 15 24 o 19 20.3675 5.28264 -0.967495   7.65529  10.833      7.6758   0.837541   349.362     18.4256     349.362     
1 1 1 26 15 25 o 3  118.532 2.74996 250.494     16.2828  252.899     16.3432  94.26      27.1116     15.8878     27.1116     
1 1 1 26 15 26 o 5  56.2212 3.77228 65.8572     10.7141  49.8622     10.1816  51.9273    205.39      29.7011     205.39      
1 1 1 26 15 27 o 12 18.8434 5.37412 4.7844      8.18914  1.72617     7.49381  17.6376    203.751     57.7057     203.751     
1 1 1 26 15 28 o 10 59.163  3.37164 67.4683     9.96817  59.5778     9.83148  46.8404    284.182     11.8348     284.182     
1 1 1 26 15 29 o 11 86.5101 2.82552 138.847     12.3904  130.298     12.042   78.0195    60.7606     32.8627     60.7606     
1 1 1 26 15 30 o 19 55.2705 3.59095 47.1464     9.84272  64.9456     9.53662  39.6636    276.801     3.03575     276.801     
1 1 1 26 15 31 o 14 19.4705 5.41799 5.48353     7.85841  3.35884     7.6895   0.198952   47.2257     15.9827     47.2258     
1 1 1 26 15 32 o 12 75.5809 2.97863 101.707     11.3852  104.527     11.0812  62.2938    117.179     17.8005     117.179     
1 1 1 26 15 33 o 13 62.7438 3.32629 73.9021     10.6492  69.2118     10.1188  48.2236    134.564     8.98571     134.564     
1 1 1 26 15 34 o 13 53.5225 3.76189 58.3594     9.53986  47.0771     10.1675  31.1356    286.29      12.0312     106.29      
1 1 1 26 15 35 o 4  65.9589 3.16988 84.9374     10.3897  73.1352     10.3923  55.3623    48.4741     19.0081     48.4741     
1 1 1 26 15 36 o 14 40.815  4.60212 26.5681     9.12936  36.6245     8.84702  32.9645    55.574      20.3627     55.574      
1 1 1 26 15 37 o 7  59.8478 3.39855 62.0125     10.0346  68.7551     10.1637  51.6438    241.704     21.4201     241.704     
1 1 1 26 15 38 o 13 83.4516 2.91574 129.022     12.1781  122.772     12.1295  71.5145    245.148     25.5042     245.148     
1 1 1 26 15 39 o 8  59.4864 3.50437 63.8094     10.2701  65.753      10.4342  46.5491    272.916     11.1854     272.916     
1 1 1 26 15 40 o 18 46.158  4.16003 38.3241     9.34631  41.2401     9.45433  40.8734    77.824      22.7535     77.824      
1 1 1 26 15 41 o 7  39.1352 4.97089 33.2613     9.49471  25.8025     9.24469  21.8155    319.015     8.32938     139.015     
1 1 1 26 15 42 o 3  59.2767 3.64471 66.3497     10.8936  63.1506     10.5461  49.9864    112.443     18.6338     112.443     
1 1 1 26 15 43 o 19 29.1351 5.80365 18.5163     9.03737  15.3035     8.66489  13.0785    52.6264     10.4969     232.626     
1 1 1 26 15 44 o 6  38.0795 5.18241 19.7362     9.62244  38.0437     9.25811  29.4459    257.869     10.3113     257.869     
1 1 1 26 15 45 o 2  43.1144 4.76877 32.831      10.0891  38.949      9.74501  33.5457    280.109     10.1496     280.109     
1 1 1 26 15 46 o 9  49.9176 4.13691 45.5029     10.0478  48.7039     10.2532  32.4865    77.7037     3.13704     257.704     
1 1 1 26 15 47 o 13 37.6655 5.36977 38.7816     9.57932  18.9945     9.99433  32.3129    56.4626     22.482      56.4626     
1 1 1 26 15 48 o 11 17.2954 5.32708 4.30654     9.30817  -5.97466    8.5059   2.10482    296.891     23.415      296.891     
1 1 1 26 15 49 o 18 65.3771 3.69005 78.0391     12.854   82.0259     10.9597  48.611     183.024     7.52931     183.024     
1 1 1 26 15 50 o 6  67.3486 3.64067 88.8312     11.823   81.0977     12.493   63.33      153.864     35.5589     153.864     
1 1 1 26 15 51 f 0  14.3514 4.7328  -6.13088    8.27415  -6.04208    8.42471  5.96812    274.087     0           0           
1 1 1 26 15 52 o 18 93.2002 3.12341 165.32      14.511   155.544     14.5692  71.362     93.4378     14.5177     93.4378     
1 1 1 26 15 53 o 10 73.6147 3.50824 102.613     12.6576  100.182     13.0643  47.629     40.7924     5.11029     220.792     
1 1 1 26 15 54 o 17 21.1208 5.93208 6.19989     9.25445  7.21103     9.50165  4.37619    62.269      12.4586     242.269     
1 1 1 26 15 55 o 2  25.4646 6.10514 2.21149     11.4009  20.1936     9.69797  12.5585    80.5547     0.0125681   80.5555     
1 1 1 26 15 56 o 19 32.3182 6.52258 13.5873     12.6655  30.8004     11.166   11.8387    79.6718     17.3018     259.672     
1 1 1 26 15 57 o 3  32.8497 7.1761  21.2256     13.1217  27.1934     13.0545  10.5625    254         20.8549     74.0003     
1 1 1 26 15 58 o 2  40.0622 6.76592 40.7038     14.8354  30.533      12.0038  10.8464    57.7449     30.8883     237.745     
1 1 1 26 15 59 o 14 40.7126 6.88052 36.3829     15.5044  38.0264     12.2993  26.8916    30.5206     2.12976     30.5206     
1 1 1 26 15 60 o 5  42.5974 6.94529 36.7786     16.639   45.8874     12.687   30.4295    85.6516     7.16571     85.6516     
1 1 1 26 15 61 o 19 37.3138 7.22199 40.7774     15.6026  26.5688     12.3148  14.6342    39.6338     17.9642     219.634     
1 1 1 26 15 62 o 9  24.9911 7.30827 15.0348     18.8304  10.8985     11.2524  9.88821    135.704     4.35701     315.704     
1 1 1 26 15 63 o 15 21.8049 6.76602 8.77359     15.1096  2.66755     13.2443  2.95217    176.793     0.952456    356.793     
1 1 1 26 15 64 o 6  27.8734 7.59074 27.6859     15.6929  10.4181     15.5411  11.0045    342.758     1.74345     342.758     
1 1 1 26 15 65 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 16 0  o 18 11.605  5.43096 -1.86293    8.2577   -1.86293    8.2577   21.0352    180         47.543      180         
1 1 1 26 16 1  o 13 112.839 3.15521 239.362     16.6218  217.187     18.78    96.8035    243.146     29.1204     243.146     
1 1 1 26 16 2  o 18 111.495 2.94039 213.756     16.812   231.269     15.92    96.5377    296.837     30.7386     296.837     
1 1 1 26 16 3  o 15 86.3178 2.96018 135.114     12.7491  131.815     12.7824  87.1555    109.078     56.3499     109.078     
1 1 1 26 16 4  o 10 55.6496 3.7203  54.6398     10.3567  57.5751     10.1326  37.4616    357.032     1.66508     357.032     
1 1 1 26 16 5  o 10 160.664 2.65888 465.304     20.7767  455.899     22.0069  137.845    336.243     37.4618     336.243     
1 1 1 26 16 6  o 1  77.0325 3.09383 101.467     11.3311  111.626     12.4643  66.749     215.99      26.171      215.99      
1 1 1 26 16 7  o 3  34.736  5.0453  21.3736     8.5651   24.019      8.40995  3.13064    91.2443     36.493      271.244     
1 1 1 26 16 8  o 15 59.6141 3.58682 68.7288     11.0476  59.9068     10.1841  3.31695    161.194     92.5947     161.194     
1 1 1 26 16 9  o 8  24.365  5.80077 12.1378     9.00193  8.53959     7.79453  0.0617416  302.753     11.9126     122.753     
1 1 1 26 16 10 f 0  111.87  2.88923 224.366     16.99    223.613     15.3079  80.5283    123.64      0           0           
1 1 1 26 16 11 o 1  98.7835 2.93823 180.025     15.3357  169.657     13.6816  87.5682    48.1325     31.9997     48.1325     
1 1 1 26 16 12 o 2  36.1845 5.45095 31.2809     10.9483  19.0265     8.33672  17.6168    213.489     3.95338     33.4887     
1 1 1 26 16 13 o 5  38.6154 5.38792 30.4357     11.1488  25.9473     8.97276  20.7382    47.466      8.39135     47.466      
1 1 1 26 16 14 o 7  55.7741 4.07881 59.6218     12.2168  53.8996     10.2407  40.9998    82.3364     5.23896     82.3365     
1 1 1 26 16 15 o 6  24.7243 5.52985 0.426512    9.57462  17.6754     8.11126  0.320226   291.709     28.4086     291.709     
1 1 1 26 16 16 o 19 58.9148 3.78598 66.9445     10.6263  59.2378     11.3783  36.288     166.651     11.238      346.651     
1 1 1 26 16 17 o 5  159.024 2.74899 474.235     22.7889  430.742     21.0375  137.07     107.542     38.6756     107.542     
1 1 1 26 16 18 o 17 92.2675 2.85303 163.84      13.4134  141.908     12.8877  73.1647    6.81717     11.8085     6.81717     
1 1 1 26 16 19 o 10 34.3973 5.44632 28.2806     9.12688  17.1415     9.34246  17.9099    220.999     6.21324     40.9994     
1 1 1 26 16 20 o 19 56.4859 3.57293 56.4347     10.0273  59.4702     9.97968  34.9504    56.2269     9.94434     236.227     
1 1 1 26 16 21 o 11 26.8893 5.89039 8.67256     10.1361  17.016      8.18247  8.31667    189.108     11.6293     9.10768     
1 1 1 26 16 22 o 18 90.6095 2.8469  142.986     12.8032  151.994     12.9823  75.0392    293.41      18.7055     293.41      
1 1 1 26 16 23 o 13 22.1906 5.54554 8.17368     7.50135  8.17144     7.88774  0.511285   137.617     21.8522     317.617     
1 1 1 26 16 24 o 15 33.1776 5.19577 18.9309     8.16485  23.2591     8.67705  17.688     218.227     4.53008     38.2267     
1 1 1 26 16 25 o 3  54.4052 4.15291 62.7688     9.65438  46.692      11.8445  39.3014    242.401     3.02357     242.401     
1 1 1 26 16 26 o 10 20.333  5.44811 2.88467     7.70883  8.22766     7.81399  4.07127    285.658     30.1765     285.658     
1 1 1 26 16 27 f 0  18.4308 5.29647 6.55666     8.01568  -2.65375    7.99671  18.5259    214.233     0           0           
1 1 1 26 16 28 o 8  72.2245 3.12141 107.231     10.7837  82.3058     11.4369  48.5249    292.702     6.40889     112.702     
1 1 1 26 16 29 o 3  56.1416 3.56294 55.0491     9.62262  60.1663     10.2156  45.2196    242.408     12.8298     242.408     
1 1 1 26 16 30 o 1  57.8416 3.55936 66.8108     10.0616  55.6779     10.2677  37.3944    106.887     6.61267     286.887     
1 1 1 26 16 31 o 14 39.384  4.73254 29.968      8.74367  28.7629     9.25121  18.7055    351.468     15.6637     171.468     
1 1 1 26 16 32 o 5  113.308 2.68742 238.879     14.7731  223.278     15.6456  86.2027    216.103     8.48133     216.103     
1 1 1 26 16 33 o 2  92.802  2.94685 147.655     13.1952  163.752     14.1499  67.4573    18.2339     1.52291     18.234      
1 1 1 26 16 34 o 6  68.3927 3.36605 85.6234     10.9745  84.8022     11.9267  36.4336    138.817     24.5504     318.817     
1 1 1 26 16 35 o 8  63.7364 3.41853 67.6891     10.3217  80.9418     11.3554  54.1864    254.519     19.5911     254.519     
1 1 1 26 16 36 o 15 24.6664 5.5877  4.0893      8.19304  17.5493     8.64446  9.71556    202.388     2.07717     22.3884     
1 1 1 26 16 37 o 4  65.8186 3.41058 84.5315     10.7252  74.0012     11.4995  61.879     76.4786     32.6463     76.4786     
1 1 1 26 16 38 o 10 36.8235 5.26358 28.1386     9.21054  24.6389     9.5378   23.4548    247.8       1.03388     67.8001     
1 1 1 26 16 39 o 18 64.9808 3.53618 79.1049     10.9859  76.0299     11.8253  54.4213    338.64      18.0729     338.64      
1 1 1 26 16 40 o 3  24.7396 5.75965 17.3033     8.84057  4.29958     8.95797  11.0484    113.32      6.16472     293.32      
1 1 1 26 16 41 o 10 20.3054 5.69611 4.34849     8.62725  6.1128      8.66921  6.11138    96.0242     7.75074     276.024     
1 1 1 26 16 42 f 0  31.7337 5.82914 22.5285     8.84877  18.0519     10.009   12.5892    342.957     0           0           
1 1 1 26 16 43 o 9  29.9149 5.89947 20.1091     8.98906  16.219      9.47404  4.39913    119.154     31.0061     299.154     
1 1 1 26 16 44 o 13 23.1456 5.79168 3.28769     8.53003  15.1875     9.20204  5.31504    7.76687     17.7327     187.767     
1 1 1 26 16 45 o 2  30.8008 5.99658 20.9677     9.49823  18.2236     9.63882  16.7471    219.136     5.63183     39.136      
1 1 1 26 16 46 o 8  105.708 2.99379 201.316     15.5097  208.504     16.146   102.279    290.362     56.4131     290.362     
1 1 1 26 16 47 o 10 38.9103 5.1875  34.8219     10.1132  26.1104     9.37179  22.4338    44.3963     6.82022     224.396     
1 1 1 26 16 48 o 18 36.6027 5.64461 22.9316     10.4234  32.3222     9.76795  14.6173    331.707     19.4279     151.707     
1 1 1 26 16 49 f 0  63.9224 3.80028 87.6889     12.5019  67.2081     11.5528  39.0897    333.942     0           0           
1 1 1 26 16 50 o 18 55.7898 4.16111 56.3457     11.098   63.1        11.8207  47.6524    308.454     20.7841     308.454     
1 1 1 26 16 51 o 10 26.8902 6.49839 14.2889     12.2109  15.4722     9.12834  11.6178    183.43      4.47648     183.43      
1 1 1 26 16 52 o 3  47.6266 5.56442 51.9239     12.1299  40.9021     13.195   31.3155    267.033     0.300341    87.0332     
1 1 1 26 16 53 o 11 26.9246 6.66088 15.1184     10.9785  15.1013     11.1816  6.95589    141.039     19.1432     321.039     
1 1 1 26 16 54 f 0  30.0733 6.67691 25.5866     11.7611  13.5189     11.329   17.2447    220.01      0           0           
1 1 1 26 16 55 o 15 26.3416 6.53094 19.9403     11.277   7.93149     10.8561  14.7314    248.429     0.0373155   248.43      
1 1 1 26 16 56 o 13 28.9691 6.64479 13.2182     11.7086  22.938      11.0482  13.5674    257.358     8.39238     77.3583     
1 1 1 26 16 57 o 6  24.3994 6.74283 3.99103     11.7751  17.3208     12.8658  5.07497    222.282     2.51427     222.282     
1 1 1 26 16 58 o 8  45.6161 6.67833 40.2823     16.4392  52.7742     12.9152  38.7558    248.251     20.1939     248.251     
1 1 1 26 16 59 o 18 57.3803 5.55599 65.9917     16.7487  72.3833     13.7996  40.0006    248.45      4.26717     248.45      
1 1 1 26 16 60 o 1  26.8115 7.24457 16.3101     15.275   16.9975     12.1183  12.7256    286.85      2.89296     286.85      
1 1 1 26 16 61 o 4  20.3225 6.52995 -1.03714    17.9     2.60555     11.4278  3.66674    232.065     9.40912     52.065      
1 1 1 26 16 62 o 4  20.4396 6.78678 -7.87442    21.612   -0.296265   14.2795  1.54421    297.409     1.64869     117.409     
1 1 1 26 16 63 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 17 0  o 19 9.72877 4.72021 -4.92389    7.41375  -4.92389    7.41375  30.631     8.65154e-06 70.4343     8.65154e-06 
1 1 1 26 17 1  o 7  41.7635 5.19264 43.4587     9.49694  23.2238     10.7655  18.8016    74.6055     19.6946     254.606     
1 1 1 26 17 2  o 2  63.5202 4.02421 75.5127     12.889   71.3669     12.4608  35.834     12.6234     20.4921     192.623     
1 1 1 26 17 3  o 8  32.3828 6.17966 20.4575     10.9646  19.7174     9.56779  10.5432    58.9256     20.162      238.926     
1 1 1 26 17 4  o 10 131.103 3.00642 312.419     19.9339  303.984     19.5196  92.494     97.0046     10.7346     277.005     
1 1 1 26 17 5  o 12 82.5162 3.56818 120.868     14.0855  125.053     15.2755  59.9582    131.309     1.20535     311.309     
1 1 1 26 17 6  o 3  69.6464 3.76048 82.9836     13.6436  92.9891     12.2363  60.7066    307.009     21.5922     307.009     
1 1 1 26 17 7  o 18 78.173  3.38166 114.301     14.527   106.202     11.7774  59.8353    192.05      5.54202     192.05      
1 1 1 26 17 8  o 17 24.314  6.02604 10.1279     9.65551  9.73966     8.49416  2.61623    144.031     20.8913     324.031     
1 1 1 26 17 9  o 11 68.6705 3.31443 80.9773     11.0275  89.3417     11.6493  52.4261    30.7764     5.66993     30.7764     
1 1 1 26 17 10 o 9  42.2653 4.65445 38.1726     9.04193  28.6257     9.75926  29.088     200.181     2.50168     200.181     
1 1 1 26 17 11 o 12 29.8376 5.67225 16.9146     8.69865  17.1141     8.62939  13.3759    125.742     5.38191     305.742     
1 1 1 26 17 12 o 11 146.742 2.8322  378.985     19.9166  393.01      21.6879  122.553    351.666     26.6367     351.666     
1 1 1 26 17 13 o 3  35.9037 4.88341 28.7713     8.22104  20.1283     8.63115  23.3981    274.621     4.93246     274.621     
1 1 1 26 17 14 o 1  78.905  2.95061 115.16      11.2618  108.835     11.9507  50.9909    232.064     13.5297     52.0642     
1 1 1 26 17 15 o 11 35.0598 5.1484  27.7102     8.54184  19.2484     8.95845  12.4387    340.649     21.7819     160.649     
1 1 1 26 17 16 o 1  49.1105 3.87746 42.8133     9.21624  45.5891     9.54457  17.9437    311.734     34.1066     131.734     
1 1 1 26 17 17 o 6  24.5402 5.58197 12.9777     7.71944  8.81259     8.04444  0.856058   230.588     0.203816    50.588      
1 1 1 26 17 18 o 17 113.852 2.74728 241.943     15.2387  223.51      16.0042  68.6926    334.19      31.0377     154.19      
1 1 1 26 17 19 o 11 96.0858 2.76342 165.785     13.2762  165.931     13.2814  84.0792    339.022     27.7283     339.022     
1 1 1 26 17 20 o 8  40.8797 4.66356 29.2559     9.49469  33.5232     8.87878  20.8463    132.176     14.0565     312.176     
1 1 1 26 17 21 o 5  55.6748 3.7606  57.2267     10.6736  56.2119     10.0507  33.2145    326.395     12.8029     146.395     
1 1 1 26 17 22 o 7  48.1368 4.25212 47.2734     9.64097  38.8138     10.2377  19.5028    143.997     29.1171     323.997     
1 1 1 26 17 23 o 8  44.8768 4.38344 37.2907     9.11434  37.7847     10.0521  37.9565    306.403     18.2768     306.403     
1 1 1 26 17 24 o 14 20.2269 5.58953 1.93645     7.83949  7.96264     8.79006  1.32676    214.129     2.6993      34.1288     
1 1 1 26 17 25 o 5  105.986 2.82965 209.128     14.6683  195.631     15.294   94.1228    131.994     33.6852     131.994     
1 1 1 26 17 26 o 15 20.2909 5.61159 0.152761    7.67173  9.47767     9.33712  1.3775     338.137     16.1499     158.137     
1 1 1 26 17 27 o 4  34.4332 5.95889 26.4739     10.8877  20.3187     9.55206  22.6871    30.4606     10.8988     30.4606     
1 1 1 26 17 28 o 16 54.5953 3.95908 52.2194     9.97758  57.874      11.3827  33.1411    98.4498     10.8927     278.45      
1 1 1 26 17 29 o 18 45.5347 4.36713 50.9043     9.40032  28.231      9.29314  20.8261    282.81      21.9546     102.81      
1 1 1 26 17 30 o 12 52.9871 3.89305 50.5022     10.4219  53.1691     9.92067  31.892     34.327      10.8084     214.327     
1 1 1 26 17 31 o 8  58.2451 3.86391 52.1311     11.2968  73.7839     10.4924  33.143     136.689     16.4414     316.689     
1 1 1 26 17 32 o 14 15.3651 4.85484 -1.65713    7.76988  -3.31784    7.51959  7.0712     207.071     29.0324     207.071     
1 1 1 26 17 33 o 5  88.4338 3.16423 156.795     14.0709  128.053     13.7962  53.7631    206.694     20.1653     26.6939     
1 1 1 26 17 34 o 13 62.683  3.56995 77.244      10.759   67.1714     11.3705  42.2731    12.4306     4.39738     192.431     
1 1 1 26 17 35 o 5  23.321  5.7278  6.55582     8.3553   12.5025     8.32754  5.89768    195.363     15.6605     15.3632     
1 1 1 26 17 36 o 19 53.8487 3.86542 58.634      10.0874  49.2048     10.3731  31.3804    348.391     13.1379     168.391     
1 1 1 26 17 37 o 11 41.8806 4.72941 37.1309     9.44434  30.2621     9.64063  38.0676    86.7165     22.4746     86.7165     
1 1 1 26 17 38 o 5  41.403  4.86438 33.4447     9.788    32.7819     9.68996  35.3363    134.994     16.2608     134.994     
1 1 1 26 17 39 o 1  39.2528 5.20858 33.0755     10.0245  27.5892     9.70619  19.6105    195.712     14.5074     15.7123     
1 1 1 26 17 40 o 15 64.6415 3.47609 74.6417     11.2009  80.0099     11.1366  51.5307    320.588     12.1198     320.588     
1 1 1 26 17 41 o 8  51.1318 4.26922 49.258      11.0845  50.1897     10.3422  44.7626    283.863     19.635      283.863     
1 1 1 26 17 42 o 14 18.7011 5.48084 -1.57525    8.47409  6.67987     8.81224  4.56445    294.692     9.49888     114.692     
1 1 1 26 17 43 o 3  73.8674 3.29818 96.9495     12.0431  105.021     12.242   57.3635    84.2863     10.7732     84.2863     
1 1 1 26 17 44 o 12 55.7338 3.79001 63.4442     10.8927  53.8772     10.0169  39.4402    122.613     1.62505     122.613     
1 1 1 26 17 45 o 5  16.8645 5.17352 -0.461751   8.58255  1.2999      7.65911  2.09324    125.915     10.5559     305.915     
1 1 1 26 17 46 o 17 49.3581 4.19018 51.0214     10.6155  42.7543     9.69737  37.5514    123.425     8.20217     123.425     
1 1 1 26 17 47 o 9  61.1145 3.68817 76.3639     11.658   64.6602     10.7167  50.0048    267.34      16.2144     267.34      
1 1 1 26 17 48 o 8  39.0292 5.72368 28.7582     11.2492  34.4783     10.3878  19.7242    127.444     12.2088     307.444     
1 1 1 26 17 49 o 16 80.5914 3.59436 119.655     15.534   124.435     13.163   83.1252    180.344     56.5077     180.344     
1 1 1 26 17 50 o 2  15.0391 4.95772 -5.30938    9.95162  -6.39641    8.20645  0.396822   79.4053     10.2683     79.4053     
1 1 1 26 17 51 o 14 36.0434 6.2042  36.1212     12.1447  20.361      10.3866  28.8184    98.3882     17.3056     98.3882     
1 1 1 26 17 52 o 18 44.0546 5.53413 41.7926     12.9356  37.7812     10.568   41.6321    222.464     31.1395     222.464     
1 1 1 26 17 53 o 16 24.9331 6.42344 6.35068     10.9541  17.159      10.7101  10.7279    348.491     8.0033      168.491     
1 1 1 26 17 54 o 10 32.4249 6.78204 17.7713     13.0564  28.9293     11.4609  23.0652    165.631     7.61505     165.631     
1 1 1 26 17 55 o 4  33.4998 7.00904 23.7824     12.9967  27.9596     12.3293  22.4536    255.877     3.89721     255.877     
1 1 1 26 17 56 o 9  34.8478 6.99513 25.3703     13.5044  31.3425     12.3439  23.4392    31.4041     3.93914     31.4041     
1 1 1 26 17 57 o 14 26.3402 7.18663 18.4555     14.3512  12.5489     12.5291  7.27687    68.0994     3.62088     68.0994     
1 1 1 26 17 58 o 11 17.7909 5.88043 -29.2559    15.2896  3.88424     13.2316  1.50868    338.333     11.9221     158.333     
1 1 1 26 17 59 o 18 58.5212 6.03274 81.4236     18.8095  71.041      15.4746  48.1538    93.7969     20.39       93.7969     
1 1 1 26 17 60 o 12 17.4004 5.80056 -15.2617    15.7128  -1.5471     11.5404  0.684998   232.879     4.92777     52.8792     
1 1 1 26 17 61 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 18 0  o 1  20.9209 7.36529 11.8693     9.36583  11.8693     9.36583  3.63299    180         34.5613     180         
1 1 1 26 18 1  o 2  65.636  3.43321 86.8904     11.3008  69.7411     11.0399  41.7324    146.66      12.356      326.66      
1 1 1 26 18 2  o 19 105.595 2.89837 208.999     14.8552  191.887     15.69    89.6572    178.167     22.4163     178.167     
1 1 1 26 18 3  o 14 73.3878 3.35366 103.273     11.5034  91.7489     12.8648  34.7614    294.035     38.9051     114.035     
1 1 1 26 18 4  o 8  72.4769 3.33829 92.6295     11.5813  97.4615     12.5358  41.0704    253.76      24.5971     73.7602     
1 1 1 26 18 5  o 11 82.0597 3.12461 117.658     12.1833  125.264     13.4196  69.8099    279.944     19.2315     279.944     
1 1 1 26 18 6  o 3  84.7954 3.41338 129.239     12.802   130.934     15.9203  79.5091    277.686     35.0349     277.686     
1 1 1 26 18 7  o 15 63.1423 3.65753 79.3492     10.7216  66.0631     11.9654  40.7969    206.376     10.1684     26.3758     
1 1 1 26 18 8  o 9  93.0433 3.00533 155.443     13.3513  156.322     14.5755  98.7752    178.398     61.9761     178.398     
1 1 1 26 18 9  f 0  129.294 2.78383 303.074     17.9371  297.2       18.093   71.3254    326.741     0           0           
1 1 1 26 18 10 o 17 69.6501 3.35152 81.4197     11.5145  94.6239     11.7023  55.3569    67.9425     9.57175     67.9425     
1 1 1 26 18 11 o 3  44.4959 4.85732 34.9386     10.1746  39.4977     10.7906  34.0144    158.876     8.39345     158.876     
1 1 1 26 18 12 o 15 49.9649 4.21887 46.019      10.1814  46.2473     10.5263  30.6707    216.857     9.43044     36.8572     
1 1 1 26 18 13 o 7  25.2433 5.82739 8.77377     8.64647  14.3269     8.5559   3.76027    340.634     0.125592    160.634     
1 1 1 26 18 14 o 3  34.8623 5.28933 17.3773     8.91223  29.8305     9.1316   7.75832    125.455     32.3061     305.455     
1 1 1 26 18 15 o 15 20.6794 5.64546 4.50589     7.73126  6.93856     8.85892  1.9331     162.262     3.75502     342.262     
1 1 1 26 18 16 o 10 80.7955 3.02481 120.283     11.888   115.53      12.4939  51.1735    127.091     16.4949     307.091     
1 1 1 26 18 17 o 11 30.024  5.77391 14.8028     8.83787  20.2762     9.1079   16.2159    153.284     1.43423     153.284     
1 1 1 26 18 18 o 19 19.7487 5.5616  6.95363     7.64772  -0.193949   9.53182  3.48075    258.883     28.569      258.883     
1 1 1 26 18 19 o 1  35.9394 5.53981 19.974      9.26521  30.5573     10.2192  21.7352    296.565     3.05832     116.565     
1 1 1 26 18 20 o 14 46.0347 4.39332 43.9823     9.25093  35.3614     10.2169  31.9563    289.058     0.232529    289.058     
1 1 1 26 18 21 o 16 83.4124 3.16227 129.304     13.0087  122.864     13.3146  58.9964    144.649     4.15579     324.649     
1 1 1 26 18 22 o 14 17.1038 5.17063 2.65905     7.54313  -2.80684    8.48831  0.146865   293.355     4.74785     113.355     
1 1 1 26 18 23 o 14 33.4668 5.3599  31.5541     8.6118   12.3037     9.66131  16.4102    175.387     10.9688     355.387     
1 1 1 26 18 24 o 2  68.0511 3.46814 95.7637     11.2897  73.9512     11.9327  59.937     270.477     22.5413     270.477     
1 1 1 26 18 25 o 16 40.6831 4.90821 32.7841     9.08795  30.3215     10.1353  22.6407    279.42      10.5483     99.4198     
1 1 1 26 18 26 o 5  35.1021 5.36286 23.1458     8.79827  24.7905     9.51966  25.7633    215.882     10.8989     215.882     
1 1 1 26 18 27 o 17 29.3932 5.89693 9.82992     8.83495  24.237      10.112   14.7848    74.3644     5.92069     254.364     
1 1 1 26 18 28 o 7  48.2222 4.67684 47.4445     10.9581  40.5087     10.979   30.6954    307.405     6.08597     127.405     
1 1 1 26 18 29 o 19 30.3924 5.82067 19.2257     8.76294  17.2427     9.4467   18.8175    89.0979     2.92974     89.0979     
1 1 1 26 18 30 o 2  45.3076 4.59338 39.7538     9.6989   37.9441     10.5113  29.467     207.531     3.98112     27.5307     
1 1 1 26 18 31 o 17 38.016  5.34331 40.0714     9.49667  17.6679     10.0937  19.0634    26.6679     13.931      206.668     
1 1 1 26 18 32 f 0  34.8808 5.66852 26.893      9.52353  21.4129     9.9301   11.9637    30.0239     0           0           
1 1 1 26 18 33 o 18 85.9339 3.22878 133.794     13.3537  135.966     14.3436  59.138     320.359     6.17032     140.359     
1 1 1 26 18 34 o 17 35.3515 5.66871 20.746      9.56211  29.4392     10.1463  11.0685    279.815     26.6837     99.8154     
1 1 1 26 18 35 o 9  20.2083 5.8285  -1.88755    8.40659  9.72708     10.7155  3.2793     186.81      32.0751     186.81      
1 1 1 26 18 36 o 16 25.8652 6.11735 9.36193     9.26896  16.4641     9.681    14.6532    167.343     0.0750313   347.343     
1 1 1 26 18 37 o 16 51.7839 4.30024 46.3413     10.587   55.8118     11.2796  48.924     239.385     26.8547     239.385     
1 1 1 26 18 38 o 14 23.916  6.26542 8.93095     9.3597   11.5689     10.5828  2.80177    171.434     25.2389     351.434     
1 1 1 26 18 39 o 4  27.5827 6.23422 15.9117     9.3429   15.2028     10.1513  11.1732    255.767     13.2046     75.7674     
1 1 1 26 18 40 o 10 39.1511 5.24605 30.5872     10.0502  30.8005     9.78039  25.6244    142.287     1.73559     322.287     
1 1 1 26 18 41 o 13 35.923  5.73866 28.2521     10.4023  25.0477     9.779    26.2483    69.7811     5.83389     69.7811     
1 1 1 26 18 42 o 6  82.0299 3.28518 123.597     14.1666  126.053     12.6624  88.2742    303.495     61.9103     303.495     
1 1 1 26 18 43 o 18 14.7418 4.76466 -7.02316    8.74257  -1.41417    7.24949  0.154727   76.9889     11.3794     76.9889     
1 1 1 26 18 44 o 2  21.4283 5.94386 4.67812     10.4714  8.96867     8.51396  6.93089    176.137     0.304471    356.137     
1 1 1 26 18 45 o 10 21.929  6.04912 9.76193     10.3924  6.23037     8.79684  3.26321    287.626     33.9585     287.626     
1 1 1 26 18 46 o 13 20.338  5.87159 6.32844     10.2784  4.56156     8.62531  2.94886    229.904     16.0424     49.9045     
1 1 1 26 18 47 o 16 23.9723 6.22381 10.6865     10.7202  11.3976     8.97263  6.68942    160.57      1.80528     160.57      
1 1 1 26 18 48 o 14 29.5943 6.40219 20.9447     11.1948  17.1091     9.57148  18.9694    44.0599     8.58266     44.0599     
1 1 1 26 18 49 o 5  23.5511 6.21239 6.26391     11.304   13.1312     9.11967  10.7834    343.193     2.20701     343.193     
1 1 1 26 18 50 f 0  57.4847 4.49056 63.8664     13.2409  65.0271     12.1453  30.6721    353.654     0           0           
1 1 1 26 18 51 o 7  32.7156 6.38838 27.1734     11.5822  19.9332     10.1293  24.7654    153.144     10.5675     153.144     
1 1 1 26 18 52 o 11 22.0138 6.10871 2.67893     11.4827  11.5895     9.20898  9.63413    349.431     1.42241     349.431     
1 1 1 26 18 53 o 16 57.9266 4.73319 77.417      14.0622  57.3715     12.8026  50.6872    78.7474     23.4336     78.7474     
1 1 1 26 18 54 o 17 22.7255 6.46985 12.1121     12.6428  6.56433     9.92407  10.1846    163.412     1.54901     343.412     
1 1 1 26 18 55 o 14 21.1847 5.93869 -13.9118    12.0252  17.1824     10.9378  7.1111     2.02728     6.22592     182.027     
1 1 1 26 18 56 o 11 28.325  7.44802 26.1806     15.9681  14.6677     12.281   15.269     175.214     0.833072    175.214     
1 1 1 26 18 57 o 11 24.5304 7.47239 19.932      18.3959  3.91571     15.0195  8.7989     279.615     0.723608    99.6153     
1 1 1 26 18 58 o 15 20.1859 6.8904  -6.28336    26.3906  -6.93538    13.9207  2.91328    48.2003     4.55544     228.2       
1 1 1 26 18 59 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 19 0  o 3  74.0606 3.2858  99.2793     12.0838  99.2793     12.0838  50.9444    180         10.2615     360         
1 1 1 26 19 1  o 12 75.9864 3.30309 94.4721     12.4838  115.511     12.441   65.6486    222.859     19.7944     222.859     
1 1 1 26 19 2  o 8  26.0412 5.83256 12.0869     8.53219  13.3898     8.548    3.60382    75.572      25.5329     255.572     
1 1 1 26 19 3  o 2  18.4665 5.28907 5.44519     7.4465   -0.167473   8.12383  1.99186    284.775     21.1736     284.775     
1 1 1 26 19 4  o 8  44.6776 4.13608 33.5047     8.96367  40.7621     9.03401  38.0986    30.6404     16.8737     30.6404     
1 1 1 26 19 5  o 13 51.4634 3.74851 49.3144     9.59147  47.944      9.46724  36.9579    131.215     0.606963    131.215     
1 1 1 26 19 6  o 11 20.0759 5.24061 11.961      7.65675  -8.5222     9.34575  1.16724    323.238     16.4583     143.238     
1 1 1 26 19 7  o 6  44.5768 4.47425 40.9598     9.45789  33.5661     9.82868  38.6941    56.2186     18.9435     56.2186     
1 1 1 26 19 8  o 4  49.369  4.23874 46.8601     9.46368  43.6518     10.9245  31.2604    210.997     7.878       30.9974     
1 1 1 26 19 9  o 4  65.6116 3.44787 75.8949     11.2971  80.996      11.2003  66.0327    93.5517     38.8587     93.5517     
1 1 1 26 19 10 o 9  17.1352 5.17817 -0.458223   7.42108  1.46761     8.3332   0.0492957  136.658     4.23845     316.658     
1 1 1 26 19 11 o 13 43.1748 5.07086 43.6474     10.0465  28.0064     10.6799  24.003     114.502     12.5755     294.502     
1 1 1 26 19 12 o 18 26.2538 5.85083 2.22297     7.97762  23.3247     10.9842  11.2763    242.297     2.24598     62.2973     
1 1 1 26 19 13 o 15 69.5885 3.61532 96.9834     11.7026  80.3408     13.0518  49.6227    104.715     2.71961     284.715     
1 1 1 26 19 14 o 2  20.1637 5.74525 1.66601     8.09967  6.85608     9.81463  2.96918    286.142     6.83803     106.142     
1 1 1 26 19 15 o 10 41.3808 5.266   39.2344     9.66066  26.9049     11.0222  26.7167    278.166     3.40277     98.1655     
1 1 1 26 19 16 o 11 54.1613 4.25621 51.4936     10.569   57.6395     12.1506  35.8542    330.655     6.09961     150.655     
1 1 1 26 19 17 o 1  46.4141 5.03702 34.0482     10.4761  48.5547     12.1812  36.449     196.726     8.92844     196.726     
1 1 1 26 19 18 o 18 79.2899 3.37765 105.012     12.4759  124.409     14.2618  71.6599    197.02      27.5766     197.02      
1 1 1 26 19 19 o 8  74.6662 3.22026 99.0979     11.3523  103.625     12.6204  63.0749    314.798     17.2848     314.798     
1 1 1 26 19 20 o 19 55.5444 3.93862 61.3519     10.346   52.83       11.1324  38.25      146.185     3.23875     326.185     
1 1 1 26 19 21 o 15 24.6966 6.01214 7.7535      8.98663  14.0164     9.30173  9.89094    298.927     2.22948     118.926     
1 1 1 26 19 22 o 19 42.1095 5.06032 26.9535     9.90216  41.7461     10.5267  31.4698    34.5126     5.83859     34.5126     
1 1 1 26 19 23 o 3  44.2783 4.62621 35.4674     9.17913  38.7884     10.7218  27.6666    127.886     6.61836     307.886     
1 1 1 26 19 24 o 9  56.1507 3.80763 51.7158     10.184   65.1503     10.9396  40.7656    33.0095     1.16514     33.0098     
1 1 1 26 19 25 o 18 23.5868 5.81497 12.6958     8.19277  6.30893     9.18528  7.6534     54.4894     0.523413    54.4894     
1 1 1 26 19 26 o 9  50.8702 4.35421 50.7599     9.99707  46.4337     11.5517  34.7119    86.4876     2.88328     266.488     
1 1 1 26 19 27 o 18 40.9259 5.29423 26.347      9.52272  39.4649     11.4295  25.521     52.8996     5.67558     232.9       
1 1 1 26 19 28 o 2  82.2202 3.54798 133.59      14.9246  115.102     14.1586  79.1663    145.656     39.2029     145.656     
1 1 1 26 19 29 o 13 52.9178 4.33028 46.2349     10.5803  59.7297     11.9494  46.0923    220.121     17.6742     220.121     
1 1 1 26 19 30 o 13 18.9964 5.57248 0.756634    8.15927  5.1379      9.30826  3.71815    123.334     12.9908     303.334     
1 1 1 26 19 31 o 19 40.4281 5.16026 35.2673     9.4142   28.8438     10.5698  29.4279    107.65      3.30552     107.65      
1 1 1 26 19 32 o 19 56.8883 3.9913  51.2907     10.6094  70.9033     11.7593  31.5837    120.337     18.6715     300.337     
1 1 1 26 19 33 o 11 66.0417 3.91025 91.8441     11.61    71.9445     13.4815  56.3048    62.3082     18.0073     62.3082     
1 1 1 26 19 34 o 14 33.093  6.2241  22.4408     9.20914  23.0365     11.8817  21.3117    181.427     1.02864     1.42656     
1 1 1 26 19 35 o 3  52.361  4.39409 58.6708     10.5007  46.6131     11.7009  35.437     217.474     3.41536     37.474      
1 1 1 26 19 36 o 12 40.7956 5.37329 40.9707     9.92196  26.3684     10.9396  38.2654    130.025     24.4387     130.025     
1 1 1 26 19 37 o 18 35.0515 5.87077 20.2383     9.54934  31.2355     10.9059  25.7691    90.3451     5.72088     90.3451     
1 1 1 26 19 38 o 4  28.3123 5.99583 7.32172     9.10971  26.0693     10.6501  16.9176    59.9931     1.17962     239.993     
1 1 1 26 19 39 o 14 54.7431 4.13463 60.24       10.873   54.5724     11.3874  58.7477    201.503     45.154      201.503     
1 1 1 26 19 40 o 6  49.2162 4.90318 55.9739     11.7457  40.4016     11.4997  40.7373    302.662     13.9062     302.662     
1 1 1 26 19 41 o 5  38.074  5.9879  41.1046     11.1993  20.851      11.5163  28.8014    21.9336     8.02576     21.9336     
1 1 1 26 19 42 o 11 16.6459 5.33075 -2.65445    9.79026  -2.77996    9.33852  1.57717    286.003     3.78259     106.003     
1 1 1 26 19 43 o 18 65.7785 4.1545  86.9886     14.0807  79.4595     13.0274  58.209     357.683     24.9637     357.683     
1 1 1 26 19 44 o 1  36.5768 6.31327 26.9942     11.943   30.8975     11.0613  29.0816    198.83      17.3008     198.83      
1 1 1 26 19 45 o 16 39.4144 5.82042 35.9104     12.0579  29.4684     10.2127  19.0088    251.162     15.1878     71.1624     
1 1 1 26 19 46 o 12 73.4413 3.80367 111.453     14.7337  93.6825     13.0862  64.6377    127.588     26.7763     127.588     
1 1 1 26 19 47 o 8  18.1747 5.64155 1.61546     10.906   -0.244582   8.75768  3.02564    5.78372     0.862341    185.784     
1 1 1 26 19 48 o 6  43.4638 5.61718 43.8457     12.8932  34.7729     10.7079  35.4538    353.544     13.1448     353.544     
1 1 1 26 19 49 o 5  32.7163 6.55945 19.4623     12.351   27.9929     10.7397  20.5491    101.956     0.675944    281.956     
1 1 1 26 19 50 o 19 30.4061 6.8514  24.5989     12.9549  17.9822     10.5859  17.2682    283.843     3.62384     103.843     
1 1 1 26 19 51 o 10 44.0088 6.18834 56.4907     14.7935  30.2248     11.7175  32.0634    279.88      5.59816     279.88      
1 1 1 26 19 52 o 9  26.6162 6.84722 20.9661     13.4161  11.7026     10.2648  15.3893    181.553     3.22102     181.553     
1 1 1 26 19 53 o 14 28.8786 6.98479 25.6606     13.7657  15.3649     10.6028  17.3148    290.617     7.11426     290.617     
1 1 1 26 19 54 o 18 20.1861 6.44713 3.66318     16.0593  0.756749    11.4733  1.58135    159.116     0.534977    339.116     
1 1 1 26 19 55 o 7  20.0357 6.48409 -54.1285    29.6946  7.94322     11.1567  3.88912    172.632     5.45202     352.632     
1 1 1 26 19 56 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 19 57 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 20 0  o 5  140.755 2.55524 354.167     17.9974  354.167     17.9974  103.294    6.26229e-06 7.03539     180         
1 1 1 26 20 1  o 13 18.4751 5.30559 1.89242     7.78586  4.32337     7.63586  0.986821   313.891     2.8965      133.891     
1 1 1 26 20 2  o 5  27.5178 5.72579 17.3565     8.19931  11.7246     8.93651  13.3716    116.179     4.86251     296.179     
1 1 1 26 20 3  o 8  27.5044 5.90278 14.5011     8.48122  14.7647     9.21936  13.5029    77.0015     4.04346     257.001     
1 1 1 26 20 4  o 12 98.252  2.95152 173.298     14.0383  175.797     14.9515  78.6211    60.0858     10.2901     60.0857     
1 1 1 26 20 5  o 13 16.855  5.10369 4.37322     7.80262  -7.95574    8.6782   1.52641    324.03      16.8438     324.03      
1 1 1 26 20 6  o 16 53.4139 4.04483 56.6309     10.2144  49.2219     10.9636  52.1765    40.9878     30.4042     40.9878     
1 1 1 26 20 7  o 18 19.0914 5.61012 2.4524      8.22454  2.72927     9.45364  1.04136    12.6453     22.2539     12.6453     
1 1 1 26 20 8  o 11 40.0427 4.92734 30.794      8.89122  30.4729     10.1242  31.6465    354.176     10.0814     354.176     
1 1 1 26 20 9  o 18 88.8157 3.01018 146.886     12.5963  138.872     14.0271  69.3674    258.367     6.47439     258.367     
1 1 1 26 20 10 o 9  21.4555 5.72388 7.83981     7.94136  5.82025     8.94719  3.68158    273.391     15.6311     93.3909     
1 1 1 26 20 11 o 5  94.4541 2.93043 166.753     13.7782  156.096     13.8806  80.379     56.1976     20.1781     56.1975     
1 1 1 26 20 12 o 2  84.3551 3.09012 130.863     12.2654  127.33      13.7035  79.3908    31.8672     34.3287     31.8672     
1 1 1 26 20 13 f 0  48.3267 4.34025 47.2739     9.82343  40.2952     10.5586  44.4627    296.685     0           0           
1 1 1 26 20 14 o 15 19.7108 5.629   1.53343     7.88753  6.54428     9.36642  3.26903    50.7114     5.1246      230.711     
1 1 1 26 20 15 o 10 30.5095 5.69362 12.4083     8.62768  24.5701     9.50084  19.1093    184.839     2.15514     184.839     
1 1 1 26 20 16 o 4  69.7371 3.56553 85.1922     11.8038  93.2125     12.9555  58.3112    206.981     14.6078     206.981     
1 1 1 26 20 17 o 8  39.707  5.67761 31.6962     10.079   30.1681     11.7029  19.2796    299.802     17.2013     119.802     
1 1 1 26 20 18 o 8  102.798 3.06247 184.602     15.4071  199.129     16.077   91.4301    130.179     30.2922     130.179     
1 1 1 26 20 19 o 16 37.0596 5.89102 27.9853     9.91374  26.5384     11.4418  12.5184    75.9159     27.1078     255.916     
1 1 1 26 20 20 o 12 94.2708 3.18374 169.071     14.5833  154.672     15.3395  79.485     324.312     19.4445     324.312     
1 1 1 26 20 21 o 14 43.7256 5.39823 38.6734     11.4095  35.78       11.3799  33.9657    335.424     7.22049     335.424     
1 1 1 26 20 22 o 14 18.7759 5.6336  5.20361     8.88371  -4.8766     10.3717  3.64244    266.463     3.7285      86.4633     
1 1 1 26 20 23 o 12 22.7821 6.04473 10.8541     9.51805  5.58169     9.36891  9.81233    329.104     0.972072    149.104     
1 1 1 26 20 24 f 0  57.0158 4.14242 49.5217     11.2343  73.4019     11.784   35.2909    220.516     0           0           
1 1 1 26 20 25 o 18 40.4162 5.1747  28.5361     9.51918  35.5438     10.6857  34.8554    249.537     14.9957     249.537     
1 1 1 26 20 26 o 1  70.4124 3.5336  90.8127     11.9031  92.3353     12.8583  48.6334    253.498     5.85387     73.4978     
1 1 1 26 20 27 o 19 47.7925 4.53715 44.1463     9.9258   43.2063     11.1815  35.8264    244.98      3.69579     244.98      
1 1 1 26 20 28 o 7  30.7199 6.29313 16.2469     9.06518  23.0067     11.466   22.6535    16.3205     7.88129     16.3205     
1 1 1 26 20 29 o 3  23.4292 5.95772 0.518       9.7985   16.468      9.76397  12.19      314.971     1.11894     134.971     
1 1 1 26 20 30 o 9  46.4833 5.11119 48.4492     10.1329  36.7596     12.2468  26.2304    297.245     13.9148     117.245     
1 1 1 26 20 31 o 16 23.5971 6.09561 10.0843     8.78889  10.293      9.99473  12.7937    95.2152     2.0475      95.2152     
1 1 1 26 20 32 o 5  37.1982 5.67724 29.6827     9.65532  26.9137     10.8861  25.156     323.225     0.610669    143.225     
1 1 1 26 20 33 o 4  17.0735 5.39145 -3.42271    8.74569  0.267784    10.0372  3.62957    270.95      6.20585     90.9498     
1 1 1 26 20 34 f 0  31.2071 6.26905 18.3019     9.8602   23.2492     10.7165  24.6488    274.374     0           0           
1 1 1 26 20 35 o 18 47.8719 5.04077 38.4296     11.3848  53.265      11.8603  28.6       329.328     10.5239     149.328     
1 1 1 26 20 36 o 14 28.3567 6.46491 20.1058     10.4642  13.9471     10.7066  16.8931    238.481     1.25115     58.4813     
1 1 1 26 20 37 o 7  35.3023 6.37142 25.5453     11.5746  28.2332     11.0793  29.0607    287.952     18.4566     287.952     
1 1 1 26 20 38 o 19 16.8861 5.26159 -12.9719    9.77218  5.22875     9.16338  2.32336    86.7241     4.13299     266.724     
1 1 1 26 20 39 o 16 23.8191 6.42076 12.0798     10.4992  8.74303     10.8823  8.95159    264.108     2.25496     264.108     
1 1 1 26 20 40 o 7  15.1859 5.02564 -7.54273    9.91914  -5.97014    9.19653  0.313529   98.7757     7.05315     278.776     
1 1 1 26 20 41 o 10 17.3853 5.49548 0.913153    9.90799  -3.69412    9.7931   1.1131     123.834     13.772      303.834     
1 1 1 26 20 42 o 16 48.1275 5.34456 51.4754     12.3135  43.0542     12.5042  39.1872    79.1118     12.9168     79.1118     
1 1 1 26 20 43 o 6  52.9355 5.16072 67.2635     13.1499  46.3871     13.0322  50.2815    157.05      28.8881     157.05      
1 1 1 26 20 44 o 7  31.9627 6.64928 25.5269     11.4871  19.7738     11.3763  21.9134    280.085     3.69714     280.085     
1 1 1 26 20 45 o 5  32.3035 6.61968 15.5599     12.292   30.4785     11.5385  16.7423    49.8449     9.12634     229.845     
1 1 1 26 20 46 o 6  20.7872 6.24749 8.69833     12.0998  -0.401401   10.8882  8.78815    314.974     1.41734     134.974     
1 1 1 26 20 47 o 7  21.2185 6.30255 -0.903072   12.2014  10.0011     11.2969  9.22835    290.12      0.480346    110.12      
1 1 1 26 20 48 o 14 23.9834 6.73369 11.9358     12.6206  10.0086     11.5278  12.6321    140.835     0.366794    320.835     
1 1 1 26 20 49 o 6  17.2929 5.73172 0.989981    14.4939  -9.77665    9.35103  2.65359    176.541     11.3879     356.541     
1 1 1 26 20 50 o 6  31.6454 7.4535  27.3478     17.4051  23.3839     10.9608  20.1158    24.1562     2.12323     24.1562     
1 1 1 26 20 51 o 8  20.8118 6.44438 5.90659     15.7136  4.3605      9.90109  6.35062    171.209     4.57412     351.209     
1 1 1 26 20 52 o 9  14.5591 5.06491 -12.5052    14.0676  -19.5707    10.5207  3.40963    73.1727     18.7653     73.1727     
1 1 1 26 20 53 o 15 27.7364 7.89991 18.1473     17.0659  23.3698     16.8204  11.5588    355.762     3.46111     355.762     
1 1 1 26 20 54 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 20 55 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 21 0  o 6  110.189 2.87986 218.146     15.8533  218.146     15.8533  83.525     180         0.569199    8.61066e-06 
1 1 1 26 21 1  o 13 46.7608 4.789   49.0508     11.0857  34.6707     10.5159  28.264     4.42274     10.9959     184.423     
1 1 1 26 21 2  o 12 47.959  4.24402 38.708      9.54916  47.7019     10.3857  41.0443    161.779     14.4104     161.779     
1 1 1 26 21 3  o 2  63.611  3.56185 66.2531     10.898   82.8205     11.5779  59.797     217.082     26.9439     217.082     
1 1 1 26 21 4  o 10 27.1873 5.57646 21.9388     8.45889  4.79409     9.58832  15.115     133.625     2.41347     133.625     
1 1 1 26 21 5  o 9  26.0381 5.84951 16.1285     8.27892  9.1809      9.41985  12.0299    17.6535     2.86289     17.6535     
1 1 1 26 21 6  o 4  87.0828 3.02512 136.626     12.7369  138.742     13.5773  81.7873    265.325     33.9093     265.325     
1 1 1 26 21 7  o 11 46.2794 4.50881 39.2922     9.43428  41.6564     10.8973  35.168     304.316     4.47741     304.316     
1 1 1 26 21 8  o 6  31.6415 5.87859 18.7495     9.27689  21.1584     9.61778  13.0566    228.599     17.0474     48.5992     
1 1 1 26 21 9  o 11 52.755  4.19628 48.7388     10.3788  55.4411     11.4333  41.1979    56.9164     6.02599     56.9163     
1 1 1 26 21 10 o 2  30.4228 5.90637 22.6132     9.08608  13.9766     9.9238   16.0937    342.623     7.81093     162.623     
1 1 1 26 21 11 o 17 28.1259 6.15181 11.3793     9.26126  19.7567     10.1436  16.9447    115.55      5.28942     115.55      
1 1 1 26 21 12 o 13 27.5186 6.09171 12.7625     8.81888  17.0075     9.89498  6.37742    115.269     24.3509     295.269     
1 1 1 26 21 13 o 18 47.1026 4.61741 41.3743     10.1608  42.9044     11.0438  12.9545    66.7668     43.233      246.767     
1 1 1 26 21 14 o 9  47.2454 4.83519 49.9729     9.81495  35.8063     11.654   33.8734    254.897     0.145458    74.8974     
1 1 1 26 21 15 o 2  47.742  4.92988 50.6931     10.3397  37.1487     11.9216  31.7545    183.34      5.46078     3.34012     
1 1 1 26 21 16 o 16 78.7624 3.40187 119.313     12.8943  108.41      13.7441  72.1399    20.306      27.7266     20.306      
1 1 1 26 21 17 o 15 72.438  3.41772 93.622      11.8912  99.2955     12.7822  64.1338    63.7047     21.3883     63.7047     
1 1 1 26 21 18 o 1  48.7693 4.42766 41.0065     10.1307  49.4668     11.0015  35.6821    297.182     0.894462    297.182     
1 1 1 26 21 19 o 18 19.0824 5.55004 5.69034     8.13647  0.0358085   9.30777  3.1829     175.929     15.719      355.929     
1 1 1 26 21 20 o 4  95.026  3.09689 156.041     13.916   174.307     15.511   81.1309    112.583     20.8671     112.583     
1 1 1 26 21 21 o 7  74.7173 3.48076 105.363     13.0092  100.866     12.9092  59.6978    189.066     8.98692     189.066     
1 1 1 26 21 22 o 10 65.6882 3.64693 76.0329     11.2319  84.4694     12.5933  58.1219    6.3563      20.1439     6.3563      
1 1 1 26 21 23 o 12 48.4922 5.00291 55.3625     10.349   36.9583     12.2344  41.3396    63.6693     13.6508     63.6693     
1 1 1 26 21 24 o 3  23.054  6.20753 12.0334     9.4719   4.14621     11.1247  9.34809    207.184     3.24359     207.184     
1 1 1 26 21 25 o 9  24.4492 5.93047 19.7969     9.78858  -3.07894    11.0958  14.0399    15.7806     0.0375499   15.78       
1 1 1 26 21 26 f 0  59.1003 4.45129 70.6079     12.727   63.5131     13.1577  27.4929    72.9778     0           0           
1 1 1 26 21 27 o 15 56.7269 4.49017 52.7671     11.9166  71.9307     13.0621  46.0322    64.0418     10.0733     64.0418     
1 1 1 26 21 28 o 15 116.047 3.11679 247.464     17.5617  248.708     18.6092  97.7393    47.8718     23.9034     47.8718     
1 1 1 26 21 29 o 11 23.1477 6.41128 8.43394     10.4075  9.3055      11.2223  11.8796    70.1838     0.953248    70.1838     
1 1 1 26 21 30 o 12 17.5677 5.38018 5.40293     8.60706  -9.27419    10.3144  0.671476   140.361     18.858      320.361     
1 1 1 26 21 31 o 15 41.4045 5.94692 33.8995     11.2702  37.7898     12.5717  29.3802    298.786     1.17613     298.786     
1 1 1 26 21 32 f 0  51.2569 5.21382 59.8449     12.3332  45.9004     13.2432  62.0524    194.158     0           0           
1 1 1 26 21 33 o 15 44.6685 5.61434 42.7055     11.8688  39.3893     12.3147  33.0889    108.909     3.87321     108.909     
1 1 1 26 21 34 o 18 17.9191 5.56713 1.79638     9.75581  -1.42697    9.56955  3.76779    353.664     8.15626     173.664     
1 1 1 26 21 35 o 8  17.2283 5.45443 -0.773938   9.77542  -2.07018    9.61932  6.95199    19.8394     34.9184     19.8394     
1 1 1 26 21 36 o 10 71.1277 4.41699 101.263     16.3239  95.6214     14.8363  55.0917    5.72344     8.04808     5.72344     
1 1 1 26 21 37 o 4  49.9524 5.20525 45.4524     12.5263  55.8545     12.6287  38.6129    105.33      7.79837     105.33      
1 1 1 26 21 38 o 15 19.3444 5.87278 4.93216     10.4878  0.137307    10.0629  2.21743    77.658      0.729066    257.658     
1 1 1 26 21 39 o 14 29.1423 6.87254 20.6926     12.1834  17.048      11.3741  14.7294    87.6837     7.57808     267.684     
1 1 1 26 21 40 f 0  25.5697 6.68724 14.579      11.6384  12.002      11.0782  25.9719    243.597     0           0           
1 1 1 26 21 41 o 3  43.7447 6.08186 52.2237     13.2663  30.3581     12.4382  33.7098    276.745     7.60165     276.745     
1 1 1 26 21 42 o 5  22.1403 6.46175 0.0957586   12.1089  11.863      11.9313  8.94249    22.4797     7.97881     202.48      
1 1 1 26 21 43 f 0  18.3253 5.87083 -4.14622    11.8608  -0.20851    11.4594  4.09598    83.0497     0           0           
1 1 1 26 21 44 o 5  27.1422 7.33519 -1.58824    15.8318  27.6374     15.4444  15.9558    37.1866     0.518633    217.186     
1 1 1 26 21 45 o 2  61.5131 6.06045 91.5999     18.8499  71.8662     17.4111  46.9318    230.551     7.69618     230.551     
1 1 1 26 21 46 o 4  20.8556 6.93068 0.811563    20.8657  -8.87416    15.2821  7.45966    96.0486     0.371686    276.049     
1 1 1 26 21 47 o 15 40.6244 8.27759 50.8858     17.699   37.7137     18.5135  31.6439    62.6786     11.1131     62.6786     
1 1 1 26 21 48 o 3  18.078  5.99009 -28.4856    15.3808  4.81128     14.0817  0.399026   106.53      0.287622    286.53      
1 1 1 26 21 49 o 15 24.9767 7.5414  7.73666     16.6811  18.4511     17.0576  10.719     17.7687     4.41939     197.769     
1 1 1 26 21 50 o 5  38.4241 8.57051 35.3232     19.0889  53.0684     18.9067  27.5437    126.753     8.51157     126.753     
1 1 1 26 21 51 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 21 52 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 22 0  o 10 22.4888 7.58555 14.1234     9.78206  14.1234     9.78206  0.614936   180         0.224989    180         
1 1 1 26 22 1  o 18 34.6516 5.90232 23.8504     10.132   24.5841     10.1236  25.5062    127.186     4.02505     127.186     
1 1 1 26 22 2  o 12 66.602  3.65585 76.4902     12.0441  87.7975     12.1239  49.1473    69.588      1.14595     249.588     
1 1 1 26 22 3  o 6  79.3258 3.43638 124.455     13.8592  107.236     13.3072  63.8003    327.657     8.55837     327.657     
1 1 1 26 22 4  o 13 54.4947 4.20648 51.3371     11.2742  60.5713     11.2446  43.0248    350.36      5.90087     350.36      
1 1 1 26 22 5  o 6  57.8398 3.97043 62.9645     10.7598  62.0473     11.916   33.9753    164.141     18.165      344.141     
1 1 1 26 22 6  o 8  57.1034 3.93778 57.0744     10.7673  64.8699     11.4828  53.239     344.596     22.9591     344.596     
1 1 1 26 22 7  o 8  38.2561 5.41024 31.6699     9.25578  26.2876     10.6871  25.8354    214.894     2.58174     34.8939     
1 1 1 26 22 8  o 5  21.224  5.63692 -4.06765    8.36678  14.5764     9.78566  2.46649    74.8605     22.5421     254.861     
1 1 1 26 22 9  o 7  28.8515 6.07485 16.9936     8.9563   16.6311     9.94403  18.1049    242.546     1.44599     62.5457     
1 1 1 26 22 10 o 1  25.8789 6.07315 10.9877     8.69439  15.2046     9.73693  16.1802    274.898     2.76018     274.898     
1 1 1 26 22 11 o 7  78.1383 3.44421 123.473     12.9404  102.169     13.6999  69.4243    230.966     22.137      230.966     
1 1 1 26 22 12 o 11 86.9721 3.22006 134.014     13.2524  143.688     14.7172  80.968     236.996     31.7697     236.996     
1 1 1 26 22 13 o 18 69.7655 3.53285 97.272      11.7282  83.2201     12.64    55.7922    337.663     7.68133     337.663     
1 1 1 26 22 14 o 19 25.5939 6.29184 8.28647     9.1003   17.0023     10.9075  3.08639    259.015     42.0672     259.015     
1 1 1 26 22 15 o 13 48.7025 4.99416 46.5137     11.6968  45.9851     11.9662  45.5477    320.843     21.5961     320.843     
1 1 1 26 22 16 o 12 104.114 3.06719 193.335     15.3986  204.023     16.5387  90.1401    159.553     24.0117     159.553     
1 1 1 26 22 17 o 19 20.4431 5.78063 -1.79376    8.77252  10.9144     10.0141  8.52674    220.734     3.28466     40.7342     
1 1 1 26 22 18 o 16 54.4914 4.36992 61.7598     11.0735  51.9963     12.1139  24.8172    158.702     31.0225     338.702     
1 1 1 26 22 19 o 19 42.841  5.76568 44.4219     10.4616  30.5073     12.9512  32.9001    319.302     4.81153     319.302     
1 1 1 26 22 20 o 13 40.0428 5.58409 32.026      9.93722  33.0789     11.652   22.5245    272.265     12.4629     92.2645     
1 1 1 26 22 21 o 12 39.9429 5.79219 43.9408     11.4608  22.8429     11.0623  25.6376    310.058     5.63082     130.058     
1 1 1 26 22 22 o 14 26.9262 6.12823 19.4625     9.29744  9.36189     10.432   15.6556    291.674     8.96614     291.674     
1 1 1 26 22 23 o 18 22.9807 5.9982  13.2486     8.93236  4.43085     10.1743  10.2923    21.3241     7.43566     201.324     
1 1 1 26 22 24 o 6  57.7742 4.33824 79.7346     11.4359  50.2371     12.3093  46.1785    53.0762     8.11181     53.0762     
1 1 1 26 22 25 o 19 19.402  5.75754 3.27527     9.01142  3.82776     9.88557  6.5811     187.337     1.7113      7.33661     
1 1 1 26 22 26 f 0  58.9452 4.58501 73.8261     12.6356  61.9355     13.7131  53.5816    248.231     0           0           
1 1 1 26 22 27 o 19 56.5014 4.838   67.8709     12.5231  58.2898     13.9839  46.1727    219.251     10.6747     219.251     
1 1 1 26 22 28 f 0  68.9841 4.76727 94.4122     14.4816  92.6636     17.7413  33.7799    268.57      0           0           
1 1 1 26 22 29 o 19 31.7403 7.02399 26.3037     11.1339  17.726      14.9774  23.0778    134.441     6.6637      134.441     
1 1 1 26 22 30 o 7  30.2136 7.08246 19.1545     12.8609  21.6492     12.2193  14.2897    66.2881     9.32976     66.2881     
1 1 1 26 22 31 o 1  26.817  7.42905 17.2591     16.4223  12.0529     12.5846  13.7294    168.014     4.84351     348.014     
1 1 1 26 22 32 o 10 54.3011 5.92664 65.9104     15.7756  57.7242     15.4052  43.8336    26.5527     10.703      26.5527     
1 1 1 26 22 33 f 0  41.3624 6.86866 30.1934     15.2399  46.7681     13.2912  18.8502    286.978     0           0           
1 1 1 26 22 34 o 4  41.1425 6.52423 46.9512     14.1491  28.3924     12.3259  31.3312    60.1006     6.9645      60.1006     
1 1 1 26 22 35 o 4  56.0959 5.8787  69.04       15.1654  62.6268     16.6643  60.9412    205.326     48.2404     205.326     
1 1 1 26 22 36 o 10 23.3129 6.46743 4.83937     11.5105  13.4311     11.0886  5.02113    214.613     19.5669     34.6129     
1 1 1 26 22 37 o 3  60.2071 5.22606 73.0345     15.5654  73.7497     15.3055  54.1428    355.325     22.873      355.325     
1 1 1 26 22 38 o 11 16.1348 5.34889 -5.23498    11.1933  -9.38167    10.602   3.2995     141.631     4.27347     321.631     
1 1 1 26 22 39 o 1  29.8279 7.5893  24.6194     16.2342  17.1245     12.6949  21.2641    243.208     6.84881     243.208     
1 1 1 26 22 40 f 0  46.3876 7.93931 39.48       19.9527  66.1339     17.8549  18.835     202.81      0           0           
1 1 1 26 22 41 o 19 37.7412 7.80636 20.7584     17.4928  50.3071     16.8315  18.9499    261.992     13.7978     81.9921     
1 1 1 26 22 42 o 9  30.3775 8.70517 28.5674     25.4206  20.3923     16.2626  20.5383    207.857     10.9627     207.857     
1 1 1 26 22 43 o 14 23.6818 7.24659 15.4525     16.4865  -0.389226   15.8605  11.8279    14.47       1.66982     194.47      
1 1 1 26 22 44 f 0  25.2115 7.55627 12.4074     17.0051  13.2922     16.1112  5.09948    339.826     0           0           
1 1 1 26 22 45 o 15 43.5322 8.18569 61.1632     18.4409  41.999      18.696   38.0808    139.382     21.1785     139.382     
1 1 1 26 22 46 o 1  33.057  7.96268 48.0149     18.0087  12.2852     17.8182  22.2784    259.747     5.53344     259.747     
1 1 1 26 22 47 o 6  19.9713 6.3988  15.302      15.4765  -27.8365    15.3584  4.52539    47.139      5.2477      227.139     
1 1 1 26 22 48 o 3  24.9193 7.65664 17.7356     17.5475  10.0377     18.3669  8.35473    203.152     0.516753    203.152     
1 1 1 26 22 49 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 22 50 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 23 0  o 18 18.2727 7.23787 9.19149     9.96091  9.19149     9.96091  5.3773     180         0.95659     0.00014473  
1 1 1 26 23 1  f 0  26.6473 6.31161 16.0998     9.97405  12.4042     9.96696  7.62708    281.476     0           0           
1 1 1 26 23 2  o 9  18.7852 5.6724  0.0177154   9.29547  3.57271     9.65658  1.10573    137.16      21.3428     317.16      
1 1 1 26 23 3  o 4  26.0822 6.29829 16.405      10.1017  10.4502     9.89015  6.31624    148.445     23.4394     328.445     
1 1 1 26 23 4  o 8  46.2542 4.92798 44.5112     11.1544  39.4087     10.9583  33.2815    201.072     1.22389     21.0715     
1 1 1 26 23 5  o 18 55.2323 4.37207 65.8226     11.6469  51.3534     11.8972  44.7175    354.006     7.64686     354.006     
1 1 1 26 23 6  o 16 96.5256 3.19887 166.336     15.6734  177.1       15.1518  85.7308    145.373     25.5434     145.373     
1 1 1 26 23 7  o 14 19.1353 5.50785 8.27412     8.30517  -3.58542    9.52533  7.16415    83.1588     3.39459     263.159     
1 1 1 26 23 8  o 19 50.8787 4.6514  51.6124     10.4939  48.7632     12.4442  44.9671    307.296     15.5859     307.296     
1 1 1 26 23 9  o 6  81.7878 3.41652 123.737     14.0005  124.609     13.8805  78.2626    212.536     33.7847     212.536     
1 1 1 26 23 10 o 2  23.8554 6.15025 9.72924     9.05644  11.5268     10.0326  11.4924    106.66      5.07716     106.66      
1 1 1 26 23 11 o 7  59.8506 3.97379 60.0911     11.0195  76.1241     12.5437  62.1625    40.381      36.7291     40.381      
1 1 1 26 23 12 o 9  39.004  5.4415  28.5438     9.78714  33.2553     10.7407  23.0466    174.71      10.2992     354.71      
1 1 1 26 23 13 o 8  76.1516 3.79679 105.065     13.0941  113.319     15.6485  64.2139    105.695     14.359      105.695     
1 1 1 26 23 14 o 10 60.9729 4.05785 74.3661     12.1824  67.2519     12.2858  45.0462    325.275     0.610114    145.275     
1 1 1 26 23 15 o 2  60.9807 3.99256 69.8063     11.2946  71.6008     12.787   51.7673    83.6451     13.2712     83.6451     
1 1 1 26 23 16 o 19 52.106  4.42202 55.8605     10.6746  49.387      11.7663  35.7027    301.091     5.39504     121.091     
1 1 1 26 23 17 o 2  18.3689 5.51944 -5.08038    8.46898  7.64184     9.93908  5.80841    198.182     3.08227     18.1817     
1 1 1 26 23 18 o 8  55.6431 4.29374 65.2575     11.0599  54.458      12.1994  33.5099    10.2915     15.3575     190.291     
1 1 1 26 23 19 o 6  22.9713 6.1226  10.9105     9.15028  8.0009      10.2203  11.4414    180.86      4.03284     0.859741    
1 1 1 26 23 20 o 11 19.4448 5.76459 7.45739     9.24049  -2.73932    10.5666  2.36644    53.0803     19.3506     233.08      
1 1 1 26 23 21 o 10 21.9215 6.43191 5.09847     10.4745  7.60777     12.6833  9.04827    36.3563     1.56792     36.3563     
1 1 1 26 23 22 o 13 39.891  6.63814 47.2764     13.1026  23.4328     13.9692  23.7425    234.925     9.26987     54.9254     
1 1 1 26 23 23 o 12 55.9366 5.85725 70.9737     14.9745  59.014      16.4561  57.5329    255.557     35.8245     255.557     
1 1 1 26 23 24 o 19 22.5799 6.46298 -4.39937    11.0267  16.8829     13.2187  3.68707    106.843     21.7913     286.843     
1 1 1 26 23 25 f 0  54.4553 5.59591 61.2161     13.2788  60.7845     16.1057  19.0641    188.957     0           0           
1 1 1 26 23 26 f 0  29.4161 6.65401 22.2574     11.354   16.0308     10.992   16.4218    121.902     0           0           
1 1 1 26 23 27 o 15 23.827  6.46994 15.222      11.1538  4.90018     11.2657  10.8346    260.726     5.56624     80.7262     
1 1 1 26 23 28 o 14 17.324  5.50301 3.10634     10.2872  -8.77006    10.2357  2.06847    28.5389     2.835       208.539     
1 1 1 26 23 29 o 5  25.3231 6.67287 14.053      11.3642  12.0981     11.3427  11.9502    37.2224     6.19772     217.222     
1 1 1 26 23 30 o 1  24.8974 6.80801 9.69083     11.3657  14.5718     12.8084  11.0505    128.922     7.96559     308.922     
1 1 1 26 23 31 o 18 28.8995 7.0614  17.4006     12.5367  20.0999     12.3826  18.7326    359.295     2.42775     359.295     
1 1 1 26 23 32 o 13 61.2409 5.05151 64.5303     14.796   87.1309     15.3421  42.4121    182.934     4.08882     2.93367     
1 1 1 26 23 33 o 13 30.0057 7.16865 19.1744     13.0302  21.8492     12.6351  19.987     185.883     1.7652      185.883     
1 1 1 26 23 34 o 1  39.6095 9.11598 41.9309     18.7535  42.1642     23.1917  30.175     1.58271     7.00439     1.58271     
1 1 1 26 23 35 o 15 26.836  8.05302 27.9087     20.7036  -13.3713    20.9848  16.5758    137.857     1.64299     137.857     
1 1 1 26 23 36 o 17 31.0918 8.44785 42.4595     20.9913  -5.67633    22.6681  22.3607    181.014     6.66751     181.014     
1 1 1 26 23 37 o 13 45.1322 9.08968 69.7767     22.3406  42.428      22.391   42.8098    170.827     27.0563     170.827     
1 1 1 26 23 38 o 17 21.571  7.23506 -7.51118    20.819   -8.3497     21.2413  4.75724    323.625     1.49487     323.625     
1 1 1 26 23 39 o 17 52.7433 8.32849 73.9391     23.9576  68.5879     18.9629  43.6329    25.541      13.6812     25.541      
1 1 1 26 23 40 o 8  21.865  6.93039 4.16997     15.9901  3.40653     15.4062  7.77878    27.3673     9.539       207.367     
1 1 1 26 23 41 o 2  18.871  6.28068 -5.68901    15.2501  -5.60097    15.3234  2.87458    84.8401     0.844762    264.84      
1 1 1 26 23 42 o 1  17.2249 5.88405 -14.773     15.1423  -10.7955    15.5837  2.19744    211.627     3.35881     31.6268     
1 1 1 26 23 43 o 9  22.4501 7.16241 5.70443     17.0645  6.75545     17.0975  8.14492    161.213     2.37493     341.213     
1 1 1 26 23 44 o 5  54.5932 8.03215 77.1484     21.3742  82.4944     21.1436  40.005     54.5623     4.84824     54.5623     
1 1 1 26 23 45 o 7  19.2475 6.41321 -14.009     16.4334  3.65184     16.1856  3.18361    324.245     6.46987     144.245     
1 1 1 26 23 46 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 23 47 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 24 0  o 19 60.3765 4.34888 69.1317     12.8197  69.1317     12.8197  46.8804    1.45778e-05 1.24031     1.45779e-05 
1 1 1 26 24 1  o 5  70.376  3.88895 102.537     13.671   85.8938     13.4637  60.402     183.138     14.9767     183.138     
1 1 1 26 24 2  o 15 22.9022 6.13789 2.65121     10.2092  14.415      10.1404  6.19046    294.197     18.0457     114.197     
1 1 1 26 24 3  o 2  61.0004 4.15169 74.4001     12.4105  68.5463     12.6242  62.9023    52.4738     35.8106     52.4738     
1 1 1 26 24 4  o 10 42.1882 5.59572 46.501      11.3768  27.7121     11.2349  41.947     104.724     25.9271     104.724     
1 1 1 26 24 5  o 7  69.5711 3.85688 96.6236     13.362   87.2591     13.2889  73.0496    2.63008     42.5842     2.63008     
1 1 1 26 24 6  o 6  53.142  4.67275 62.091      12.237   49.2178     11.9714  47.1057    3.38127     15.9681     3.38127     
1 1 1 26 24 7  o 10 35.2509 6.14079 33.7675     11.0221  19.8317     10.9805  29.9853    159.142     12.4158     159.142     
1 1 1 26 24 8  o 18 20.0144 5.72172 11.8205     9.79715  -6.77095    9.97715  3.86129    67.5059     17.5469     247.506     
1 1 1 26 24 9  o 18 19.2472 5.77602 -0.39543    8.90207  6.42174     10.563   4.24742    99.5564     14.6824     279.556     
1 1 1 26 24 10 o 10 22.8442 6.15844 0.881463    9.61483  16.2234     11.0808  10.9533    276.103     3.37658     276.103     
1 1 1 26 24 11 o 1  21.1651 6.08707 8.62403     9.52477  2.86508     11.1587  8.92544    157.103     0.912767    157.103     
1 1 1 26 24 12 o 10 31.5652 6.94815 23.8714     10.6465  20.2645     14.3125  18.8001    61.9596     5.76206     241.96      
1 1 1 26 24 13 o 19 39.4877 6.07109 37.8161     10.9356  28.7192     12.4527  24.722     268.225     7.4132      88.2253     
1 1 1 26 24 14 o 8  25.3233 6.4072  16.0478     9.77186  9.1203      11.5015  14.851     145.881     6.04458     145.881     
1 1 1 26 24 15 o 19 25.0318 6.46455 13.626      9.94571  11.4041     11.305   14.7985    302.636     4.63286     302.636     
1 1 1 26 24 16 o 14 31.0699 6.95182 14.1681     11.4368  29.7393     13.472   7.74521    93.7346     28.4884     273.735     
1 1 1 26 24 17 o 17 16.5564 5.47297 -7.16699    9.92224  -5.80194    12.4086  4.7737     280.594     29.9266     280.594     
1 1 1 26 24 18 o 14 27.4497 6.89638 20.2944     11.3441  10.8092     13.5467  2.30485    215.559     33.664      35.5586     
1 1 1 26 24 19 o 10 23.5755 6.71015 2.58111     11.0557  15.9914     13.6825  11.8858    159.522     0.523651    339.522     
1 1 1 26 24 20 o 7  19.2328 6.04203 2.09544     10.4612  -2.15548    13.0689  0.613814   281.993     22.1966     101.993     
1 1 1 26 24 21 o 2  19.5305 5.97764 8.39669     10.705   -11.2195    12.9363  4.71115    105.088     1.47436     285.088     
1 1 1 26 24 22 o 8  26.2569 6.92934 21.5677     13.9487  7.67762     10.9235  10.9074    106.773     11.8683     286.773     
1 1 1 26 24 23 o 8  32.2752 6.80838 28.0516     12.1427  19.4247     11.8378  22.1705    285.81      2.59176     285.81      
1 1 1 26 24 24 o 6  26.711  6.66903 10.3718     11.7071  19.7186     11.2133  15.4296    316.88      6.00366     316.88      
1 1 1 26 24 25 o 17 52.3867 5.50797 55.2343     14.4066  58.3434     13.565   25.6624    51.0128     25.4449     231.013     
1 1 1 26 24 26 o 19 26.8488 6.62421 5.18054     11.8788  23.922      11.9576  17.3082    276.15      4.7054      276.15      
1 1 1 26 24 27 o 2  41.7446 7.61838 47.3733     16.1582  35.565      16.217   32.4927    97.0063     6.96667     97.0063     
1 1 1 26 24 28 o 5  29.5325 8.16    17.8278     18.2958  21.9791     16.8922  14.2812    292.701     10.8455     112.701     
1 1 1 26 24 29 o 17 28.8351 7.95587 9.9613      17.3954  25.7417     16.9723  16.9329    269.349     3.57023     89.3493     
1 1 1 26 24 30 o 1  21.3323 6.66084 13.1783     15.3385  -18.4895    15.0995  7.35878    321.229     11.4817     141.229     
1 1 1 26 24 31 o 1  21.6478 6.89254 -3.3944     15.2901  5.23187     16.2691  10.479     70.1208     0.800874    70.1208     
1 1 1 26 24 32 o 8  18.9012 6.31012 -4.64307    15.0273  -14.0276    16.5859  6.05911    31.8758     8.38696     211.876     
1 1 1 26 24 33 o 11 27.5315 7.73038 31.0035     18.0206  -2.55594    17.1462  13.0849    137.932     8.10429     137.932     
1 1 1 26 24 34 o 6  21.8263 6.92996 6.29355     15.7866  -1.61375    15.9759  7.40362    240.747     2.46339     240.747     
1 1 1 26 24 35 o 5  31.1841 8.28775 26.5133     17.7863  25.8012     17.3562  20.5791    25.4679     1.00814     25.468      
1 1 1 26 24 36 o 8  24.2372 7.40552 13.6825     16.5227  6.42123     16.6006  10.5191    303.387     8.49061     123.387     
1 1 1 26 24 37 o 15 18.0283 6.09597 -16.2193    15.4994  -4.76061    15.748   4.33717    153.08      3.89195     333.08      
1 1 1 26 24 38 o 8  22.6487 7.19112 5.37615     17.4567  7.46162     16.5602  6.85595    339.681     1.34277     339.681     
1 1 1 26 24 39 o 18 23.7609 7.7318  1.52191     17.118   16.8027     24.4716  9.86882    231.824     0.00705846  231.82      
1 1 1 26 24 40 o 3  32.9486 8.90076 -16.1796    27.0823  72.4988     26.1537  20.1089    201.455     11.3314     201.455     
1 1 1 26 24 41 f 0  26.7802 8.63545 9.42839     25.2559  30.3872     26.4399  13.0992    354.192     0           0           
1 1 1 26 24 42 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 24 43 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 25 0  o 9  42.2383 7.17125 39.5973     13.1645  39.5973     13.1645  31.6004    360         1.68788     180         
1 1 1 26 25 1  o 15 29.7224 6.81158 27.474      12.2807  11.33       12.2536  16.1849    290.562     8.18068     110.562     
1 1 1 26 25 2  o 14 43.0165 6.30991 51.0511     13.2497  30.115      13.164   35.6342    184.93      9.69473     184.93      
1 1 1 26 25 3  o 14 25.9188 6.66113 6.89154     11.6559  19.9022     11.7341  1.84464    142.274     32.5918     322.274     
1 1 1 26 25 4  o 16 20.8144 6.28768 2.15879     11.8313  5.95977     11.4974  5.47296    70.6474     14.5126     250.647     
1 1 1 26 25 5  f 0  20.2565 6.18452 7.28428     11.7455  -2.47961    11.6395  12.0005    160.712     0           0           
1 1 1 26 25 6  o 2  26.028  6.89532 10.9985     12.2774  16.8186     12.2265  12.1622    104.955     6.04089     104.955     
1 1 1 26 25 7  o 14 89.4754 3.99187 160.513     17.8644  146.968     17.7271  80.3565    295.802     25.268      295.802     
1 1 1 26 25 8  o 8  31.648  6.99689 14.6335     12.7787  31.0043     13.0385  22.0002    193.813     2.04971     193.813     
1 1 1 26 25 9  o 3  55.9575 5.35725 70.844      14.4865  57.7021     14.5867  56.1954    232.626     31.0857     232.626     
1 1 1 26 25 10 o 18 20.865  6.53501 9.34573     14.3569  -10.2038    13.8523  4.69439    260.665     15.9839     80.665      
1 1 1 26 25 11 o 3  30.2596 8.47165 13.926      14.2921  32.2727     23.5519  16.8618    293.494     6.12982     113.494     
1 1 1 26 25 12 o 3  18.7329 5.97199 2.92593     10.797   -9.24477    13.8855  4.82663    290.153     8.15562     110.153     
1 1 1 26 25 13 o 15 24.6144 6.97841 16.9898     12.6897  0.757345    15.5507  6.59004    62.5949     19.1633     242.595     
1 1 1 26 25 14 o 8  30.263  7.31217 9.03401     12.2036  34.1387     15.8922  13.7732    357.796     13.7135     177.796     
1 1 1 26 25 15 o 9  20.9913 6.38949 8.71975     11.9013  -3.29075    13.3564  6.73756    349.037     9.61118     169.037     
1 1 1 26 25 16 o 8  69.6749 4.83908 86.2017     16.1006  108.638     17.1648  59.5088    214.151     15.2268     214.151     
1 1 1 26 25 17 o 10 37.3073 7.16375 32.2071     12.9791  32.6831     14.5294  11.3821    335.915     31.1256     155.915     
1 1 1 26 25 18 o 19 46.6671 5.95526 52.1784     13.8422  40.9934     12.9673  38.2724    53.5522     9.44278     53.5522     
1 1 1 26 25 19 o 3  21.0581 6.31945 -1.40777    13.5058  8.58493     10.682   6.03968    154.887     0.926664    154.887     
1 1 1 26 25 20 o 19 30.0215 7.87663 18.5855     16.871   23.6995     15.051   18.7618    90.6019     1.68038     270.602     
1 1 1 26 25 21 o 14 20.2246 6.44555 6.86811     14.5304  -11.2705    13.8849  5.77262    141.837     0.546109    141.837     
1 1 1 26 25 22 o 1  56.0912 6.46541 67.139      18.4794  69.7705     16.4536  46.5041    31.7122     10.8612     31.7122     
1 1 1 26 25 23 o 13 46.9345 7.36171 72.4943     17.5301  32.7105     17.3881  39.4324    276.203     11.675      276.203     
1 1 1 26 25 24 o 17 54.658  7.52015 57.9246     20.2343  81.7376     19.2589  48.7269    247.493     18.2371     247.493     
1 1 1 26 25 25 o 17 25.3888 7.4835  17.2891     16.056   4.31175     16.2972  15.994     294.753     5.83992     294.753     
1 1 1 26 25 26 o 10 33.0402 8.19173 18.8871     17.3287  36.4603     17.4368  23.6581    142.026     3.1603      142.026     
1 1 1 26 25 27 o 12 29.9264 8.19161 21.7298     17.7035  22.7606     17.3     20.1061    175.149     1.55883     175.149     
1 1 1 26 25 28 o 8  29.2285 8.31024 27.4509     19.6952  14.8394     17.808   9.68558    74.7002     20.8019     254.7       
1 1 1 26 25 29 o 14 22.9    7.25007 6.1213      17.8618  3.33722     16.3613  9.92214    295.947     3.71315     295.947     
1 1 1 26 25 30 o 5  34.4313 8.54075 48.0286     20.4549  18.9816     17.7014  28.7507    247.174     15.3107     247.174     
1 1 1 26 25 31 o 5  28.3435 8.30573 18.3625     22.042   21.9897     17.3358  18.5953    312.423     3.12742     312.423     
1 1 1 26 25 32 o 2  26.1755 8.24358 11.4144     21.5119  16.732      22.1881  6.03973    79.1307     3.2903      79.1307     
1 1 1 26 25 33 o 16 30.1999 8.58619 17.0782     22.6765  34.8948     19.4198  19.0187    146.145     0.541305    146.145     
1 1 1 26 25 34 o 6  27.7055 8.28748 15.4077     22.0058  25.8531     18.8152  16.3291    103         5.18437     103         
1 1 1 26 25 35 o 13 26.1741 8.05538 12.0374     21.6756  21.6387     18.7498  7.24635    8.95694     3.23911     8.95694     
1 1 1 26 25 36 o 11 25.1609 7.82016 28.7727     20.7154  -1.92917    18.8171  11.3562    89.0144     1.57307     89.0144     
1 1 1 26 25 37 o 14 19.6897 6.58644 -9.22795    18.6417  0.790953    16.2558  4.33132    309.469     4.62171     129.469     
1 1 1 26 25 38 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 25 39 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 25 40 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 26 0  o 5  102.482 5.88477 198.115     29.7497  198.115     29.7497  91.7611    180         25.6555     180         
1 1 1 26 26 1  o 18 115.414 3.89534 247.127     22.4127  247.127     22.4127  128.258    30          78.7344     30          
1 1 1 26 26 2  o 4  65.4321 6.06516 86.4673     18.9414  86.4673     18.9414  52.2107    60          3.63894     60          
1 1 1 26 26 3  f 0  57.8908 5.61846 67.1515     15.4288  67.1515     15.4288  49.411     270         0           0           
1 1 1 26 26 4  o 9  65.638  5.62309 85.6143     17.7751  85.6143     17.7751  56.6696    300         12.2732     300         
1 1 1 26 26 5  o 6  53.092  7.64204 61.8422     17.991   61.8422     17.991   51.2788    330         20.831      330         
1 1 1 26 26 6  f 0  114.701 4.49906 247.729     25.6779  247.729     25.6779  42.3907    180         0           0           
1 1 1 26 26 7  o 4  13.5492 6.53355 -4.77293    13.7309  -4.77293    13.7309  0.151041   30          8.71552     210         
1 1 1 26 26 8  o 1  101.902 4.27183 194.778     21.6378  194.778     21.6378  119.371    60          82.0473     60          
1 1 1 26 26 9  o 1  53.4787 7.30347 61.7616     17.4702  61.7616     17.4702  21.5837    90          39.0285     270         
1 1 1 26 26 10 o 9  24.4447 10.376  20.4403     22.8379  20.4403     22.8379  11.5297    120         5.21689     120         
1 1 1 26 26 11 o 8  12.3146 6.10625 -11.4843    14.2854  -11.4843    14.2854  1.51993    330         13.1252     330         
1 1 1 26 26 12 o 2  13.2106 6.45977 -7.91511    14.5454  -7.91511    14.5454  0.0770779  180         10.5739     360         
1 1 1 26 26 13 o 12 58.6151 7.45448 73.8233     19.7929  73.8233     19.7929  50.0962    210         10.3208     210         
1 1 1 26 26 14 o 12 19.7251 8.6232  10.1955     16.8237  10.1955     16.8237  2.60926    60          0.659688    60          
1 1 1 26 26 15 o 6  30.7864 10.2858 30.7011     17.9444  30.7011     17.9444  23.6673    90          0.713589    90          
1 1 1 26 26 16 o 7  11.3994 5.77583 -20.4288    15.4297  -20.4288    15.4297  0.16013    120         2.98207     120         
1 1 1 26 26 17 o 7  92.5698 5.20424 165.608     23.7813  165.608     23.7813  65.3571    150         10.7486     330         
1 1 1 26 26 18 f 0  19.0421 8.74625 6.2578      19.9692  6.2578      19.9692  5.8178     180         0           0           
1 1 1 26 26 19 o 4  86.9027 6.9025  155.682     29.0873  155.682     29.0873  82.2725    30          32.0066     30          
1 1 1 26 26 20 o 6  25.7945 10.19   23.7625     19.6788  23.7625     19.6788  7.25327    240         24.6386     60          
1 1 1 26 26 21 o 15 73.2178 7.21645 113.434     25.0083  113.434     25.0083  80.3964    270         49.3723     270         
1 1 1 26 26 22 o 11 15.9467 7.61309 -1.71811    17.7195  -1.71811    17.7195  0.551383   300         0.255347    120         
1 1 1 26 26 23 o 10 60.3983 8.33266 82.6178     22.472   82.6178     22.472   65.0148    150         38.3409     150         
1 1 1 26 26 24 o 16 28.9152 11.0282 32.0928     22.1929  32.0928     22.1929  24.765     180         13.7126     180         
1 1 1 26 26 25 f 0  17.4999 8.7147  -13.9258    30.063   -13.9258    30.063   6.45339    30          0           0           
1 1 1 26 26 26 o 2  24.1146 9.84474 21.6008     19.2114  21.6008     19.2114  16.2457    240         5.29147     240         
1 1 1 26 26 27 o 6  36.8916 11.1195 45.194      20.9151  45.194      20.9151  33.7148    270         12.3615     270         
1 1 1 26 26 28 o 4  33.8915 11.5061 43.1708     22.547   43.1708     22.547   29.7381    300         9.94246     300         
1 1 1 26 26 29 o 15 19.6406 8.85941 11.4788     19.3253  11.4788     19.3253  3.99415    150         0.284108    330         
1 1 1 26 26 30 o 12 19.5519 8.84346 11.5007     19.4165  11.5007     19.4165  5.93411    180         2.07975     360         
1 1 1 26 26 31 o 2  18.8019 8.70944 8.83461     20.4124  8.83461     20.4124  3.75674    210         2.30184     30          
1 1 1 26 26 32 o 4  14.054  6.94495 -8.51393    18.0281  -8.51393    18.0281  0.308773   60          6.09505     60          
1 1 1 26 26 33 o 1  15.2551 7.38461 -2.22019    17.9137  -2.22019    17.9137  0.144028   270         1.77321     90          
1 1 1 26 26 34 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 26 35 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 26 26 36 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 0  0  o 11 93.0034 4.33168 155.322     19.9852  155.322     19.9852  27.3829    2.85625e-05 20.5559     180         
1 1 1 27 0  1  o 6  143.373 2.87186 365.258     20.5969  365.258     20.5969  108.688    60          6.30576     60          
1 1 1 27 0  2  o 4  92.0501 2.92151 151.108     13.415   151.108     13.415   33.587     120         66.8032     300         
1 1 1 27 0  3  o 18 55.368  3.59984 55.7211     9.78403  55.7211     9.78403  2.08152    1.30164e-05 6.48259     180         
1 1 1 27 0  4  o 9  62.3978 3.46458 70.2997     10.6758  70.2997     10.6758  3.65021    240         90.4537     240         
1 1 1 27 0  5  o 5  225.342 3.69999 901.888     41.7325  901.888     41.7325  252.515    120         173.348     120         
1 1 1 27 0  6  o 19 57.3478 3.42959 59.5508     9.68805  59.5508     9.68805  7.48164    5.74913e-06 30.5172     180         
1 1 1 27 0  7  o 6  478.168 5.51156 4061.75     131.994  4061.75     131.994  343.169    60          17.0862     240         
1 1 1 27 0  8  o 15 32.369  5.41825 21.4255     7.63109  21.4255     7.63109  18.0772    300         48.8998     300         
1 1 1 27 0  9  o 10 172.468 2.93809 528.22      25.3608  528.22      25.3608  113.054    180         27.3811     8.66596e-06 
1 1 1 27 0  10 o 6  105.933 2.64148 199.655     13.9834  199.655     13.9834  64.6481    60          24.6412     240         
1 1 1 27 0  11 o 15 146.502 2.68162 381.216     19.6583  381.216     19.6583  144.528    120         75.615      120         
1 1 1 27 0  12 o 12 139.277 2.56725 344.54      17.8913  344.54      17.8913  90.3892    180         75.5214     180         
1 1 1 27 0  13 o 13 540.559 5.48108 5190.41     148.412  5190.41     148.412  465.044    60          137.515     60          
1 1 1 27 0  14 o 19 555.545 5.55352 5482.54     154.544  5482.54     154.544  450.212    120         86.4857     120         
1 1 1 27 0  15 o 6  97.9705 3.03766 171.144     14.8486  171.144     14.8486  15.3034    180         112.514     8.68129e-06 
1 1 1 27 0  16 o 6  199.155 2.91809 704.05      29.0956  704.05      29.0956  189.777    60          88.2624     60          
1 1 1 27 0  17 o 19 261.972 3.26817 1218.01     42.8762  1218.01     42.8762  173.798    120         35.2391     300         
1 1 1 27 0  18 o 11 262.228 3.49756 1220.69     45.9257  1220.69     45.9257  148.158    180         86.5229     8.70606e-06 
1 1 1 27 0  19 o 19 203.387 2.88423 734.245     29.3711  734.245     29.3711  124.098    60          48.4349     240         
1 1 1 27 0  20 o 8  323.878 3.73534 1861.92     60.5914  1861.92     60.5914  229.283    120         13.2856     300         
1 1 1 27 0  21 o 6  55.2334 3.24243 55.2027     8.82761  55.2027     8.82761  3.74174    1.42203e-05 16.1149     180         
1 1 1 27 0  22 o 7  155.618 2.61776 430.027     20.389   430.027     20.389   70.2808    60          85.6293     240         
1 1 1 27 0  23 o 15 168.543 2.57156 504.266     21.6975  504.266     21.6975  85.2481    300         74.1762     120         
1 1 1 27 0  24 o 11 362.263 3.65934 2329.06     66.4029  2329.06     66.4029  217.818    180         89.576      8.63073e-06 
1 1 1 27 0  25 o 9  81.3849 2.66603 118.175     10.8202  118.175     10.8202  20.7618    59.9999     8.07176     59.9999     
1 1 1 27 0  26 o 12 388.354 3.85446 2677.01     74.9823  2677.01     74.9823  307.2      300         52.9137     300         
1 1 1 27 0  27 o 10 53.5809 3.35647 52.0999     8.84252  52.0999     8.84252  3.77484    8.76595e-06 22.8705     180         
1 1 1 27 0  28 o 17 322.967 3.36897 1851.1      54.5007  1851.1      54.5007  272.415    60          79.2731     60          
1 1 1 27 0  29 f 0  163.201 2.81928 473.084     23.027   473.084     23.027   90.5819    120         0           0           
1 1 1 27 0  30 o 11 45.2172 3.81233 37.7883     8.31501  37.7883     8.31501  15.4157    180         76.3408     180         
1 1 1 27 0  31 o 16 73.5342 2.74489 96.6719     10.0504  96.6719     10.0504  20.3691    240         60.4057     60          
1 1 1 27 0  32 o 14 124.245 2.75304 274.519     17.1035  274.519     17.1035  119.617    120         64.9862     120         
1 1 1 27 0  33 o 1  128.26  2.61624 292.408     16.7846  292.408     16.7846  66.9193    180         49.4886     8.62291e-06 
1 1 1 27 0  34 o 18 55.0412 3.88042 55.3468     10.4411  55.3468     10.4411  3.27136    60          63.5871     240         
1 1 1 27 0  35 f 0  335.019 3.60684 1993.14     60.5243  1993.14     60.5243  177.755    120         0           0           
1 1 1 27 0  36 o 13 115.717 2.70707 238.253     15.6595  238.253     15.6595  122.458    180         87.4966     180         
1 1 1 27 0  37 o 13 35.3051 5.48584 25.0959     8.49452  25.0959     8.49452  0.651237   59.9999     8.57736     59.9999     
1 1 1 27 0  38 o 12 272.872 3.1738  1322.32     43.3744  1322.32     43.3744  266.883    120         147.531     120         
1 1 1 27 0  39 o 10 79.2148 3.00201 112.297     11.8386  112.297     11.8386  67.7557    180         34.8545     180         
1 1 1 27 0  40 o 10 158.453 2.70422 446.208     21.4453  446.208     21.4453  190.029    240         157.88      240         
1 1 1 27 0  41 f 0  52.5621 3.78548 50.5834     9.71477  50.5834     9.71477  75.2446    120         0           0           
1 1 1 27 0  42 o 12 155.468 2.82161 429.798     21.9508  429.798     21.9508  92.6629    6.79001e-09 32.7923     180         
1 1 1 27 0  43 o 2  33.4418 6.57933 24.0318     9.5384   24.0318     9.5384   2.43115    60          31.2152     60          
1 1 1 27 0  44 o 18 37.4745 5.29316 27.7953     8.82235  27.7953     8.82235  2.85661    120         4.99814     300         
1 1 1 27 0  45 o 8  13.2525 5.77753 2.40814     7.50219  2.40814     7.50219  8.66599    180         19.263      180         
1 1 1 27 0  46 f 0  32.8651 5.96505 22.6824     8.49107  22.6824     8.49107  39.2489    60          0           0           
1 1 1 27 0  47 o 10 148.945 2.69075 394.766     20.0548  394.766     20.0548  129.246    300         52.0789     300         
1 1 1 27 0  48 o 15 19.3111 6.66033 9.86374     7.59397  9.86374     7.59397  7.30534    8.57649e-06 19.5908     8.57649e-06 
1 1 1 27 0  49 o 15 174.243 2.5889  540.017     22.5839  540.017     22.5839  163.518    240         86.8412     240         
1 1 1 27 0  50 f 0  30.1264 6.17857 19.8331     8.09388  19.8331     8.09388  22.389     300         0           0           
1 1 1 27 0  51 o 1  136.163 2.96573 330.7       20.1938  330.7       20.1938  78.8579    180         28.95       8.65137e-06 
1 1 1 27 0  52 o 18 62.2918 3.41131 70.3508     10.4982  70.3508     10.4982  14.0649    60          57.023      240         
1 1 1 27 0  53 o 16 39.0211 4.91207 29.686      8.69875  29.686      8.69875  24.1438    300         2.40929     120         
1 1 1 27 0  54 f 0  86.2591 2.93639 133.391     12.6261  133.391     12.6261  39.4424    180         0           0           
1 1 1 27 0  55 o 14 23.1639 6.95114 13.7732     8.17908  13.7732     8.17908  2.9791     240         12.5156     60          
1 1 1 27 0  56 o 16 18.4916 6.71768 9.15414     7.9263   9.15414     7.9263   0.48358    300         5.28676     300         
1 1 1 27 0  57 o 9  60.6791 3.75758 67.3752     11.216   67.3752     11.216   45.0087    4.08259e-06 8.32076     4.08259e-06 
1 1 1 27 0  58 o 12 203.171 3.258   738.507     33.1336  738.507     33.1336  157.791    60          42.8675     60          
1 1 1 27 0  59 o 11 43.7803 5.55069 37.7599     11.0142  37.7599     11.0142  12.6337    120         33.2972     300         
1 1 1 27 0  60 o 7  74.4397 3.30405 100.234     12.2131  100.234     12.2131  68.0375    180         36.8069     180         
1 1 1 27 0  61 o 16 12.3083 5.6426  -0.0798727  8.25724  -0.0798727  8.25724  3.93634    60          11.6475     60          
1 1 1 27 0  62 o 18 112.105 3.20054 225.89      17.914   225.89      17.914   97.1972    120         45.8999     120         
1 1 1 27 0  63 o 13 13.1164 5.83989 1.80857     8.0879   1.80857     8.0879   0.0736979  180.001     0.292782    180.001     
1 1 1 27 0  64 o 12 66.3633 3.62278 80.5171     11.8789  80.5171     11.8789  59.8156    60          32.3368     60          
1 1 1 27 0  65 o 18 14.2094 6.2135  3.16266     8.74027  3.16266     8.74027  2.4235     120         15.0925     120         
1 1 1 27 0  66 o 17 37.0777 6.29019 29.1374     10.1369  29.1374     10.1369  16.1353    180         16.1333     8.66984e-06 
1 1 1 27 0  67 o 10 12.7064 5.79564 0.588938    8.56475  0.588938    8.56475  1.29525    240         6.85566     240         
1 1 1 27 0  68 o 14 12.0715 5.61773 -0.895759   8.64248  -0.895759   8.64248  0.204622   300         0.873093    300         
1 1 1 27 0  69 o 11 18.1457 7.31086 8.75293     10.3929  8.75293     10.3929  2.16678    180         3.19793     8.6606e-06  
1 1 1 27 0  70 o 15 24.5866 8.12672 17.1663     11.1778  17.1663     11.1778  3.61203    240         23.5131     60          
1 1 1 27 0  71 o 5  93.7243 4.25803 162.469     19.8078  162.469     19.8078  62.9499    300         5.79219     300         
1 1 1 27 0  72 o 2  38.0031 8.86876 35.6263     15.0015  35.6263     15.0015  27.6746    180         8.30755     180         
1 1 1 27 0  73 o 19 23.4323 8.16696 15.9996     11.4649  15.9996     11.4649  9.54132    60          2.91822     240         
1 1 1 27 0  74 o 5  16.1572 6.99954 5.26232     10.8517  5.26232     10.8517  1.31122    300         8.56962     120         
1 1 1 27 0  75 o 7  20.1715 8.00646 11.6513     12.2202  11.6513     12.2202  0.254117   180         0.0135313   360         
1 1 1 27 0  76 o 14 27.7655 8.36847 21.4875     11.8464  21.4875     11.8464  9.49822    240         15.473      60          
1 1 1 27 0  77 o 14 15.7251 6.93115 4.63314     11.0929  4.63314     11.0929  0.0420816  299.999     0.285485    119.999     
1 1 1 27 0  78 o 7  15.2384 6.81647 3.7669      11.1639  3.7669      11.1639  0.0748091  5.76309e-05 1.18631     5.76309e-05 
1 1 1 27 0  79 o 12 18.3735 7.8116  9.24547     12.9858  9.24547     12.9858  0.907411   240         6.92296     60          
1 1 1 27 0  80 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 1  0  o 12 72.4584 3.24788 94.2007     11.6837  94.2007     11.6837  24.1485    180         0.425068    0.000115698 
1 1 1 27 1  1  o 15 313.369 3.93178 1738.59     58.2861  1747.98     65.0369  271.571    317.365     88.4659     317.365     
1 1 1 27 1  2  o 12 339.489 3.98634 2012.31     66.0967  2080.23     69.5432  210.33     193.51      75.1464     13.5104     
1 1 1 27 1  3  o 16 150.45  2.96747 395.02      21.2876  408.651     23.397   91.5851    223.66      27.0319     43.6603     
1 1 1 27 1  4  o 18 60.3551 3.12534 73.5988     9.19674  56.881      9.41774  34.9148    132.128     145.431     132.128     
1 1 1 27 1  5  o 18 322.665 3.66077 1827.27     57.8345  1868.46     60.5491  227.944    252.413     13.9858     72.4128     
1 1 1 27 1  6  o 17 108.188 2.41702 210.16      12.3062  205.34      13.8069  37.4228    149.058     71.7161     329.058     
1 1 1 27 1  7  o 8  285.764 3.01232 1440.86     41.5114  1456.29     44.7227  210.472    258.375     6.7755      258.375     
1 1 1 27 1  8  o 11 279.092 3.06014 1399.94     41.9586  1363.72     43.5996  233.502    71.3653     64.194      71.3653     
1 1 1 27 1  9  o 17 90.5765 2.49144 145.497     10.9073  145.899     11.656   45.6511    317.224     18.3931     137.224     
1 1 1 27 1  10 o 15 297.717 3.34221 1568.5      48.822   1577.04     50.8922  254.663    50.7915     79.2681     50.7915     
1 1 1 27 1  11 o 10 238.409 2.90983 1011.06     33.3485  1005.38     36.1194  180.774    232.71      19.6069     232.71      
1 1 1 27 1  12 f 0  258.326 3.02972 1168.72     38.4243  1199.07     40.0193  160.878    308.255     0           0           
1 1 1 27 1  13 f 0  176.976 2.58814 559.54      22.0663  551.373     23.7957  107.156    234.451     0           0           
1 1 1 27 1  14 o 13 268.086 3.0471  1283.2      39.2873  1266.92     42.5023  188.373    305.853     9.5627      125.853     
1 1 1 27 1  15 o 8  314.224 3.34353 1731.42     48.1331  1773.08     56.8997  207.254    149.218     40.4854     329.218     
1 1 1 27 1  16 o 6  195.548 2.71118 690.433     25.9369  666.15      27.1584  168.979    334.712     64.7863     334.712     
1 1 1 27 1  17 o 6  140.941 2.61412 356.926     18.4593  348.197     18.4347  81.6384    308.059     30.6749     128.059     
1 1 1 27 1  18 o 1  265.537 3.09192 1246.74     40.226   1255.4      42.0491  156.127    310.664     69.8938     130.664     
1 1 1 27 1  19 o 17 305.018 3.58366 1628.28     54.753   1675.09     54.797   196.713    313.324     46.4094     133.324     
1 1 1 27 1  20 o 1  379.27  4.17917 2585.59     75.2565  2525.52     83.2996  309.527    308.906     71.5051     308.906     
1 1 1 27 1  21 o 8  150.727 2.72171 395.15      18.3979  411.232     22.5599  85.9008    185.841     36.9086     5.84123     
1 1 1 27 1  22 o 17 169.181 2.72028 496.064     22.433   519.517     23.6966  148.822    197.065     68.0582     197.065     
1 1 1 27 1  23 o 19 320.661 3.64303 1821.66     57.1035  1829.83     59.9525  200.96     155.297     59.0744     335.297     
1 1 1 27 1  24 o 3  214.954 2.87854 804.382     29.5462  835.333     32.4488  119.466    341.88      66.1175     161.88      
1 1 1 27 1  25 o 15 127.098 2.63421 287.96      15.907   285.624     17.5646  95.8222    86.9171     26.3429     86.9171     
1 1 1 27 1  26 o 16 251.624 3.13988 1107.6      35.8034  1139.91     43.1407  197.056    87.4211     37.61       87.4211     
1 1 1 27 1  27 o 18 46.2288 3.72683 39.8814     7.63939  37.0401     9.15575  4.93358    102.701     38.6462     102.701     
1 1 1 27 1  28 o 12 255.309 3.05556 1165.95     36.3796  1147.83     41.5917  204.242    249.262     47.4654     249.262     
1 1 1 27 1  29 o 19 101.696 2.73437 180.086     13.5246  187.479     14.2962  74.0764    242.035     32.4992     242.035     
1 1 1 27 1  30 o 5  74.2681 2.94504 97.5853     10.3373  98.8205     11.473   28.6001    180.438     27.4877     0.437738    
1 1 1 27 1  31 o 13 47.5106 3.70156 48.6798     7.95707  33.2596     8.85245  0.240577   191.63      34.5167     191.631     
1 1 1 27 1  32 o 14 112.089 2.58182 228.927     13.758   217.492     15.1323  77.7385    143.914     9.17109     143.914     
1 1 1 27 1  33 o 13 113.402 2.63863 239.442     14.6286  217.772     15.2585  42.1641    311.032     70.0552     131.032     
1 1 1 27 1  34 o 14 175.308 2.62443 539.137     21.9817  551.851     24.1049  162.349    241.245     84.6514     241.245     
1 1 1 27 1  35 o 16 92.674  2.6087  149.2       11.7856  156.221     12.3986  60.78      329.442     2.22873     329.442     
1 1 1 27 1  36 o 12 102.858 2.62254 172.105     12.8757  204.736     14.1193  57.3339    277.526     23.1785     97.5256     
1 1 1 27 1  37 o 15 65.3982 3.05707 81.1449     9.61914  71.6645     10.2252  22.2639    67.9635     11.9032     67.9635     
1 1 1 27 1  38 o 16 39.5545 4.27525 29.4494     7.85547  27.6088     8.51222  3.72191    9.29602     45.3406     9.29602     
1 1 1 27 1  39 o 4  198.148 2.63835 701.179     25.639   693.719     26.7408  161.991    35.9841     49.1446     35.9841     
1 1 1 27 1  40 o 7  84.9301 2.7318  128.883     11.2468  128.004     11.9334  67.897     350.094     44.1794     350.094     
1 1 1 27 1  41 o 12 23.2283 5.5959  8.351       7.62406  9.5559      7.98201  14.1723    178.666     40.0086     178.666     
1 1 1 27 1  42 o 6  84.8334 2.82181 133.275     11.8756  123.356     12.0294  69.813     256.041     38.7406     256.041     
1 1 1 27 1  43 o 18 96.9248 2.87264 168.567     12.5528  166.326     15.1471  53.3361    332.432     22.5944     152.432     
1 1 1 27 1  44 o 15 176.292 2.62122 562.464     23.0898  543.181     23.2179  117.527    231.415     7.70221     51.4155     
1 1 1 27 1  45 o 6  129.467 2.52492 291.882     15.9683  304.937     16.7663  105.024    165.524     36.0784     165.524     
1 1 1 27 1  46 o 4  65.9748 3.04602 73.7534     9.6635   82.2146     10.3719  28.1636    338.139     27.1347     158.139     
1 1 1 27 1  47 o 2  47.7424 3.82642 42.0652     8.94179  40.5812     9.04022  20.0839    51.0252     0.506918    51.025      
1 1 1 27 1  48 o 12 89.0323 2.81482 134.325     12.4591  149.041     12.5751  78.2372    67.3203     47.5783     67.3203     
1 1 1 27 1  49 o 5  25.3533 5.42978 16.6248     7.83048  6.01213     7.99165  6.32679    236.955     30.5927     236.955     
1 1 1 27 1  50 o 3  81.4675 3.07633 125.685     12.1702  112.337     12.782   63.1333    274.422     21.0134     274.422     
1 1 1 27 1  51 o 11 85.322  3.0196  135.492     13.151   125.484     12.5907  53.6186    352.214     6.22441     172.214     
1 1 1 27 1  52 o 3  43.1518 4.46933 36.1816     9.10037  32.5615     9.59454  26.046     215.959     1.79632     215.959     
1 1 1 27 1  53 o 9  65.4264 3.35061 82.6472     10.8494  71.9646     10.9236  44.2464    245.849     3.83606     245.849     
1 1 1 27 1  54 o 3  52.8551 3.70633 50.2703     9.71292  51.3685     9.66149  31.686     94.9696     3.32549     274.97      
1 1 1 27 1  55 o 5  22.4004 5.68942 8.46527     7.84054  7.62259     8.44064  6.44621    99.1255     36.3984     99.1255     
1 1 1 27 1  56 o 1  31.6464 5.67469 16.0302     8.98257  22.5906     9.16801  7.31729    79.178      2.76621     79.178      
1 1 1 27 1  57 o 3  22.2005 5.80237 7.88945     8.61175  7.21683     8.4757   1.80267    224.091     13.8249     44.0912     
1 1 1 27 1  58 o 15 99.1895 3.03712 191.868     15.5538  163.267     14.558   77.8581    237.175     25.2034     237.175     
1 1 1 27 1  59 o 2  53.188  4.60311 46.7367     11.871   58.84       12.0136  30.3644    56.0916     6.50337     236.092     
1 1 1 27 1  60 o 16 63.5546 4.03035 72.2097     11.8052  76.1681     13.567   37.5141    203.485     6.69929     23.4853     
1 1 1 27 1  61 o 10 87.6211 3.36469 136.931     14.2374  141.729     15.1976  80.5247    284.156     48.4051     284.156     
1 1 1 27 1  62 o 17 114.039 2.98417 246.604     17.2075  223.374     16.8271  88.2825    308.579     27.1839     308.579     
1 1 1 27 1  63 o 16 24.4592 5.87859 3.36339     9.29103  16.5217     9.1977   1.07879    113.845     25.6891     293.845     
1 1 1 27 1  64 o 17 67.5385 3.84204 83.3553     12.4892  84.9947     13.2919  53.6106    277.548     21.2487     277.548     
1 1 1 27 1  65 o 9  30.4685 6.17437 15.1539     9.90536  22.1355     10.1328  12.1345    270.013     11.0736     90.0134     
1 1 1 27 1  66 o 9  46.5136 4.63472 39.1337     10.4732  43.5915     10.5069  30.0355    226.523     2.60895     226.523     
1 1 1 27 1  67 o 13 30.2697 6.03154 14.6453     10.161   22.3861     9.32614  15.4713    267.984     2.55486     87.9842     
1 1 1 27 1  68 o 3  59.581  4.53535 67.1988     13.2206  68.3282     13.4373  39.3206    331.932     3.96509     331.932     
1 1 1 27 1  69 o 8  48.2124 5.70577 33.1546     12.8396  61.7537     13.0803  27.4994    105.246     4.07129     285.246     
1 1 1 27 1  70 o 9  48.3923 5.47041 41.78       12.5599  51.7558     13.0111  32.7493    84.5142     7.48066     84.5142     
1 1 1 27 1  71 o 10 31.6539 6.97785 33.5362     13.5745  6.42357     14.2075  16.4749    108.249     5.82001     108.249     
1 1 1 27 1  72 o 17 43.425  6.53538 23.8514     14.9133  57.0713     13.3332  26.0907    20.1229     1.06548     20.1229     
1 1 1 27 1  73 o 2  20.4989 6.28707 5.86603     13.054   -2.65021    10.9287  1.83897    117.27      16.6696     297.27      
1 1 1 27 1  74 o 15 32.2827 6.54741 39.9545     14.2448  4.35351     11.4955  17.3217    111.981     1.15854     291.981     
1 1 1 27 1  75 o 10 43.3901 6.08681 35.7499     12.7441  43.0603     12.7806  31.1255    171.161     12.2186     171.161     
1 1 1 27 1  76 o 6  40.7033 6.4879  34.7857     12.8171  37.0354     13.0198  27.3908    281.864     8.73968     281.864     
1 1 1 27 1  77 o 7  20.4959 6.09207 -4.86987    11.2611  10.76       11.2209  3.9024     337.809     5.45865     157.809     
1 1 1 27 1  78 o 13 27.6383 7.06432 19.274      12.8348  15.3519     12.3306  10.6884    70.6059     2.72148     250.606     
1 1 1 27 1  79 o 8  30.8645 7.63142 18.4541     13.769   28.9498     15.5264  12.5853    102.664     2.81243     102.664     
1 1 1 27 1  80 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 2  0  o 6  323.54  3.70491 1857.87     60.0357  1857.87     60.0357  273.906    360         70.2619     360         
1 1 1 27 2  1  o 1  209.212 2.91076 783.81      29.7878  769.039     31.2156  140.592    85.137      19.0958     265.137     
1 1 1 27 2  2  o 16 77.619  2.99744 112.264     11.6237  102.242     11.5884  24.208     327.009     43.385      147.009     
1 1 1 27 2  3  o 16 222.245 3.08365 888.152     31.8289  864.485     36.6223  168.539    104.894     18.1682     104.894     
1 1 1 27 2  4  o 18 105.422 2.50532 201.303     13.2229  193.35      13.2077  72.5701    298.602     16.4455     298.602     
1 1 1 27 2  5  o 11 119.211 2.51748 254.524     15.0092  249.963     15.0356  67.4018    324.858     25.959      144.858     
1 1 1 27 2  6  o 16 217.242 2.76778 832.989     28.7881  841.174     31.4312  146.981    336.692     18.1434     156.692     
1 1 1 27 2  7  o 12 69.2667 2.65358 77.0358     8.87332  94.0742     9.4594   20.0874    180.443     8.49393     0.442901    
1 1 1 27 2  8  o 8  72.6637 2.64122 92.9632     9.29845  94.8204     9.86919  1.49692    58.686      94.0603     58.686      
1 1 1 27 2  9  o 10 197.658 2.6068  688.46      25.8028  697.319     25.8396  156.068    31.0663     32.0866     31.0663     
1 1 1 27 2  10 o 5  154.315 2.51856 428.357     19.0172  416.294     19.9106  87.8602    236.055     40.721      56.055      
1 1 1 27 2  11 o 13 155.014 2.51993 430.09      19.8495  422.207     19.3021  150.252    267.904     112.94      267.904     
1 1 1 27 2  12 o 2  338.712 3.35871 2030.66     56.9499  2041.45     57.0732  255.774    192.644     19.2676     192.644     
1 1 1 27 2  13 o 3  188.82  2.61617 632.017     24.1919  632.654     25.3073  174.004    310.19      86.1942     310.19      
1 1 1 27 2  14 o 18 163.591 2.59019 473.798     20.8859  475.496     21.5796  138.136    220.853     52.0394     220.853     
1 1 1 27 2  15 o 1  167.947 2.63171 501.663     20.7387  498.9       23.4687  143.835    359.792     57.0139     359.792     
1 1 1 27 2  16 o 19 387.276 3.93242 2637.6      71.2481  2689.89     81.16    284.028    163.701     5.19289     163.701     
1 1 1 27 2  17 o 7  81.1754 2.63123 114.228     10.3656  120.053     10.9868  15.5724    185.329     71.3272     5.32905     
1 1 1 27 2  18 o 3  169.378 2.53148 513.911     20.2586  503.767     22.6263  118.141    103.463     0.286985    283.463     
1 1 1 27 2  19 o 5  174.652 2.62679 549.295     23.1163  532.88      22.865   176.975    284.622     146.044     284.622     
1 1 1 27 2  20 o 2  110.382 2.65152 214.506     14.7965  218.248     14.4904  48.9057    173.75      49.6908     353.75      
1 1 1 27 2  21 o 15 216.26  2.79353 835.605     29.1212  823.842     31.3705  127.763    326.264     52.6741     146.264     
1 1 1 27 2  22 o 16 180.231 2.56774 583.742     22.8261  568.658     23.5403  142.102    322.005     33.4658     322.005     
1 1 1 27 2  23 o 17 213.037 2.70249 803.874     28.3855  806.391     29.313   105.243    27.44       93.1834     207.44      
1 1 1 27 2  24 o 13 76.3367 2.69313 103.628     10.1541  103.641     10.3849  33.7547    54.2549     12.3032     234.255     
1 1 1 27 2  25 o 9  52.9656 3.25945 43.6002     8.4353   57.2195     8.58055  6.66891    300.963     66.6768     300.963     
1 1 1 27 2  26 o 6  211.43  2.79573 790.797     28.4647  795.586     30.7429  142.433    213.283     14.0956     33.2827     
1 1 1 27 2  27 o 17 180.394 2.66355 573.6       23.1792  581.139     24.9573  117.91     348.823     16.8078     168.823     
1 1 1 27 2  28 o 6  46.9724 3.77638 42.6236     8.4258   36.8971     8.93899  0.468522   181.772     18.6107     1.77207     
1 1 1 27 2  29 o 5  257.99  3.18219 1179.97     37.3172  1183.65     44.6489  196.971    148.1       27.906      148.1       
1 1 1 27 2  30 o 13 85.4222 2.78812 121.784     11.4668  138.044     12.3435  55.0761    94.6723     12.8834     94.6722     
1 1 1 27 2  31 o 18 103.444 2.67018 198.534     13.3665  181.985     14.2014  70.9087    171.756     7.68367     171.756     
1 1 1 27 2  32 o 18 111.654 2.70282 218.518     14.418   224.605     15.7701  90.7859    34.0379     37.0869     34.0379     
1 1 1 27 2  33 o 15 108.461 2.60727 205.797     13.4128  212.331     14.8714  93.0703    75.2016     47.9135     75.2016     
1 1 1 27 2  34 o 18 25.3417 5.48533 11.4481     7.03962  11.4932     8.21873  5.72793    95.8168     16.6989     95.8168     
1 1 1 27 2  35 o 3  61.588  3.3062  67.3849     9.63742  68.2495     10.5999  13.1737    177.362     50.5218     357.362     
1 1 1 27 2  36 o 19 200.968 2.68609 714.743     25.7822  719.931     28.2736  122.441    134.796     37.3798     314.796     
1 1 1 27 2  37 o 5  125.825 2.61337 276.276     15.8323  286.664     17.0848  100.032    252.729     30.075      252.729     
1 1 1 27 2  38 o 4  107.439 2.61489 209.698     14.0067  200.954     14.1024  57.94      303.462     29.7315     123.462     
1 1 1 27 2  39 o 12 58.1066 3.39104 63.5154     9.42673  57.5834     10.0784  20.7281    337.201     28.1911     157.201     
1 1 1 27 2  40 o 13 14.2073 4.5229  -4.01856    6.37211  -2.65085    7.14106  46.235     201.252     101.734     201.252     
1 1 1 27 2  41 o 2  27.305  5.45123 13.4658     7.19781  14.0393     8.38357  18.6042    13.4784     61.0793     13.4784     
1 1 1 27 2  42 o 1  190.759 2.67133 646.337     24.3375  648.087     26.6852  161.656    185.461     59.8055     185.461     
1 1 1 27 2  43 o 2  108.487 2.59782 212.302     13.7035  206.903     14.48    92.9187    346.022     42.9503     346.022     
1 1 1 27 2  44 o 17 133.886 2.62764 326.858     16.6893  311.73      18.4424  79.2888    80.0357     24.4567     260.036     
1 1 1 27 2  45 o 14 143.042 2.52899 355.833     17.6761  372.787     18.5693  97.4681    338.501     0.242995    158.502     
1 1 1 27 2  46 o 14 105.871 2.60528 192.846     13.4042  206.97      14.2028  72.142     108.816     3.1588      108.816     
1 1 1 27 2  47 o 16 113.475 2.66398 219.627     14.8469  239.971     15.4069  97.825     140.739     45.7676     140.739     
1 1 1 27 2  48 o 4  95.2682 2.84717 159.748     13.569   164.68      13.5533  74.7258    219.063     24.1662     219.063     
1 1 1 27 2  49 o 2  181.767 2.88614 584.627     25.0527  595.151     27.4897  131.587    173.571     14.3716     173.571     
1 1 1 27 2  50 o 16 45.1556 4.42238 34.2999     9.77527  40.8002     9.61522  14.7017    71.5216     27.7388     251.522     
1 1 1 27 2  51 o 3  138.723 2.73451 327.708     18.5054  360.674     19.4794  101.628    65.8929     14.8501     65.893      
1 1 1 27 2  52 o 7  33.3148 5.34476 19.9912     7.82307  22.202      9.61789  9.90769    78.8428     18.4012     258.843     
1 1 1 27 2  53 o 6  124.65  2.6066  264.302     15.3699  291.907     17.169   88.3491    46.6308     8.61206     46.6308     
1 1 1 27 2  54 o 12 77.8627 3.25097 113.38      12.5371  105.406     12.6999  58.1967    245.142     14.1948     245.142     
1 1 1 27 2  55 o 2  100.148 3.01917 173.684     15.4962  187.322     14.6775  69.0176    141.456     4.53478     141.457     
1 1 1 27 2  56 o 5  65.7583 3.43514 77.0139     11.4906  79.8871     10.9688  43.8687    247.218     2.47128     247.218     
1 1 1 27 2  57 o 5  79.7177 3.12648 125.552     12.7557  104.45      12.0972  59.4272    16.5098     14.5451     16.5098     
1 1 1 27 2  58 o 4  34.1673 5.77455 14.1        10.5497  31.3393     9.70247  14.8265    14.9393     9.62611     194.939     
1 1 1 27 2  59 o 14 59.2292 4.40983 56.8221     13.5659  73.5515     11.5759  34.9129    283.233     6.18918     103.232     
1 1 1 27 2  60 f 0  188.245 3.4275  638.424     30.5876  645.871     33.9702  103.602    66.8243     0           0           
1 1 1 27 2  61 o 16 50.6942 4.56125 44.9439     10.9085  51.3716     11.744   36.9538    69.5409     11.0505     69.5409     
1 1 1 27 2  62 o 12 19.9375 5.77259 -3.45001    8.84802  8.69614     10.2517  2.95472    295.202     11.0132     115.202     
1 1 1 27 2  63 o 15 39.0679 5.74281 28.9171     10.9368  31.2545     10.8156  16.5653    344.145     15.2131     164.145     
1 1 1 27 2  64 o 12 25.7742 6.15851 11.4721     10.0079  13.5161     8.98126  11.8848    328.513     0.821353    328.513     
1 1 1 27 2  65 o 4  33.8329 5.78269 27.0864     9.81083  19.0915     9.71884  14.8237    240.752     10.9285     60.752      
1 1 1 27 2  66 o 6  29.3079 6.16955 15.7092     9.61543  19.2215     9.90284  12.8004    56.5465     7.51152     236.547     
1 1 1 27 2  67 o 12 30.8757 6.40865 23.6163     11.2856  16.0964     9.97406  16.6082    150.383     0.512619    330.383     
1 1 1 27 2  68 o 14 82.7685 3.7512  122.044     15.0727  133.463     15.8848  55.9493    120.17      6.24511     120.17      
1 1 1 27 2  69 o 5  71.9971 4.12132 98.3159     14.2939  97.5086     15.1693  53.8041    319.615     17.1719     319.615     
1 1 1 27 2  70 o 13 35.8752 6.89303 20.7139     14.3353  34.2711     12.1097  21.2231    349.421     3.57553     349.421     
1 1 1 27 2  71 o 19 35.4289 6.92262 38.2169     14.4908  17.1362     11.7205  20.3012    252.388     1.39226     252.388     
1 1 1 27 2  72 o 7  58.4429 5.14613 69.3805     15.7768  64.8507     13.6762  46.0654    249.491     20.9822     249.491     
1 1 1 27 2  73 o 15 30.498  7.22369 15.5413     14.7746  23.3172     12.0665  5.78909    294.335     24.069      114.335     
1 1 1 27 2  74 o 18 26.5647 6.70991 -3.53861    14.2852  24.1806     12.4087  9.48728    132.957     9.60054     312.957     
1 1 1 27 2  75 o 13 31.3398 7.34619 19.4346     14.8456  24.5187     12.5372  18.2845    27.7658     8.85104     27.7658     
1 1 1 27 2  76 o 11 26.0106 7.05623 23.2453     14.7253  2.9381      12.3596  8.36877    178.054     2.16823     178.054     
1 1 1 27 2  77 o 13 25.3006 6.90245 11.5055     12.3856  14.8577     12.4596  7.4421     318.502     8.39378     138.502     
1 1 1 27 2  78 o 1  21.7495 6.41925 11.861      11.8294  0.0687104   12.3199  2.6421     254.653     3.14652     74.6527     
1 1 1 27 2  79 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 3  0  o 19 247.3   2.74621 1084.98     34.0155  1084.98     34.0155  173.782    180         17.8569     8.84977e-06 
1 1 1 27 3  1  o 13 182.646 2.61626 603.088     24.3313  580.335     23.5646  147.589    342.245     37.7664     342.245     
1 1 1 27 3  2  o 9  235.136 2.91027 993.323     34.2124  968.402     34.3684  170.091    285.343     0.758036    285.343     
1 1 1 27 3  3  f 0  359.52  3.7327  2287.16     68.6305  2302.48     65.8349  284.389    105.671     0           0           
1 1 1 27 3  4  o 12 296.068 3.3435  1558.72     48.439   1552.58     50.7455  238.182    119.156     46.0812     119.156     
1 1 1 27 3  5  o 9  120.419 2.5041  263.681     14.9762  251.163     15.2008  90.4894    226.374     25.18       226.374     
1 1 1 27 3  6  o 8  91.5366 2.61585 148.916     12.1533  148.787     11.794   53.7529    265.031     2.94722     265.031     
1 1 1 27 3  7  o 12 43.3948 3.54679 35.6834     6.96189  32.1097     8.04202  17.9721    128.415     69.6667     128.415     
1 1 1 27 3  8  o 16 147.736 2.46356 393.353     17.8131  380.824     18.6391  130.447    144.157     104.698     144.157     
1 1 1 27 3  9  o 19 269.457 2.95468 1295.4      39.8918  1280.93     39.9049  235.317    168.372     82.0768     168.372     
1 1 1 27 3  10 o 12 408.831 3.83986 2951.45     78.6432  2984.83     78.6992  332.76     110.621     68.0869     110.621     
1 1 1 27 3  11 o 2  85.3639 2.5665  123.872     10.6546  135.202     11.2562  45.3125    129.084     9.56913     129.084     
1 1 1 27 3  12 o 15 490.942 4.46451 4284.09     107.588  4283.31     112.048  325.662    330.026     67.8879     150.026     
1 1 1 27 3  13 o 6  202.091 2.65967 713.916     26.2915  735.004     27.5798  89.725     112.275     111.227     292.275     
1 1 1 27 3  14 o 6  139.819 2.50854 342.767     18.1482  350.947     16.9524  86.2786    320.692     20.3715     140.692     
1 1 1 27 3  15 o 2  89.4722 2.58491 142.635     11.3795  141.819     11.748   9.05319    139.063     139.128     139.063     
1 1 1 27 3  16 o 15 192.182 2.58795 641.791     25.2617  668.567     24.5605  114.721    356.807     44.3407     176.807     
1 1 1 27 3  17 o 19 153.629 2.67369 426.027     20.4368  411.638     20.7053  50.115     44.721      117.201     224.721     
1 1 1 27 3  18 o 18 61.8728 2.9739  78.0791     8.94993  59.0735     9.1992   9.69232    247.235     8.12988     67.2353     
1 1 1 27 3  19 o 8  277.559 3.06626 1397.23     41.7053  1337.41     43.5213  208.741    310.873     17.9975     310.873     
1 1 1 27 3  20 o 18 159.682 2.62367 467.49      21.1692  437.386     20.8145  115.809    61.4925     10.121      61.4926     
1 1 1 27 3  21 o 19 214.505 2.74297 832.339     27.5513  800.462     31.2256  166.844    351.015     29.3944     351.015     
1 1 1 27 3  22 o 18 72.4161 2.78324 90.6849     9.47758  95.9882     10.6405  29.3464    310.592     14.8728     130.592     
1 1 1 27 3  23 o 2  153.094 2.47016 427.325     18.2293  404.31      19.5997  115.721    145.934     20.9432     145.934     
1 1 1 27 3  24 o 10 36.0032 4.38262 25.2823     7.48487  22.1621     7.72849  8.12472    242.623     28.1433     242.623     
1 1 1 27 3  25 o 19 347.849 3.46241 2162.86     59.1873  2135.06     61.4882  283.817    246.471     67.5091     246.471     
1 1 1 27 3  26 o 8  166.955 2.55163 509.264     20.989   480.02      21.6694  122.827    106.44      13.294      106.44      
1 1 1 27 3  27 o 12 90.4055 2.69547 144.87      12.2036  145.724     12.1655  52.7294    176.497     7.61162     356.497     
1 1 1 27 3  28 o 15 53.643  3.4988  56.0309     9.32114  47.2753     9.2278   9.82138    156.007     28.6251     336.007     
1 1 1 27 3  29 o 10 213.604 2.8153  803.683     29.4393  816.292     30.8272  193.506    12.678      86.7853     12.678      
1 1 1 27 3  30 o 17 162.383 2.64831 458.918     21.2039  477.243     21.9001  94.565     259.876     38.9172     79.8761     
1 1 1 27 3  31 f 0  105.418 2.72841 206.234     14.2993  189.069     14.4518  56.388     269.435     0           0           
1 1 1 27 3  32 o 2  25.3961 5.45868 8.69909     7.88737  14.1282     7.50271  45.9211    191.578     116.65      191.578     
1 1 1 27 3  33 o 5  51.9201 3.44526 41.2252     8.50798  56.0602     9.12134  18.1474    263.22      7.97747     83.22       
1 1 1 27 3  34 o 3  34.7705 4.95886 29.6442     7.82708  15.6178     8.77859  50.3037    293.007     142.745     293.007     
1 1 1 27 3  35 o 18 74.1762 3.00417 104.199     10.3122  92.2268     11.7537  11.5387    294.141     75.6416     114.141     
1 1 1 27 3  36 o 7  68.736  3.25828 82.9734     10.3039  85.8884     11.9741  19.1748    86.6877     50.8084     266.688     
1 1 1 27 3  37 o 16 154.654 2.5827  434.22      18.7841  416.027     21.105   125.827    54.5419     38.1212     54.5419     
1 1 1 27 3  38 o 7  181.881 2.67739 584.924     23.2529  591.081     25.5134  105.871    105.672     42.8695     285.672     
1 1 1 27 3  39 o 6  17.9577 5.18792 2.00975     6.70684  2.34832     8.06576  12.599     110.836     30.7078     110.836     
1 1 1 27 3  40 o 12 189.539 2.64451 623.56      23.9189  654.327     26.3085  156.571    294.02      49.7384     294.02      
1 1 1 27 3  41 o 15 112.584 2.70548 213.143     14.7381  238.76      15.7501  84.7431    126.834     17.611      126.834     
1 1 1 27 3  42 o 2  82.4534 2.82993 116.551     10.9266  126.216     12.3885  60.7768    20.1018     15.9548     20.1018     
1 1 1 27 3  43 o 19 74.4178 3.09478 106.88      10.6577  91.5933     12.1012  39.1107    191.733     18.3243     11.7325     
1 1 1 27 3  44 o 15 86.2118 3.00174 132.346     11.5252  133.39      14.1965  46.9877    33.2418     20.2118     213.242     
1 1 1 27 3  45 o 7  98.1619 2.82584 170.335     14.207   173.804     13.5199  65.0117    243.707     0.564827    63.7077     
1 1 1 27 3  46 o 1  130.244 2.67745 297.662     17.4667  307.551     17.444   83.5157    304.539     10.5568     124.539     
1 1 1 27 3  47 o 10 44.703  4.17872 35.0021     8.99502  38.1208     9.26525  17.7767    49.297      16.5254     229.297     
1 1 1 27 3  48 o 17 21.6624 5.68816 3.94618     8.32093  9.1358      8.3733   7.43227    155.044     32.6962     155.044     
1 1 1 27 3  49 o 19 23.2021 5.69711 8.65892     7.45946  9.31844     8.74067  4.44053    288.727     32.2711     288.727     
1 1 1 27 3  50 o 16 49.3328 3.9582  37.5761     9.01867  51.8132     10.1504  25.4077    233.021     11.9821     53.0215     
1 1 1 27 3  51 o 19 204.018 2.92645 743.724     29.0255  746.644     30.7918  152.838    259.359     26.5248     259.359     
1 1 1 27 3  52 o 4  103.334 2.84179 187.532     14.5137  195.48      14.863   67.4092    52.0386     4.49565     232.039     
1 1 1 27 3  53 o 17 106.773 2.79657 203.447     14.5712  205.59      15.2992  65.4345    218.588     13.0303     38.5882     
1 1 1 27 3  54 o 17 13.5174 4.41674 -2.76527    6.78348  -9.54809    7.55776  7.03635    324.054     20.8398     324.054     
1 1 1 27 3  55 o 7  117.85  2.69132 241.326     15.7382  257.196     16.0047  89.1299    326.119     20.2498     326.119     
1 1 1 27 3  56 o 7  76.1185 3.1402  98.1745     11.0649  111.459     12.7985  58.3357    186.137     17.0562     186.137     
1 1 1 27 3  57 f 0  77.5156 3.3236  115.081     11.9843  102.874     13.5338  49.3171    162.498     0           0           
1 1 1 27 3  58 o 15 35.2615 5.47512 25.3812     8.96047  22.6796     9.86326  19.5563    24.9343     0.570859    204.934     
1 1 1 27 3  59 o 12 31.8556 6.11921 19.8621     10.2221  20.0037     9.82157  11.2654    106.932     14.5396     286.932     
1 1 1 27 3  60 o 10 78.7707 3.41927 109.66      13.8131  116.321     13.0013  64.6113    251.196     26.8403     251.196     
1 1 1 27 3  61 o 2  36.7792 5.81141 34.225      10.8933  19.6928     10.2086  21.0593    198.497     15.1625     198.497     
1 1 1 27 3  62 o 16 46.8165 4.60285 36.145      10.5413  47.1593     10.2336  17.3686    141.961     25.1427     321.961     
1 1 1 27 3  63 o 2  79.8533 3.39507 109.828     13.5719  124.095     13.4216  50.4634    135.504     3.13702     315.504     
1 1 1 27 3  64 f 0  21.9861 6.13706 4.04331     9.53867  9.19288     10.5256  18.8625    169.828     0           0           
1 1 1 27 3  65 o 4  82.8611 3.6026  118.609     13.3139  135.735     16.4453  62.6679    97.4899     18.3673     97.4899     
1 1 1 27 3  66 o 8  85.5961 3.57072 135.917     14.7846  135.582     15.695   55.2741    240.403     0.0209959   240.408     
1 1 1 27 3  67 o 2  26.79   6.2387  21.689      10.5878  5.5429      10.3415  11.6008    342.662     4.3823      162.662     
1 1 1 27 3  68 o 14 19.4261 5.95525 0.85078     10.2427  1.5255      11.1739  2.67252    274.955     4.13278     94.9547     
1 1 1 27 3  69 o 8  78.3456 4.17842 105.187     17.1258  127.763     14.9285  61.9332    135.599     25.2541     135.599     
1 1 1 27 3  70 o 16 19.9127 5.98171 11.9552     12.7203  -10.4093    9.34087  3.13699    254.426     8.86071     74.4263     
1 1 1 27 3  71 o 19 20.2322 6.27621 7.4244      13.917   -6.71959    10.6806  4.57983    71.718      3.89541     251.718     
1 1 1 27 3  72 f 0  16.5044 5.49274 -10.3675    13.1478  -7.49123    10.1001  3.51795    332.825     0           0           
1 1 1 27 3  73 o 4  21.0766 6.23421 -12.2822    13.497   11.8229     11.453   4.30946    142.876     12.1256     322.876     
1 1 1 27 3  74 o 17 40.0497 6.9837  44.3798     15.17    27.8905     12.9414  20.865     357.994     5.59057     177.994     
1 1 1 27 3  75 o 9  60.371  5.61922 68.4812     17.4647  82.0687     14.9868  44.5687    126.531     16.1279     126.531     
1 1 1 27 3  76 o 2  42.2537 7.0503  49.8832     16.1529  33.5394     13.3649  29.8044    171.294     14.2635     171.294     
1 1 1 27 3  77 o 13 34.094  7.47183 17.3403     17.8074  38.1325     13.7722  17.5957    231.759     7.68411     231.759     
1 1 1 27 3  78 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 4  0  o 9  380.328 3.59357 2566.87     68.4654  2566.87     68.4654  334.051    180         105.453     180         
1 1 1 27 4  1  o 8  40.2528 3.54702 32.8704     6.96416  25.7688     6.93978  10.2041    188.283     38.7917     188.283     
1 1 1 27 4  2  f 0  293.979 3.11121 1548.88     45.8507  1518.37     45.818   181.39     28.8928     0           0           
1 1 1 27 4  3  o 3  246.791 2.71647 1085.24     33.615   1075.54     33.5778  189.446    302.018     21.7629     302.018     
1 1 1 27 4  4  o 17 278.106 2.91518 1379.5      41.3712  1364.93     39.8803  230.334    49.3284     57.0303     49.3284     
1 1 1 27 4  5  o 15 188.477 2.57761 628.086     25.2064  632.057     23.449   182.522    138.188     103.435     138.188     
1 1 1 27 4  6  o 1  247.951 2.83684 1095.74     36.5143  1085.66     33.9505  192.361    184.44      26.1902     184.44      
1 1 1 27 4  7  o 11 330.857 3.49567 1963.18     60.3008  1923.58     55.5664  244.737    282.998     6.15632     282.999     
1 1 1 27 4  8  o 7  383.408 3.78876 2600.38     72.7167  2620.87     72.8789  317.003    87.6412     73.1555     87.6412     
1 1 1 27 4  9  o 14 119.873 2.53956 256.964     15.0603  253.234     15.412   27.8632    285.728     111.691     105.728     
1 1 1 27 4  10 o 4  209.772 2.66918 790.299     27.3582  770.912     28.7244  170.177    61.2129     41.0197     61.2129     
1 1 1 27 4  11 o 5  325.759 3.32341 1916.94     53.0482  1850.64     55.3829  215.248    126.256     44.848      306.256     
1 1 1 27 4  12 o 2  228.419 2.73808 956.116     30.0111  895.563     32.5168  143.111    171.01      43.4248     351.01      
1 1 1 27 4  13 o 15 402.722 3.79736 2931.69     73.5431  2829.87     79.4934  304.55     292.043     20.6155     292.043     
1 1 1 27 4  14 o 6  253.177 2.85844 1157.26     36.2494  1117.47     36.2763  191.495    80.4311     17.7987     80.4311     
1 1 1 27 4  15 f 0  286.901 3.11706 1477.46     43.8126  1444.3      45.7722  237.382    139.307     0           0           
1 1 1 27 4  16 o 1  109.917 2.45796 209.818     13.1327  219.241     13.9131  63.2796    204.313     19.197      24.3126     
1 1 1 27 4  17 o 3  89.1548 2.69888 148.794     11.7582  133.943     12.2456  26.0313    174.926     64.5899     354.926     
1 1 1 27 4  18 o 8  55.4892 3.19012 57.3491     8.87131  52.7259     8.71129  9.07001    234.145     79.6718     234.145     
1 1 1 27 4  19 o 10 118.156 2.48503 255.608     14.7647  240.224     14.625   88.8676    275.597     23.7422     275.597     
1 1 1 27 4  20 o 14 277.547 3.1988  1361.93     45.4269  1373.05     43.5287  223.72     249.372     47.9017     249.372     
1 1 1 27 4  21 o 4  222.977 2.99369 893.158     34.108   871.792     32.7963  113.927    129.874     92.5641     309.874     
1 1 1 27 4  22 o 18 114.731 2.56812 226.844     14.3519  240.793     15.1456  86.2742    287.23      23.7293     287.23      
1 1 1 27 4  23 o 2  183.69  2.73283 607.584     23.925   590.013     26.294   136.27     102.596     13.5189     102.596     
1 1 1 27 4  24 o 13 47.2134 3.60831 37.7406     8.16478  42.4577     8.63723  0.300128   140.543     33.9879     320.543     
1 1 1 27 4  25 o 5  231.37  2.87863 939.435     33.3061  961.142     33.4472  179.589    40.2106     29.1227     40.2106     
1 1 1 27 4  26 o 15 215.692 2.76132 795.12      28.4582  857.059     31.2452  159.96     241.111     12.8451     241.111     
1 1 1 27 4  27 o 7  42.9518 4.1071  39.9034     8.32818  27.5131     8.57346  17.9765    123.927     83.1173     123.927     
1 1 1 27 4  28 o 7  147.377 2.5836  389.909     18.498   381.397     19.6169  93.2131    293.903     20.0452     113.903     
1 1 1 27 4  29 o 17 217.711 2.83891 838.906     30.2384  844.468     31.6961  178.166    110.186     47.0639     110.186     
1 1 1 27 4  30 o 15 217.561 2.80709 845.101     29.3486  836.091     31.7988  157.918    30.2844     6.30451     30.2843     
1 1 1 27 4  31 o 12 198.063 2.65775 686.637     25.9707  706.651     26.7909  142.557    164.87      4.50017     164.87      
1 1 1 27 4  32 o 7  44.7984 3.97943 33.6876     8.68429  39.0176     8.74986  0.491382   313.347     48.2167     133.347     
1 1 1 27 4  33 o 1  154.709 2.57551 416.966     19.6674  433.321     20.2704  130.507    25.9734     46.2443     25.9734     
1 1 1 27 4  34 o 11 30.9909 5.19534 26.0387     7.93962  9.59731     8.74163  7.01191    218.087     33.8207     218.087     
1 1 1 27 4  35 o 2  27.656  5.32373 19.3402     7.83976  8.63431     7.92896  7.66326    209.171     28.8521     209.171     
1 1 1 27 4  36 o 10 91.3262 2.78044 153.915     12.51    143.292     12.8534  32.8405    288.643     58.6191     108.643     
1 1 1 27 4  37 o 17 102.109 2.59475 185.735     12.8345  185.397     13.6635  45.7321    246.592     48.4123     66.5922     
1 1 1 27 4  38 o 19 71.9541 2.92549 95.6008     10.1241  89.333      10.8369  48.7605    323.424     8.38309     323.424     
1 1 1 27 4  39 o 17 104.234 2.60762 200.044     13.0744  187.015     14.0606  74.9244    340.448     9.2143      340.448     
1 1 1 27 4  40 o 1  27.6434 5.47212 15.7173     7.69703  12.5503     8.14514  7.09802    146.157     33.205      146.157     
1 1 1 27 4  41 o 1  26.5694 5.64679 15.595      7.97703  9.86375     8.56457  9.76596    243.461     38.9185     243.461     
1 1 1 27 4  42 o 5  118.013 2.66268 243.199     15.6108  253.373     15.8426  73.2602    216.217     14.7882     36.2172     
1 1 1 27 4  43 o 3  49.3301 4.01767 40.1056     9.4091   48.4987     10.0712  23.5706    248.469     2.51814     248.469     
1 1 1 27 4  44 o 10 30.5141 5.67877 13.5637     8.099    21.7952     9.6506   0.946691   69.1285     24.0186     69.1286     
1 1 1 27 4  45 o 16 92.7479 3.14562 160.451     14.1115  147.792     14.9743  60.7552    51.0816     2.81571     231.082     
1 1 1 27 4  46 o 6  77.1694 3.14715 99.5707     11.0358  114.334     13.2108  49.5781    345.102     3.12388     165.102     
1 1 1 27 4  47 o 10 36.9988 5.18889 28.2407     8.17392  23.1518     10.2563  18.4188    285.596     0.0338983   285.597     
1 1 1 27 4  48 o 2  80.4593 3.22155 105.252     11.5877  127.994     14.3149  66.7541    60.3228     26.6415     60.3228     
1 1 1 27 4  49 o 11 76.3707 3.16098 100.169     11.8156  109.725     12.2717  70.4892    221.153     41.8217     221.153     
1 1 1 27 4  50 o 13 39.4599 4.8182  30.6506     8.57931  27.6312     9.6978   25.0356    84.6417     8.62503     84.6417     
1 1 1 27 4  51 o 15 97.3897 2.83111 164.767     13.2904  175.663     14.2889  77.3793    128.099     23.8429     128.099     
1 1 1 27 4  52 o 9  111.065 2.85894 220.643     15.4779  222.317     16.2864  72.9186    281.214     4.55016     101.214     
1 1 1 27 4  53 o 6  140.144 2.91922 356.149     18.4501  349.746     22.2807  100.916    36.5221     11.7246     36.5221     
1 1 1 27 4  54 o 5  21.2273 5.68135 6.0993      7.82257  6.79959     8.75411  1.22397    283.974     2.75297     103.974     
1 1 1 27 4  55 f 0  19.0667 5.48472 3.68666     7.6698   2.65829     8.80346  1.04792    110.553     0           0           
1 1 1 27 4  56 o 19 43.0187 4.91718 36.5797     10.0398  33.35       10.4019  29.409     317.962     7.45201     317.962     
1 1 1 27 4  57 o 12 72.919  3.35382 98.3083     12.0836  94.8469     12.2866  52.0976    237.565     8.64623     237.565     
1 1 1 27 4  58 o 12 47.1323 4.435   42.248      10.3284  40.7757     10.1033  26.0818    220.896     7.53721     40.8956     
1 1 1 27 4  59 o 4  63.6437 3.65694 64.5644     11.5678  84.516      11.3336  45.0065    279.525     7.48951     279.525     
1 1 1 27 4  60 f 0  104.4   3.07742 216.491     15.988   179.609     16.0265  44.1003    11.3231     0           0           
1 1 1 27 4  61 o 4  36.2597 5.61893 21.6918     9.49027  30.5072     10.4292  19.0302    351.887     6.10342     171.887     
1 1 1 27 4  62 o 8  59.1868 4.21701 64.5571     11.4013  66.7355     13.2161  49.5791    21.1958     24.1003     21.1958     
1 1 1 27 4  63 o 10 32.0121 5.67029 30.8942     8.79761  8.56777     11.5472  15.3306    271.511     7.37605     91.5108     
1 1 1 27 4  64 o 8  32.0155 6.01068 16.1352     9.42783  26.052      10.4279  19.8763    26.0835     4.55068     26.0835     
1 1 1 27 4  65 o 1  76.1903 3.71627 118.165     12.2764  98.2951     15.2884  50.9033    290.939     3.40114     290.939     
1 1 1 27 4  66 o 10 19.9975 5.70135 12.071      10.0254  -11.0421    10.2766  4.35273    1.50055     5.99437     181.501     
1 1 1 27 4  67 o 2  73.3083 4.04237 97.7252     14.4435  105.061     15.024   52.785     274.647     12.2254     274.647     
1 1 1 27 4  68 o 1  33.2743 6.77945 22.9969     13.5006  24.345      10.5717  16.0815    13.3466     5.17479     193.347     
1 1 1 27 4  69 o 12 44.172  6.1014  43.2435     14.5311  37.4609     11.4964  32.1358    80.2004     12.7775     80.2004     
1 1 1 27 4  70 o 19 21.9741 6.08178 -9.60282    13.3413  13.7786     9.7662   3.66948    55.3031     15.3868     235.303     
1 1 1 27 4  71 o 2  48.0527 6.35013 39.4578     15.4674  57.2715     13.5536  26.7851    7.04549     5.52305     187.046     
1 1 1 27 4  72 o 19 23.0083 6.58609 17.6058     14.0735  -4.81549    10.9497  6.04227    164.769     1.38376     164.769     
1 1 1 27 4  73 o 11 20.6386 6.31388 -5.55467    14.3824  6.99463     10.8862  5.46768    319.376     1.94427     139.376     
1 1 1 27 4  74 o 3  23.0103 6.72456 4.15837     14.3115  10.435      11.4919  7.40006    222.452     3.89875     42.4522     
1 1 1 27 4  75 o 1  40.5259 6.43848 65.6278     15.5324  12.8963     13.308   28.8135    7.01801     18.4514     7.01801     
1 1 1 27 4  76 o 17 40.2975 7.65922 54.0856     17.8285  28.1197     14.4821  25.7223    33.7292     8.84628     33.7292     
1 1 1 27 4  77 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 5  0  o 19 378.533 3.59186 2542.89     68.1093  2542.89     68.1093  326.097    3.05141e-06 91.5083     3.0514e-06  
1 1 1 27 5  1  o 13 111.222 2.3932  213.556     13.0553  225.713     13.5938  15.0691    142.365     125.208     322.365     
1 1 1 27 5  2  o 4  301.944 3.10066 1620.37     47.7713  1615.58     46.0515  245.071    253.694     49.5392     253.694     
1 1 1 27 5  3  o 4  104.182 2.33341 191.185     12.1208  194.179     12.2139  66.0383    69.1056     1.70036     249.105     
1 1 1 27 5  4  f 0  184.251 2.519   606.22      23.6907  598.091     22.8252  193.271    292.901     0           0           
1 1 1 27 5  5  o 12 245.603 2.69286 1076.07     33.1372  1064.11     33.1502  202.444    38.9992     49.7931     38.9992     
1 1 1 27 5  6  o 9  155.736 2.36423 432.722     18.4284  427.556     18.4743  142.179    159.666     73.1809     159.666     
1 1 1 27 5  7  o 1  258.286 2.86996 1191.63     37.8449  1175.72     36.4462  225.669    258.732     77.9183     258.732     
1 1 1 27 5  8  o 14 238.427 2.76026 994.828     32.9439  1022.37     33.015   152.749    239.708     40.4988     59.7084     
1 1 1 27 5  9  o 5  186.483 2.60295 615.368     25.1685  618.406     23.448   153.895    316.411     43.7047     316.411     
1 1 1 27 5  10 o 15 36.9902 4.06168 23.5493     7.44918  26.2539     7.07897  28.1851    68.0864     85.5032     68.0864     
1 1 1 27 5  11 o 8  168.361 2.58123 516.892     22.1053  488.932     21.4526  104.981    43.2179     29.3404     223.218     
1 1 1 27 5  12 o 14 208.427 2.69515 772.668     28.605   768.726     27.6922  183.686    307.254     70.736      307.254     
1 1 1 27 5  13 o 4  211.675 2.80374 816.931     29.6004  773.366     29.8587  178.319    165.275     54.3181     165.275     
1 1 1 27 5  14 f 0  228.062 2.80649 936.883     31.9583  908.991     32.184   155.85     266.476     0           0           
1 1 1 27 5  15 o 7  155.693 2.58255 431.483     19.1101  428.565     21.132   88.8184    292.156     42.5612     112.156     
1 1 1 27 5  16 o 10 182.44  2.55773 613.319     22.3477  568.05      24.2818  120.554    97.4726     18.9261     277.473     
1 1 1 27 5  17 o 18 102.751 2.57459 204.452     12.5348  171.357     13.7248  75.1554    61.2253     23.3695     61.2253     
1 1 1 27 5  18 o 2  25.2005 5.29392 8.50626     6.68012  14.4991     7.81835  48.2059    310.839     114.183     310.839     
1 1 1 27 5  19 o 8  181.78  2.56886 601.23      23.3354  571.495     23.4536  141.194    65.8669     25.2771     65.8669     
1 1 1 27 5  20 o 18 165.635 2.63736 494.597     21.4239  479.085     22.3317  122.428    177.004     11.816      177.004     
1 1 1 27 5  21 o 14 258.395 3.0167  1196.15     40.532   1174.64     37.5639  193.764    186.732     15.0302     186.732     
1 1 1 27 5  22 o 2  50.6908 3.60643 52.6215     8.44307  40.061      9.31316  4.85528    242.229     6.89757     62.2292     
1 1 1 27 5  23 o 7  39.6974 4.30353 24.5831     7.76549  33.1069     8.79707  23.3885    44.4977     88.0008     44.4977     
1 1 1 27 5  24 o 14 251.752 2.8921  1081.7      36.962   1169.81     35.9227  194.256    49.7986     26.5369     49.7985     
1 1 1 27 5  25 o 8  254.132 2.95694 1126.13     38.2034  1167.93     37.0749  193.487    297.877     21.5794     297.877     
1 1 1 27 5  26 o 3  56.9696 3.35582 57.0807     9.38123  59.0869     9.607    22.8136    65.6416     11.7623     245.642     
1 1 1 27 5  27 f 0  135.662 2.60468 317.8       16.7946  336.269     18.5834  84.8956    317.961     0           0           
1 1 1 27 5  28 o 9  187.667 2.7281  621.404     24.368   629.477     26.8988  93.6505    230.389     80.9331     50.3886     
1 1 1 27 5  29 o 8  145.511 2.59595 375.677     18.6363  376.538     19.204   86.0367    216.702     33.0835     36.7016     
1 1 1 27 5  30 o 8  34.9543 5.16331 20.9446     8.35435  24.4248     9.16131  8.94929    297.877     49.4996     297.877     
1 1 1 27 5  31 o 18 23.3778 5.62747 7.08356     7.70101  10.9309     8.17409  13.7464    108.899     38.2385     108.899     
1 1 1 27 5  32 o 16 20.3099 5.22754 -2.4713     7.82872  10.8301     7.50771  22.1112    293.723     55.2939     293.723     
1 1 1 27 5  33 o 18 62.4607 3.21985 71.2879     9.97291  68.3078     10.0404  28.645     267.39      19.7156     87.39       
1 1 1 27 5  34 o 9  139.947 2.70975 348.238     18.5592  348.602     19.4046  110.388    320.796     26.5289     320.796     
1 1 1 27 5  35 o 13 125.273 2.62377 276.66      16.4508  281.8       16.4556  84.1164    117.909     5.30068     297.909     
1 1 1 27 5  36 o 8  171.234 2.6743  507.686     22.9403  535.408     22.9454  141.03     185.397     42.365      185.397     
1 1 1 27 5  37 o 17 152.518 2.61579 411.032     20.1189  416.462     19.8646  110.202    223.87      7.4486      223.87      
1 1 1 27 5  38 o 7  203.1   2.756   743.279     27.7284  725.246     28.3589  135.738    163.352     14.5943     343.352     
1 1 1 27 5  39 o 15 66.5399 3.33559 89.0977     11.1063  70.2791     10.8928  48.9512    85.6379     24.1418     85.6379     
1 1 1 27 5  40 o 19 52.7869 3.76656 46.9913     9.51784  53.8421     10.134   26.7758    76.0478     5.81185     256.048     
1 1 1 27 5  41 o 3  41.3436 4.55385 32.8566     8.78483  30.0801     9.41572  3.25862    340.306     40.7372     160.306     
1 1 1 27 5  42 o 11 77.4401 3.13282 108.378     11.5798  106.495     12.6011  50.4134    71.1352     0.183092    71.1339     
1 1 1 27 5  43 o 19 148.204 2.63263 388.175     18.648   395.037     20.413   138.24     163.533     73.4581     163.533     
1 1 1 27 5  44 o 4  39.6403 4.74196 36.5499     8.06015  22.4151     9.50723  15.9291    139.241     9.5087      319.242     
1 1 1 27 5  45 o 3  31.7005 5.48032 18.9087     7.88676  19.1106     9.39328  7.39739    91.5796     17.5562     271.58      
1 1 1 27 5  46 o 3  114.113 2.63639 236.466     14.9074  228.842     15.196   82.0924    82.1903     7.32658     82.1903     
1 1 1 27 5  47 o 14 55.399  3.63599 57.6564     9.5355   53.6681     10.356   19.1599    337.347     35.3663     157.347     
1 1 1 27 5  48 o 3  86.9299 3.00913 127.775     13.0485  143.854     13.0536  76.3882    194.716     36.5216     194.716     
1 1 1 27 5  49 o 2  33.3082 5.22435 25.5973     8.32522  16.7839     8.75378  16.0109    69.9541     2.82304     249.954     
1 1 1 27 5  50 o 2  17.5728 5.2229  -2.72135    7.66492  4.10334     8.24225  10.835     309.454     38.2857     309.454     
1 1 1 27 5  51 o 12 81.6533 3.17374 115.266     12.63    125.442     13.2452  54.7053    358.416     0.215964    178.416     
1 1 1 27 5  52 o 6  42.294  4.6738  32.4053     9.24289  34.6215     9.924    12.7022    141.722     28.7902     321.722     
1 1 1 27 5  53 o 13 43.6306 5.00887 32.2552     9.87171  39.8182     11.299   27.35      91.8744     1.06457     91.8744     
1 1 1 27 5  54 o 14 115.958 2.98519 241.696     16.8048  242.917     17.8184  80.5011    132.792     4.38414     132.792     
1 1 1 27 5  55 o 3  33.1366 5.99162 19.529      9.25783  23.5423     10.7321  17.2177    123.9       2.02631     303.9       
1 1 1 27 5  56 o 18 57.004  4.0224  61.4854     10.2629  58.3001     12.226   28.2111    359.792     18.1064     179.792     
1 1 1 27 5  57 o 14 75.9707 3.3845  100.505     11.5572  109.631     14.0435  49.0333    347.97      2.47956     167.97      
1 1 1 27 5  58 o 3  56.1604 4.07677 50.2285     9.87259  67.2692     12.8064  29.236     241.532     14.8103     61.532      
1 1 1 27 5  59 o 2  51.6384 4.58132 49.9341     9.87683  50.5034     13.0208  36.6971    149.706     7.41369     149.706     
1 1 1 27 5  60 o 15 50.3222 4.69417 48.578      9.76719  47.4978     12.9518  25.901     159.485     13.1613     339.485     
1 1 1 27 5  61 o 1  44.7279 5.12325 40.0037     10.3808  37.582      11.7006  21.1664    47.9187     14.7473     227.919     
1 1 1 27 5  62 o 8  44.064  5.2904  42.3661     10.292   33.9005     11.9177  32.67      340.108     11.1273     340.108     
1 1 1 27 5  63 o 11 79.239  3.59989 113.668     13.7993  119.053     14.6404  66.4626    109.185     30.181      109.185     
1 1 1 27 5  64 o 10 19.6616 5.73349 4.6499      8.86522  3.01908     9.45633  1.38641    71.8152     23.8343     71.8152     
1 1 1 27 5  65 o 13 36.8266 6.01165 25.733      11.3215  30.1921     10.4627  12.5699    125.355     20.1687     305.355     
1 1 1 27 5  66 o 12 30.9679 6.24488 19.2328     9.78272  20.9477     10.5483  6.99443    142.354     22.8339     322.354     
1 1 1 27 5  67 o 3  18.3923 5.69732 0.934864    10.3028  -0.61865    9.74712  1.50538    149.677     7.70968     329.677     
1 1 1 27 5  68 o 12 19.8111 5.91916 2.98374     10.6764  3.26735     9.52612  2.3494     251.39      1.95609     71.3903     
1 1 1 27 5  69 o 9  17.5769 5.52349 -6.87625    10.4834  2.21737     9.54725  2.22041    70.2791     5.66131     250.279     
1 1 1 27 5  70 o 14 45.4058 6.2904  33.6844     15.0867  52.8367     12.0523  28.6136    236.398     1.82454     236.398     
1 1 1 27 5  71 o 1  32.1792 7.38226 24.4578     15.0288  21.9879     12.25    6.50355    222.347     25.4256     42.3466     
1 1 1 27 5  72 o 6  23.2194 7.00767 10.3253     14.4704  0.679978    14.7737  7.18383    308.614     1.12209     308.614     
1 1 1 27 5  73 o 1  23.6551 6.9263  -9.06901    14.6576  18.9599     14.9026  8.21971    226.859     3.49949     46.8595     
1 1 1 27 5  74 o 4  25.4673 7.41658 15.7646     15.3731  8.58045     15.4048  8.8798     49.1301     1.24712     229.13      
1 1 1 27 5  75 o 11 22.5242 7.06331 8.92942     16.3733  0.128363    15.4925  3.04705    231.13      1.85847     51.1297     
1 1 1 27 5  76 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 6  0  o 5  11.6743 5.12837 1.57542     6.02145  1.57542     6.02145  0.785464   0.00067099  1.62316     0.000670989 
1 1 1 27 6  1  o 5  193.237 2.55862 667.643     24.7911  657.144     24.7628  169.207    288.035     63.3847     288.035     
1 1 1 27 6  2  o 18 80.5416 2.51489 117.9       10.1564  112.711     10.0925  17.1014    58.9093     70.4897     238.909     
1 1 1 27 6  3  o 12 294.22  3.03873 1568.17     44.7908  1504.81     44.8042  156.161    191.283     119.586     11.283      
1 1 1 27 6  4  o 3  436.175 3.91056 3390.29     85.4775  3370.13     85.48    314.276    120.647     14.4325     300.647     
1 1 1 27 6  5  o 11 178.593 2.48399 572.407     21.7857  559.158     22.6569  119.871    341.494     16.0978     161.494     
1 1 1 27 6  6  o 14 255.589 2.77648 1145.41     35.5596  1172.84     35.5625  243.587    40.3279     117.973     40.3279     
1 1 1 27 6  7  o 8  115.864 2.38229 250.236     13.8064  226.672     13.8039  76.4762    117.272     3.20277     297.272     
1 1 1 27 6  8  o 7  112.028 2.37585 221.928     13.5446  223.677     13.0965  31.0877    156.178     94.1244     336.178     
1 1 1 27 6  9  o 6  261.455 2.86415 1212.46     36.7724  1213.68     38.2691  224.181    164.706     68.9456     164.706     
1 1 1 27 6  10 o 4  64.5287 2.79166 70.2838     8.95478  78.1464     8.99612  20.725     277.397     19.2715     97.3974     
1 1 1 27 6  11 o 19 145.833 2.45906 373.676     18.2915  380.855     17.6381  65.0313    29.48       77.4373     209.48      
1 1 1 27 6  12 o 1  77.0671 2.63761 103.831     10.3588  107.432     9.94021  38.7472    17.621      8.46054     197.621     
1 1 1 27 6  13 o 5  91.7078 2.58184 143.598     12.0356  155.417     11.6132  62.8922    210.933     21.7426     210.933     
1 1 1 27 6  14 o 8  60.7306 3.33862 61.8588     10.7     70.0519     9.27681  2.88083    147.444     79.2545     147.444     
1 1 1 27 6  15 o 19 242.033 2.81818 1036.87     35.3826  1042.44     32.9312  176.034    93.419      1.48406     93.419      
1 1 1 27 6  16 o 7  88.0506 2.72249 137.336     11.8487  138.36      12.119   46.15      350.564     27.9132     350.564     
1 1 1 27 6  17 o 18 203.029 2.77769 758.416     28.089   705.278     28.3949  140.985    150.013     10.1206     330.013     
1 1 1 27 6  18 o 15 28.5418 5.14912 14.9315     7.0734   15.2167     7.70541  20.9442    56.2034     57.3765     56.2034     
1 1 1 27 6  19 o 14 321.34  3.61652 1874.86     52.4479  1796.14     63.2671  255.979    328.537     44.4204     328.537     
1 1 1 27 6  20 o 13 49.0974 3.75664 44.9123     9.06108  41.8287     9.11751  4.07116    230.504     62.7172     230.504     
1 1 1 27 6  21 o 9  211.649 2.71284 820.779     28.0374  770.033     29.4271  159.737    48.1517     15.0683     48.1517     
1 1 1 27 6  22 o 13 43.6737 4.0231  32.8027     8.47067  36.2588     8.71358  5.98276    308.4       58.0909     308.4       
1 1 1 27 6  23 o 9  84.6441 2.87462 136.582     10.9934  118.788     13.0389  40.1618    173.278     33.1289     353.278     
1 1 1 27 6  24 o 19 219.568 2.7456  877.301     29.3652  835.109     30.9812  142.2      193.965     32.2284     13.965      
1 1 1 27 6  25 o 8  149.93  2.46236 394.466     18.2396  403.622     18.7634  80.8941    355.81      51.7651     175.81      
1 1 1 27 6  26 o 18 27.9189 5.13511 22.4411     7.88261  5.83709     7.88452  10.1526    67.6636     34.9573     67.6636     
1 1 1 27 6  27 o 17 82.6378 2.78577 121.468     11.225   121.729     11.7758  28.5046    48.3397     55.3883     228.34      
1 1 1 27 6  28 o 2  27.1568 5.65892 10.9987     8.18183  15.8013     8.39503  24.231     150.264     72.1505     150.264     
1 1 1 27 6  29 o 13 97.0896 2.75632 161.93      13.189   173.732     13.5769  65.2441    97.7894     0.939562    277.789     
1 1 1 27 6  30 o 14 187.887 2.65252 629.883     24.822   624.696     25.1267  145.54     154.774     24.0213     154.774     
1 1 1 27 6  31 o 5  141.042 2.55626 354.931     17.2446  352.26      18.8316  84.9114    61.3612     28.9719     241.361     
1 1 1 27 6  32 o 6  98.9192 2.7354  177.443     12.5856  171.065     14.383   65.8012    94.7601     3.07688     274.76      
1 1 1 27 6  33 o 3  119.864 2.58262 250.551     14.9882  260.792     16.0016  96.9375    357.622     29.0229     357.622     
1 1 1 27 6  34 o 5  94.2904 2.76713 161.988     12.0172  154.932     13.9524  72.4277    57.4061     18.8099     57.4061     
1 1 1 27 6  35 o 15 135.988 2.76299 333.387     18.8661  325.359     18.753   79.3851    289.69      32.0154     109.69      
1 1 1 27 6  36 o 14 114.242 2.87133 231.806     16.7961  233.616     16.0162  81.76      22.2983     6.07232     22.2982     
1 1 1 27 6  37 o 4  68.2827 3.5354  76.9286     12.0728  90.8252     11.866   51.6164    335.063     30.1144     335.063     
1 1 1 27 6  38 o 6  177.392 3.07774 538.414     28.1304  585.114     26.4285  152.083    264.431     55.9148     264.431     
1 1 1 27 6  39 o 15 102.481 3.10322 185.491     15.5664  190.099     16.2337  77.4034    161.256     16.2357     161.256     
1 1 1 27 6  40 o 16 53.984  3.84332 50.8423     10.1694  54.711      10.3367  24.6488    277.469     15.766      97.4687     
1 1 1 27 6  41 f 0  26.95   5.80761 14.4591     8.4631   12.1462     8.6887   15.57      20.0242     0           0           
1 1 1 27 6  42 o 10 73.0088 3.074   91.4742     11.1833  99.7744     11.1923  42.6803    247.428     11.8792     67.4276     
1 1 1 27 6  43 o 16 132.424 2.68166 292.224     17.3819  334.743     18.1564  114.655    34.9309     46.4658     34.9309     
1 1 1 27 6  44 f 0  41.3129 4.56045 29.754      9.19835  33.4462     9.0331   31.4099    291.767     0           0           
1 1 1 27 6  45 o 3  71.9342 3.18131 93.0788     11.0617  93.0607     11.7488  55.3374    164.508     14.5011     164.508     
1 1 1 27 6  46 o 3  43.3813 4.57589 41.1702     9.18219  29.0658     9.74634  15.5183    268.811     24.81       88.8107     
1 1 1 27 6  47 o 4  22.2186 5.61226 11.1664     7.64149  3.053       8.95318  1.88067    357.488     10.119      177.488     
1 1 1 27 6  48 o 14 83.5601 3.20379 128.038     12.5212  123.659     14.124   41.2829    328.71      31.377      148.71      
1 1 1 27 6  49 o 17 80.9261 3.2437  122.661     12.5364  113.876     13.5853  58.8025    232.241     8.56236     232.241     
1 1 1 27 6  50 o 17 51.2698 4.25449 54.1901     10.0757  43.1215     11.0533  43.9383    231.322     27.9792     231.322     
1 1 1 27 6  51 o 5  17.2548 5.18919 -3.65651    7.72609  3.72835     8.31658  1.83678    80.0906     12.8803     80.0906     
1 1 1 27 6  52 o 18 57.9062 3.78076 59.5432     10.6058  63.2289     11.0912  38.7775    287.433     1.89169     287.433     
1 1 1 27 6  53 o 15 89.0673 3.05775 150.519     13.101   136.165     14.0199  81.4684    274.929     44.473      274.929     
1 1 1 27 6  54 o 7  75.9856 3.34596 104.33      11.7827  105.332     13.5143  55.2633    316.613     9.49676     316.613     
1 1 1 27 6  55 o 13 66.7653 3.46187 87.4871     10.7115  75.2208     12.0717  34.9292    207.14      18.8597     27.1399     
1 1 1 27 6  56 o 6  91.1653 2.97318 145.175     12.7774  155.471     14.3121  65.9907    178.736     10.029      178.736     
1 1 1 27 6  57 f 0  22.6713 5.75858 11.8123     7.95298  3.95031     9.49762  23.6048    355.504     0           0           
1 1 1 27 6  58 o 10 96.2931 3.06813 173.704     14.3048  163.194     15.1749  81.2882    26.1781     34.4445     26.1781     
1 1 1 27 6  59 o 2  49.0941 4.4003  39.1062     9.79117  52.3836     11.3689  33.6845    173.265     4.55575     173.265     
1 1 1 27 6  60 o 4  27.7835 5.76698 21.0945     8.55583  8.46577     9.77305  0.577716   190.399     33.1424     10.3995     
1 1 1 27 6  61 o 9  63.3786 3.66179 76.4764     11.0691  72.6735     11.9342  40.5329    216.048     1.67571     36.0477     
1 1 1 27 6  62 o 2  44.8103 5.14134 44.5862     9.84289  34.3918     11.9143  20.4964    81.0576     16.1564     261.058     
1 1 1 27 6  63 o 19 56.169  4.45923 56.4285     11.8822  64.4319     12.7903  33.3815    289.058     5.47979     109.058     
1 1 1 27 6  64 o 15 32.9398 6.51838 24.6909     10.9721  21.1616     11.4748  14.07      100.927     10.9962     280.927     
1 1 1 27 6  65 o 11 23.1987 6.39541 12.0399     10.8508  4.62879     10.9872  4.85019    18.7481     14.1344     198.748     
1 1 1 27 6  66 o 17 21.0531 6.40469 -1.2642     9.01274  9.2572      14.935   1.2264     188.267     0.680598    8.26737     
1 1 1 27 6  67 o 16 29.4065 7.02821 26.8714     12.9153  6.84206     14.0202  15.5747    174.566     2.7884      174.566     
1 1 1 27 6  68 o 5  31.6434 7.10662 11.1126     12.0189  32.5351     14.5874  12.9325    276.203     11.0789     96.2031     
1 1 1 27 6  69 o 3  28.2709 6.7825  24.0681     11.9272  7.11363     12.8263  15.3664    91.7398     6.98984     91.7398     
1 1 1 27 6  70 o 12 35.9835 7.30803 27.8086     12.6545  30.7916     15.1235  24.5438    81.5142     9.02625     81.5142     
1 1 1 27 6  71 o 16 20.7727 6.37575 -10.4116    11.0922  12.7138     14.5017  4.45225    43.0885     11.361      223.089     
1 1 1 27 6  72 o 16 22.2405 6.41883 -0.9141     11.9286  13.4681     11.8312  6.71212    204.761     2.36122     24.7608     
1 1 1 27 6  73 o 11 19.4649 6.01319 8.18449     11.5565  -7.38536    11.7424  2.65149    105.53      5.6216      285.53      
1 1 1 27 6  74 o 14 23.6222 7.11862 10.0134     17.6115  8.32237     12.1344  4.60187    72.11       1.63751     252.11      
1 1 1 27 6  75 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 7  0  o 14 68.7699 2.82189 84.7037     9.64961  84.7037     9.64961  12.5307    360         73.3123     180         
1 1 1 27 7  1  o 17 265.391 2.96794 1253.75     40.1805  1246.53     38.7567  189.02     117.919     10.5298     297.919     
1 1 1 27 7  2  o 6  67.8377 2.74503 78.7006     9.26817  85.2206     9.30801  3.54002    21.5144     78.9573     201.514     
1 1 1 27 7  3  o 4  141.735 2.353   362.813     16.7198  349.912     16.7027  104.243    35.5738     10.0642     35.5738     
1 1 1 27 7  4  o 13 96.8467 2.59875 158.961     12.7006  174.522     12.4445  32.2209    307.899     67.8899     127.899     
1 1 1 27 7  5  o 10 289.103 2.96684 1475.43     42.9653  1491.72     43.0019  213.929    142.587     4.01012     142.587     
1 1 1 27 7  6  o 1  115.447 2.43339 238.319     14.319   234.978     13.8047  100.458    235.586     58.8727     235.586     
1 1 1 27 7  7  o 19 298.075 3.11504 1588.54     47.4002  1566.38     45.6575  187.884    347.231     61.9985     167.231     
1 1 1 27 7  8  o 6  229.036 2.64273 926.468     30.3221  935.192     30.3437  171.559    356.109     10.2232     356.109     
1 1 1 27 7  9  o 17 150.709 2.48366 412.918     19.0799  393.14      18.4384  84.4348    348.068     46.3185     168.068     
1 1 1 27 7  10 o 14 108.079 2.46918 213.985     13.3243  201.036     13.3767  40.361     163.034     69.762      343.034     
1 1 1 27 7  11 o 18 136.18  2.43149 340.571     16.5407  317.876     16.6143  80.7446    249.911     30.9351     69.9108     
1 1 1 27 7  12 f 0  51.3175 3.31723 38.0214     8.26542  57.3147     8.30719  11.6664    168.078     0           0           
1 1 1 27 7  13 o 17 312.89  3.20154 1735.23     51.1166  1742.3      49.2638  209.125    357.672     40.4854     177.672     
1 1 1 27 7  14 o 3  51.6309 3.35428 43.9209     8.47422  51.7551     8.65467  4.8806     96.3051     69.6517     96.3051     
1 1 1 27 7  15 o 1  104.862 2.59608 201.747     13.894   189.141     13.3504  64.7198    234.292     13.638      54.2916     
1 1 1 27 7  16 o 15 103.975 2.58788 194.339     13.3927  189.9       13.5308  32.0721    23.5174     81.5712     203.517     
1 1 1 27 7  17 o 12 184.118 2.61287 605.283     24.0315  598.17      24.1842  148.798    267.919     33.3971     267.919     
1 1 1 27 7  18 o 8  63.0821 3.1407  73.7973     10.4598  68.3426     9.26905  22.2705    162.549     32.6391     342.549     
1 1 1 27 7  19 o 9  225.426 2.74266 881.034     30.8902  923.809     31.0688  184.496    198.67      42.6632     198.67      
1 1 1 27 7  20 o 6  269.253 3.1832  1299.84     45.0144  1276.86     40.8215  168.694    332.059     55.0482     152.059     
1 1 1 27 7  21 o 17 207.636 2.77609 795.081     29.9093  736.814     27.874   137.485    188.492     25.5705     8.49222     
1 1 1 27 7  22 o 15 213.34  2.84289 818.779     30.2627  798.299     30.5186  171.955    183.63      36.1005     183.63      
1 1 1 27 7  23 o 8  210.637 2.86782 829.318     28.6455  748.308     31.6124  165.16     302.391     26.6614     302.391     
1 1 1 27 7  24 o 19 106.54  2.7632  222.579     14.0379  182.284     15.168   96.3294    313.458     51.6564     313.458     
1 1 1 27 7  25 o 9  329.201 3.52298 1956.31     56.6143  1902.15     59.5398  272.386    185.17      67.2012     185.17      
1 1 1 27 7  26 o 19 143.502 2.56108 376.299     17.7351  355.713     19.0122  99.3818    344.664     4.64976     164.664     
1 1 1 27 7  27 o 16 28.0557 5.49547 18.1976     7.9857   10.624      8.35006  13.705     3.02666     48.409      3.02666     
1 1 1 27 7  28 o 10 214.462 2.95559 829.168     31.3589  806.972     32.1518  151.394    10.811      5.31752     190.811     
1 1 1 27 7  29 o 11 175.347 2.61395 544.718     22.187   548.263     23.731   118.742    255.679     12.8347     75.679      
1 1 1 27 7  30 o 11 113.181 2.64971 223.332     14.3072  232.713     15.7007  80.5881    6.31196     4.12928     6.31197     
1 1 1 27 7  31 o 18 85.4927 2.77119 133         11.471   127.611     12.1812  59.3404    190.397     4.48804     190.397     
1 1 1 27 7  32 o 2  66.3803 3.3388  84.3663     10.7426  73.7086     11.2414  30.1152    53.6264     26.758      233.626     
1 1 1 27 7  33 o 13 40.5334 4.89998 31.0319     8.962    29.6014     10.1707  2.5645     147.704     53.286      147.704     
1 1 1 27 7  34 o 1  30.0363 5.26487 4.7176      8.24546  29.152      9.38813  0.0289756  57.6954     1.17862     237.695     
1 1 1 27 7  35 o 10 80.8189 3.13467 103.805     12.3707  130.671     12.8432  42.369     127.099     24.5097     307.099     
1 1 1 27 7  36 o 5  202.153 2.85937 727.081     26.8742  729.756     30.9234  173.713    137.604     61.6363     137.604     
1 1 1 27 7  37 f 0  115.375 2.83987 245.236     16.128   230.119     16.6285  42.0107    86.2178     0           0           
1 1 1 27 7  38 o 11 100.492 2.89567 184.165     14.2973  176.778     14.7876  94.5412    127.729     57.4068     127.729     
1 1 1 27 7  39 o 2  92.3996 2.8823  150.119     13.3375  155.192     13.2861  62.8399    234.032     0.0487303   234.025     
1 1 1 27 7  40 o 4  41.3728 4.55382 32.172      9.29662  31.0161     8.9733   7.28713    13.1508     2.88393     13.1508     
1 1 1 27 7  41 o 15 46.0149 4.18302 38.8721     9.47252  38.6206     9.3737   5.04974    70.0483     50.1416     250.048     
1 1 1 27 7  42 o 1  101.84  2.86715 179.832     14.2109  191.494     14.9996  83.0907    64.9073     25.7588     64.9073     
1 1 1 27 7  43 o 16 43.6014 4.59657 25.5034     8.84149  46.3679     10.3758  17.3234    145.995     21.6565     325.995     
1 1 1 27 7  44 o 19 77.735  3.22132 98.2213     11.5969  119.847     13.4131  50.5102    6.81143     5.07616     186.811     
1 1 1 27 7  45 o 13 25.1984 5.8824  5.96671     8.03652  16.572      9.74518  5.2294     196.253     5.99956     16.253      
1 1 1 27 7  46 o 5  15.6451 4.98549 -1.61878    7.67303  -6.73172    9.02175  11.3805    271.075     35.8983     271.075     
1 1 1 27 7  47 o 7  30.4639 5.80621 20.823      8.62098  14.6131     9.78551  14.9213    353.653     69.0125     353.653     
1 1 1 27 7  48 o 11 56.9655 3.84589 58.5844     10.6615  60.0957     11.0307  24.2832    97.3637     27.6751     277.364     
1 1 1 27 7  49 o 18 54.0441 4.0637  49.6621     10.4746  57.9276     11.1919  24.2728    12.1372     23.2409     192.137     
1 1 1 27 7  50 o 16 32.419  5.49313 24.4426     8.19784  16.0399     9.67229  17.5922    36.0938     3.54832     36.0938     
1 1 1 27 7  51 o 15 89.1609 3.07355 132.627     12.4506  154.998     14.9498  64.8617    80.1644     9.01467     80.1644     
1 1 1 27 7  52 o 11 34.7699 5.34386 25.9658     8.40546  20.6775     9.69494  16.4941    16.5608     8.77107     196.561     
1 1 1 27 7  53 o 1  50.4538 4.12348 47.027      9.45855  47.2724     10.9399  29.8605    201.977     5.77725     21.977      
1 1 1 27 7  54 o 17 76.914  3.29771 111.609     12.1247  103.498     13.1002  52.574     138.409     2.16298     138.409     
1 1 1 27 7  55 o 17 24.0931 5.83312 6.32328     8.02405  14.4449     9.27073  2.28896    323.751     23.0887     143.751     
1 1 1 27 7  56 o 1  57.3804 3.87928 53.5528     10.4308  68.7236     11.5855  43.0389    101.822     11.1293     101.822     
1 1 1 27 7  57 o 14 30.2326 5.80292 22.3593     8.70491  13.6776     9.81925  18.2007    221.539     3.17979     221.539     
1 1 1 27 7  58 o 4  56.1695 4.05152 64.6122     11.0651  53.576      11.296   36.8316    318.876     0.191124    318.875     
1 1 1 27 7  59 o 14 26.0411 6.12029 15.4756     8.9243   10.3869     10.0908  12.7032    11.8051     1.97111     191.805     
1 1 1 27 7  60 o 18 58.8811 3.89119 62.7014     10.9561  67.1223     11.7449  24.5394    254.299     28.4151     74.2993     
1 1 1 27 7  61 o 9  26.2901 6.2017  13.8077     9.01914  13.6254     10.1754  12.7022    107.743     3.87767     107.743     
1 1 1 27 7  62 o 1  24.1639 6.10042 11.7805     8.76184  9.94459     10.0116  10.1709    354.843     0.801644    174.843     
1 1 1 27 7  63 f 0  58.6111 4.28641 66.397      11.3524  64.6234     13.3086  25.3273    68.2608     0           0           
1 1 1 27 7  64 o 11 22.8472 6.19251 7.58443     9.9422   9.92988     9.95476  5.49418    335.126     11.6262     155.126     
1 1 1 27 7  65 o 7  20.8777 6.09501 4.51077     10.5639  5.4263      10.1412  2.38486    18.6358     15.0983     198.636     
1 1 1 27 7  66 o 12 24.0198 6.48037 7.74758     11.1735  12.2549     10.6955  7.08731    244.302     1.16053     244.302     
1 1 1 27 7  67 o 14 33.2641 6.56868 20.1277     11.891   27.1738     11.1332  11.4518    66.3936     17.3605     246.394     
1 1 1 27 7  68 o 4  36.2526 6.55326 31.8915     12.3976  24.8266     11.5784  22.1853    81.5637     1.51486     81.5637     
1 1 1 27 7  69 o 11 22.7406 6.52364 -3.74525    11.93    15.3988     12.8233  8.449      240.635     4.58271     60.6352     
1 1 1 27 7  70 o 6  24.4398 6.77963 8.96607     12.5823  12.6765     11.7945  10.5888    316.721     1.50292     136.721     
1 1 1 27 7  71 o 8  21.9484 6.46116 10.2333     12.1188  2.78135     11.6585  6.4351     3.58099     3.99679     183.581     
1 1 1 27 7  72 o 7  21.3396 6.43992 5.28887     12.2205  5.82772     12.1034  3.39968    89.8249     1.9081      269.825     
1 1 1 27 7  73 o 17 21.7567 6.47161 0.718702    12.4597  11.653      12.1856  3.64953    276.339     3.71349     96.3393     
1 1 1 27 7  74 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 8  0  o 15 55.076  3.32861 54.9821     9.02673  54.9821     9.02673  3.77454    0.00023784  1.09368     180         
1 1 1 27 8  1  o 3  153.506 2.48206 424.959     19.4962  411.345     18.6927  119.665    277.453     20.7467     277.453     
1 1 1 27 8  2  o 19 131.772 2.42912 314.177     16.035   302.472     16.0157  85.3387    337.59      15.7812     157.59      
1 1 1 27 8  3  o 15 131.369 2.43251 309.103     15.9416  303.748     16.0573  116.368    166.483     52.6744     166.483     
1 1 1 27 8  4  o 12 42.2234 3.76101 34.6625     7.69387  29.8161     7.81505  5.33752    17.843      46.1643     17.843      
1 1 1 27 8  5  o 18 229.96  2.70051 948.477     31.1028  928.842     31.137   163.445    301.963     9.57989     121.964     
1 1 1 27 8  6  o 6  148.182 2.48262 391.113     17.6211  388.182     19.2103  96.3887    62.924      19.4826     242.924     
1 1 1 27 8  7  o 3  190.858 2.64191 650.917     24.2376  642.174     26.2458  150.264    212.541     24.1595     212.541     
1 1 1 27 8  8  f 0  153.944 2.44439 430.597     18.8328  410.597     18.874   52.6171    276.189     0           0           
1 1 1 27 8  9  o 1  170.842 2.5353  530.401     22.0984  505.739     21.3162  154.326    168.916     64.7959     168.916     
1 1 1 27 8  10 o 14 29.4217 5.13286 16.1405     7.56765  15.9687     7.47397  8.05337    243.764     26.0645     243.764     
1 1 1 27 8  11 o 16 65.5276 2.99042 73.802      9.89672  79.4044     9.61482  16.7761    205.689     50.5593     25.6886     
1 1 1 27 8  12 o 10 162.635 2.47395 463.957     20.1366  474.944     20.189   79.5899    198.079     76.7276     18.0791     
1 1 1 27 8  13 o 8  127.623 2.51916 298.061     16.4332  280.716     15.7612  81.7607    110.248     17.7191     290.248     
1 1 1 27 8  14 o 2  47.8502 3.50462 40.3648     8.12106  41.9274     8.44457  11.2326    12.4188     21.4619     192.419     
1 1 1 27 8  15 f 0  117.54  2.42535 234.072     14.1995  257.031     14.3243  67.9731    113.593     0           0           
1 1 1 27 8  16 o 17 203.214 2.50846 736.231     25.5275  729.946     25.5638  151.926    123.513     8.4308      123.513     
1 1 1 27 8  17 o 9  230.654 2.73223 953.114     32.1813  936.592     30.9797  179.255    84.5798     22.4055     84.5798     
1 1 1 27 8  18 o 16 77.789  2.80098 113.941     11.0992  101.764     10.661   52.3124    123.787     4.74234     123.787     
1 1 1 27 8  19 o 1  109.722 2.5708  217.453     14.3763  210.623     13.8573  64.7382    205.286     24.8236     25.2861     
1 1 1 27 8  20 o 17 99.8457 2.71089 180.329     13.6591  174.415     13.4195  90.4021    172.175     50.9091     172.175     
1 1 1 27 8  21 o 15 177.043 2.55866 576.487     24.0019  537.309     21.3963  144.291    350.521     34.0587     350.521     
1 1 1 27 8  22 o 11 209.894 2.6753  787.481     28.6146  778.055     27.6634  175.428    48.5422     47.5397     48.5422     
1 1 1 27 8  23 o 2  248.594 2.87804 1082.9      37.1526  1114.51     34.4615  242.234    90.2634     125.127     90.2634     
1 1 1 27 8  24 o 3  94.2958 2.79943 154.324     12.9755  162.416     13.4245  81.4481    148.682     39.2896     148.682     
1 1 1 27 8  25 o 5  236.648 2.87689 1004.97     33.2872  986.911     34.9126  192.73     346.584     43.2423     346.584     
1 1 1 27 8  26 o 15 139.727 2.51389 355.922     17.8148  338.533     17.3628  106.094    188.776     14.1273     188.776     
1 1 1 27 8  27 o 18 50.6299 3.89823 46.8311     9.45879  45.749      9.98598  19.5584    148.502     18.9864     328.502     
1 1 1 27 8  28 o 17 51.2866 3.86535 56.9269     9.3989   38.9168     9.74918  22.4826    118.161     13.3404     298.161     
1 1 1 27 8  29 o 11 143.303 2.90513 385.191     19.4724  347.02      21.9584  83.5917    32.3821     37.0395     212.382     
1 1 1 27 8  30 o 16 50.4776 4.11096 50.079      10.0296  42.4424     10.2914  16.4256    315.728     29.0666     135.728     
1 1 1 27 8  31 o 1  32.6866 5.80784 23.1708     8.80335  16.6994     10.4242  1.84926    159.537     9.08924     339.537     
1 1 1 27 8  32 o 17 147.414 2.99525 391.838     21.1183  383.521     23.0251  121.914    236.055     35.9009     236.055     
1 1 1 27 8  33 o 9  135.87  2.85068 325.195     19.1098  333.404     19.6686  88.389     175.682     15.0557     355.682     
1 1 1 27 8  34 o 10 113.373 2.80272 221.345     14.9883  237.56      16.8074  69.5638    291.524     19.2871     111.524     
1 1 1 27 8  35 f 0  29.153  5.68545 14.956      8.08903  16.941      9.06551  38.3466    263.846     0           0           
1 1 1 27 8  36 o 11 23.3131 5.57684 4.82169     7.61913  13.1717     8.35793  5.63887    313.016     21.4952     313.016     
1 1 1 27 8  37 o 5  75.2383 3.24745 106.736     11.4992  96.5872     12.7463  59.1334    9.12198     20.0577     9.12198     
1 1 1 27 8  38 o 1  69.6297 3.19414 90.9113     10.6715  83.3227     11.4318  46.0397    324.505     0.657232    144.505     
1 1 1 27 8  39 o 7  61.577  3.31932 69.8402     9.42972  66.772      10.8095  31.538     311.539     19.5981     131.539     
1 1 1 27 8  40 o 18 22.6813 5.52951 12.0596     7.21572  2.96645     9.09605  0.772783   258.438     14.7505     78.4381     
1 1 1 27 8  41 o 10 122.711 2.82813 262.901     16.6878  276.177     18.0478  91.3399    305.852     10.7955     305.852     
1 1 1 27 8  42 f 0  43.2766 5.14469 20.1331     10.1228  53.4522     10.5316  43.6863    197.017     0           0           
1 1 1 27 8  43 o 17 76.7072 3.34377 104.828     12.8132  107.494     12.7672  62.8796    167.598     21.7646     167.598     
1 1 1 27 8  44 o 4  128.799 2.9392  309.766     20.0801  286.015     17.8119  89.421     200.999     0.848171    20.9993     
1 1 1 27 8  45 o 18 17.1353 5.26427 -1.1691     8.66178  -0.416466   8.16333  5.88455    11.6694     25.0432     11.6694     
1 1 1 27 8  46 o 1  120.601 3.13527 273.296     17.8787  251.043     19.7896  109.375    22.3242     52.3755     22.3242     
1 1 1 27 8  47 f 0  42.8598 4.82745 28.5305     9.30653  41.1176     10.7025  40.0439    308.542     0           0           
1 1 1 27 8  48 o 5  35.7853 5.17597 31.8901     8.38925  17.6132     9.50285  14.1457    10.2502     8.92931     10.2502     
1 1 1 27 8  49 o 8  63.0146 3.41145 70.4772     9.98254  74.0145     11.3794  44.1281    89.3818     4.19225     89.3818     
1 1 1 27 8  50 o 17 115.563 2.78101 245.705     15.1086  234.962     16.9497  94.6129    194.203     30.9608     194.203     
1 1 1 27 8  51 o 1  62.266  3.57037 67.2542     10.3163  74.4796     11.7778  44.2813    233.877     5.91068     233.877     
1 1 1 27 8  52 o 16 80.3503 3.11506 116.065     11.7172  117.9       13.234   67.6246    355.928     27.4648     355.928     
1 1 1 27 8  53 o 13 30.7564 5.85228 15.5072     9.0623   21.7837     9.50189  16.8494    23.211      7.38793     23.211      
1 1 1 27 8  54 o 18 51.2829 4.08398 50.2277     9.88419  47.6245     10.6847  23.0302    322.738     21.9161     142.738     
1 1 1 27 8  55 o 16 20.9084 5.76634 3.25964     8.20843  8.52917     9.35332  5.27934    2.03457     9.46625     182.035     
1 1 1 27 8  56 o 14 21.623  5.47829 -3.24606    8.22179  15.1752     8.98038  0.909      143.892     23.0486     323.893     
1 1 1 27 8  57 o 4  39.3268 5.2179  26.1893     9.41235  34.7681     10.4078  22.5041    266.135     4.85546     86.1351     
1 1 1 27 8  58 o 5  19.6945 5.70002 4.703       8.40847  3.23391     9.53651  4.58309    192.551     9.1288      12.5509     
1 1 1 27 8  59 o 10 73.4824 3.52862 98.7499     12.2454  101.4       13.5652  41.1202    68.905      15.4767     248.905     
1 1 1 27 8  60 o 3  21.173  5.70646 11.9551     8.59292  -1.34716    9.77535  1.92232    116.519     19.5091     296.519     
1 1 1 27 8  61 o 11 39.347  5.48867 29.2634     9.88105  33.2351     11.0041  25.7965    230.475     3.44641     230.475     
1 1 1 27 8  62 o 3  55.8562 4.32092 62.1112     10.9527  57.322      12.6336  45.204     12.5362     19.6947     12.5362     
1 1 1 27 8  63 o 15 62.9008 4.04459 73.1601     12.3674  76.9949     12.8545  45.8832    242.008     10.936      242.008     
1 1 1 27 8  64 o 12 33.5264 6.26764 25.1814     11.1846  22.4966     10.1982  21.654     251.725     10.0646     251.725     
1 1 1 27 8  65 o 6  36.1328 6.40938 32.839      12.7994  23.1385     10.4454  21.1573    75.5307     0.609918    255.531     
1 1 1 27 8  66 o 8  31.0041 7.46849 23.2908     15.6463  18.9558     12.169   16.1432    127.458     10.0181     127.458     
1 1 1 27 8  67 o 11 38.2553 6.62891 28.1144     13.011   35.296      12.3415  28.9145    235.026     14.1126     235.026     
1 1 1 27 8  68 o 8  37.1123 6.82903 24.3776     13.4727  36.9194     12.6971  22.6853    289.469     1.24116     289.469     
1 1 1 27 8  69 o 1  27.3569 6.94915 13.6992     12.6344  18.4013     11.8573  6.23119    158.808     19.2612     338.808     
1 1 1 27 8  70 o 8  22.1892 6.56804 10.5058     12.4276  2.8143      12.3932  5.44004    230.492     10.108      50.4917     
1 1 1 27 8  71 o 3  31.1715 7.60226 25.4551     13.4647  22.6687     15.6621  15.8783    232.068     0.0793384   232.067     
1 1 1 27 8  72 o 18 27.3351 7.19148 20.5423     13.2362  14.5334     13.308   9.52494    356.727     0.998227    356.727     
1 1 1 27 8  73 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 9  0  o 10 170.994 2.5438  519.227     21.7767  519.227     21.7767  182.003    180         109.295     180         
1 1 1 27 9  1  o 18 24.6517 5.15104 3.87411     7.73062  16.5206     7.14802  22.0851    26.8837     59.4248     26.8837     
1 1 1 27 9  2  o 16 249.455 2.80065 1113.44     34.9975  1096.68     35.0239  164.071    161.046     39.7777     341.046     
1 1 1 27 9  3  o 19 259.24  2.76182 1180.69     35.8347  1206.12     35.924   156.496    315.755     69.8351     135.755     
1 1 1 27 9  4  o 1  164.441 2.44892 483.84      20.1534  476.073     20.2075  179.128    100.579     127.972     100.579     
1 1 1 27 9  5  o 3  132.661 2.45308 315.008     16.0072  310.162     16.5716  93.2041    108.754     3.5718      288.754     
1 1 1 27 9  6  o 5  228.868 2.70569 933.431     31.0372  926.765     31.0285  187.986    139.586     40.1556     139.586     
1 1 1 27 9  7  o 1  106.8   2.49341 212.987     13.3128  192.65      13.3152  70.2544    111.952     9.52838     291.952     
1 1 1 27 9  8  o 19 162.137 2.45797 468.25      19.6728  465.02      20.2643  105.909    173.571     24.0378     353.571     
1 1 1 27 9  9  o 7  92.7265 2.53704 146.431     11.7555  159.455     11.7626  80.1639    217.355     41.2176     217.355     
1 1 1 27 9  10 o 9  76.0525 2.78665 108.82      10.8093  97.3505     10.3552  43.9738    173.964     29.8413     173.964     
1 1 1 27 9  11 o 14 235.53  2.78601 990.728     32.2148  980.001     33.5326  183.423    30.2932     21.2423     30.2932     
1 1 1 27 9  12 o 17 275.955 2.96399 1360.17     40.2704  1346.2      41.6886  213.506    334.759     20.9698     334.759     
1 1 1 27 9  13 o 4  164.338 2.56301 485.61      21.5045  473.6       20.7116  131.272    281.406     24.9938     281.406     
1 1 1 27 9  14 o 8  68.3262 2.90919 83.0066     9.77173  83.5164     10.0574  35.0532    99.4607     21.1991     99.4607     
1 1 1 27 9  15 o 12 183.683 2.50177 611.222     22.9836  587.224     23.0658  166.258    123.056     66.9499     123.056     
1 1 1 27 9  16 o 11 80.581  2.69627 123.002     10.8173  108.467     10.8609  47.9657    307.867     12.5697     127.867     
1 1 1 27 9  17 o 6  24.4698 5.37305 8.26843     7.35661  12.908      7.37656  21.5939    81.1034     61.3584     81.1034     
1 1 1 27 9  18 o 15 220.381 2.65946 869.447     29.3061  856.53      29.435   151.428    345.546     18.9956     165.546     
1 1 1 27 9  19 o 5  249.613 2.82277 1112.73     35.2486  1102.51     35.3712  188.381    322.221     11.9483     322.221     
1 1 1 27 9  20 o 19 113.959 2.56501 240.556     14.8698  221.603     14.3874  92.3751    198.594     25.6557     198.594     
1 1 1 27 9  21 o 8  27.3368 5.42521 16.5489     7.69406  10.8542     7.99341  14.5691    2.24232     50.7315     2.24232     
1 1 1 27 9  22 o 8  97.3566 2.74346 170.968     13.5467  166.638     13.1706  79.189     218.882     66.2505     218.882     
1 1 1 27 9  23 o 18 53.7825 3.59306 51.5931     10.1394  52.4607     8.94279  26.2244    166.787     9.01494     346.787     
1 1 1 27 9  24 o 19 44.8176 4.44201 31.4358     9.5945   42.2171     9.62624  15.5694    185.629     7.37325     5.62893     
1 1 1 27 9  25 o 17 169.588 2.76915 516.403     23.7631  507.019     23.3061  145.217    99.0262     47.2261     99.0262     
1 1 1 27 9  26 o 13 110.82  2.94962 220.472     16.7353  217.509     15.9639  95.1996    136.758     36.7503     136.758     
1 1 1 27 9  27 o 2  42.1193 4.95295 31.3888     10.231   34.0592     9.91999  13.6016    330.39      12.6745     150.39      
1 1 1 27 9  28 o 13 81.7982 3.08382 118.305     13.2802  120.91      11.8502  60.6228    28.5522     11.586      28.5522     
1 1 1 27 9  29 f 0  154.639 2.65968 430.652     20.1134  421.1       21.0676  120.314    230.885     0           0           
1 1 1 27 9  30 f 0  59.1644 3.35466 64.6892     9.68382  61.166      10.022   24.4805    251.932     0           0           
1 1 1 27 9  31 o 6  22.1607 5.40322 11.556      7.53956  3.74256     7.59518  19.1822    146.583     56.2338     146.583     
1 1 1 27 9  32 o 10 109.801 2.70431 234.661     14.603   196.42      14.9846  104.035    91.2554     58.7801     91.2554     
1 1 1 27 9  33 o 12 72.3638 3.09152 102.256     11.1052  85.8141     11.14    48.9675    100.867     2.96771     100.867     
1 1 1 27 9  34 f 0  30.1668 5.39206 7.6503      7.59213  27.6322     9.78914  32.711     106.555     0           0           
1 1 1 27 9  35 o 4  23.6365 5.81571 6.99627     7.3949   11.7516     9.52228  17.3484    121.729     58.6913     121.729     
1 1 1 27 9  36 o 12 97.2837 3.32602 170.206     13.6631  169.534     18.3014  75.9137    296.994     16.948      296.994     
1 1 1 27 9  37 o 9  135.677 2.78229 335.705     18.1128  322.413     19.6142  103.283    59.5406     14.6521     59.5406     
1 1 1 27 9  38 o 9  60.1777 3.93515 71.645      11.1599  60.1367     12.1031  40.7728    73.9184     0.410496    73.9183     
1 1 1 27 9  39 o 13 28.6039 5.97931 18.4078     8.70879  11.7808     10.0575  8.81835    234.879     53.6871     234.879     
1 1 1 27 9  40 o 1  149.613 2.82851 409.733     20.1673  391.806     22.1223  111.048    220.241     10.6838     220.241     
1 1 1 27 9  41 o 6  79.2122 3.18403 112.063     12.1952  113.99      12.9728  73.9087    162.972     40.6167     162.972     
1 1 1 27 9  42 o 12 93.5266 2.8012  156.461     12.8744  157.504     13.3219  81.0321    36.8918     32.9536     36.8918     
1 1 1 27 9  43 o 15 99.8455 2.74003 166.81      12.9044  191.418     14.4783  94.7205    54.6638     52.0087     54.6638     
1 1 1 27 9  44 o 12 60.3961 3.46531 61.2355     9.76103  71.5346     11.049   36.3636    359.567     8.93607     179.567     
1 1 1 27 9  45 o 12 32.9172 5.68397 16.2222     9.18243  25.9936     9.61918  13.8411    318.954     11.4917     138.954     
1 1 1 27 9  46 o 19 34.7422 5.63181 22.1612     9.16164  24.6493     10.0347  9.39104    214.783     25.1866     34.783      
1 1 1 27 9  47 o 10 68.5746 3.57101 78.0049     12.0651  93.7227     12.2353  53.0915    55.899      13.8178     55.899      
1 1 1 27 9  48 o 13 44.7387 4.72623 40.8087     9.95307  34.6011     10.4697  36.769     242.721     24.0845     242.721     
1 1 1 27 9  49 o 18 26.4521 6.10227 14.6392     9.4269   11.4971     9.21946  10.1391    330.569     1.87957     150.569     
1 1 1 27 9  50 o 16 112.368 2.81619 224.742     15.2781  230.501     16.381   88.114     6.95875     21.9234     6.95875     
1 1 1 27 9  51 o 9  26.041  5.73022 18.6532     8.31699  4.80863     9.89158  8.50214    200.91      11.9839     20.9099     
1 1 1 27 9  52 o 8  29.6415 5.79455 24.175      8.98702  9.45297     10.0552  17.1052    245.365     3.11016     245.365     
1 1 1 27 9  53 o 6  90.9612 3.10638 149.14      13.2567  151.694     14.9381  72.7139    300.661     21.9482     300.661     
1 1 1 27 9  54 o 2  19.1537 5.64126 -0.482534   7.81506  6.13257     10.1744  3.98066    187.182     8.06818     7.18187     
1 1 1 27 9  55 o 17 32.1553 5.94177 13.5376     8.98669  29.0129     10.9021  15.6968    202.632     8.20208     22.6316     
1 1 1 27 9  56 o 7  28.5577 6.08386 16.4445     8.65254  16.4685     10.2436  9.85237    61.4263     15.1272     241.426     
1 1 1 27 9  57 o 15 35.5201 5.96049 22.822      10.0788  28.9191     10.8654  20.1814    188.133     3.72193     8.13289     
1 1 1 27 9  58 o 9  55.438  4.42484 59.6358     11.0436  57.8668     12.9511  42.1096    254.454     12.0729     254.454     
1 1 1 27 9  59 o 1  28.9757 6.33508 15.1178     9.36751  19.9218     10.9204  10.8285    261.103     12.9357     81.1029     
1 1 1 27 9  60 o 6  28.9212 6.34163 19.4875     9.44008  15.0025     11.1987  13.4277    130.935     6.14369     310.935     
1 1 1 27 9  61 o 8  33.3539 5.96941 21.784      9.89497  24.681      10.0937  21.449     207.132     6.08407     207.132     
1 1 1 27 9  62 o 2  47.8608 4.75143 51.8377     11.5059  38.3204     10.5653  40.1437    178.001     22.8184     178.001     
1 1 1 27 9  63 o 15 53.7423 4.73851 58.924      13.6441  53.8941     11.2675  36.6455    39.9139     4.71809     39.9139     
1 1 1 27 9  64 o 7  48.9565 5.46678 56.2409     14.0873  40.8435     11.8676  40.2075    185.631     20.011      185.631     
1 1 1 27 9  65 o 6  20.9712 6.18325 9.54276     11.7826  -0.809934   10.1715  6.93862    346.404     1.1067      166.404     
1 1 1 27 9  66 o 14 48.353  6.40193 48.0248     16.7976  51.114      12.7336  23.4697    114.948     14.5532     294.948     
1 1 1 27 9  67 o 19 23.8945 6.67308 12.1388     12.179   7.94459     11.4836  6.18459    43.5402     14.1786     223.54      
1 1 1 27 9  68 o 17 19.6633 5.73715 -19.128     11.725   13.3955     10.6435  4.50665    249.367     2.65385     69.3667     
1 1 1 27 9  69 o 14 26.7013 6.88486 14.5327     12.5591  17.0827     11.5008  8.85       69.0853     11.1955     249.085     
1 1 1 27 9  70 o 19 18.2352 5.82877 4.64866     11.8968  -9.02393    11.4349  0.989765   7.06771     3.10657     187.068     
1 1 1 27 9  71 o 3  18.4953 6.03053 -9.86024    14.9775  1.10158     11.7621  0.469503   10.974      2.27754     190.974     
1 1 1 27 9  72 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 10 0  o 3  72.3715 2.85591 93.797      10.2836  93.797      10.2836  60.2556    8.00033e-06 18.5645     8.00033e-06 
1 1 1 27 10 1  o 16 26.3989 5.23252 18.047      7.48096  6.94655     7.70657  15.3453    220.61      48.3376     220.61      
1 1 1 27 10 2  o 16 303.573 3.16331 1672.44     49.0495  1605.2      47.2041  206.363    345.246     37.5247     165.246     
1 1 1 27 10 3  o 8  252.857 2.8561  1139.89     36.884   1132.39     35.4902  196.012    135.499     18.4509     135.499     
1 1 1 27 10 4  o 14 262.223 2.82259 1231.91     37.0651  1211.76     37.1163  225.933    339.398     64.7504     339.398     
1 1 1 27 10 5  o 5  164.991 2.49877 477.915     20.6586  488.961     20.6611  129.546    288.387     18.8398     288.387     
1 1 1 27 10 6  o 7  97.1881 2.68538 172.395     13.0942  163.772     13.0092  91.0822    190.261     58.1336     190.261     
1 1 1 27 10 7  o 19 140.96  2.49963 355.573     17.689   350.412     17.6118  94.0288    266.381     16.2612     86.3806     
1 1 1 27 10 8  f 0  91.5891 2.66611 152.581     11.9806  146.017     12.4227  52.9319    297.02      0           0           
1 1 1 27 10 9  f 0  30.5863 5.0311  13.6794     7.61815  21.2585     7.63856  21.6757    311.783     0           0           
1 1 1 27 10 10 o 12 25.481  5.21848 6.75119     7.37054  16.4578     7.37028  17.1719    287.499     52.336      287.499     
1 1 1 27 10 11 o 4  51.7869 3.53684 54.9305     9.19925  41.9043     8.83395  20.2734    36.2013     2.35057     36.2014     
1 1 1 27 10 12 o 7  170.245 2.51411 515.584     21.0022  514.137     21.8865  120.961    132.94      6.38001     312.94      
1 1 1 27 10 13 o 3  121.985 2.44582 270.181     15.2095  258.92      14.6652  99.7599    243.874     26.5355     243.874     
1 1 1 27 10 14 o 7  165.079 2.57724 480.063     20.5819  488.388     22.0462  140.119    218.606     41.1686     218.606     
1 1 1 27 10 15 o 9  118.337 2.43951 253.193     14.45    244.805     14.4504  105.219    213.309     44.6015     213.309     
1 1 1 27 10 16 o 11 95.2496 2.65218 161.125     12.2982  161.896     12.9644  74.3596    89.6511     17.8609     89.6511     
1 1 1 27 10 17 o 1  87.6907 2.66336 141.699     11.8212  132.285     11.5305  28.1315    30.2885     67.7079     210.289     
1 1 1 27 10 18 o 9  29.135  5.20873 14.3945     7.6962   17.2489     7.55532  11.4712    301.511     48.1103     301.511     
1 1 1 27 10 19 o 1  26.1049 5.30825 8.92161     7.40695  15.9508     7.53492  23.2192    183.193     71.651      183.193     
1 1 1 27 10 20 o 17 52.7617 3.67351 52.3519     9.74418  47.9854     9.42698  0.887607   122.873     72.0449     122.873     
1 1 1 27 10 21 o 12 240.181 3.13516 1058.15     38.953   997.613     36.5274  195.766    177.593     40.7303     177.593     
1 1 1 27 10 22 o 13 85.3552 3.16332 129.402     14.0697  130.963     12.8611  35.5619    205.52      48.7056     25.5198     
1 1 1 27 10 23 o 12 145.183 2.88704 361.728     20.9993  389.815     20.945   137.773    117.646     68.9141     117.646     
1 1 1 27 10 24 o 15 94.2434 2.98498 156.324     14.15    160.83      13.9686  77.4651    249.124     25.5348     249.124     
1 1 1 27 10 25 o 12 131.281 2.8884  313.344     17.4452  301.425     20.3369  107.499    330.73      28.1929     330.73      
1 1 1 27 10 26 o 14 113.889 2.66193 232.282     14.6337  230.139     15.686   86.7924    5.57364     12.8805     5.57365     
1 1 1 27 10 27 o 19 109.969 2.79955 220.275     15.5441  211.345     15.2617  42.7236    103.081     71.4892     283.081     
1 1 1 27 10 28 o 15 76.2714 2.99595 116.992     11.6171  91.9666     11.1211  46.6724    295.079     10.1195     115.079     
1 1 1 27 10 29 o 5  95.7243 2.93649 160.292     15.0531  167.329     12.9144  68.7117    86.3504     4.70908     86.3503     
1 1 1 27 10 30 o 8  37.6773 4.6408  19.5748     8.42481  33.8709     8.1382   8.91786    60.2883     16.8063     240.288     
1 1 1 27 10 31 o 3  33.0236 5.00591 13.7444     8.30518  27.7086     7.93119  4.88453    3.01909     15.8861     183.019     
1 1 1 27 10 32 o 18 16.3373 4.90371 2.95775     7.23467  -3.53747    7.08296  6.2024     355.051     16.4699     355.051     
1 1 1 27 10 33 o 6  43.633  4.30954 35.0008     8.86452  34.9223     9.45568  24.7231    186.239     6.52806     186.239     
1 1 1 27 10 34 o 9  77.6414 3.171   112.492     12.1678  104.092     12.3788  72.599     216.854     41.5992     216.854     
1 1 1 27 10 35 o 2  27.4165 5.6295  9.78453     8.72571  17.8937     8.1416   2.47495    179.609     25.141      359.609     
1 1 1 27 10 36 o 12 156.395 2.72098 446.073     20.993   428.361     21.6161  121.658    107.642     20.0571     107.642     
1 1 1 27 10 37 o 7  23.3173 5.6171  2.85389     8.2924   14.2905     8.4478   1.73622    132.528     28.085      132.528     
1 1 1 27 10 38 o 19 42.1573 4.62305 37.8643     9.17218  28.5445     9.52674  21.5752    243.239     15.1226     243.239     
1 1 1 27 10 39 o 2  57.7949 3.77806 53.3591     9.76313  68.795      11.9097  38.3851    6.3084      1.31855     186.308     
1 1 1 27 10 40 o 14 51.6548 3.96522 41.084      9.27352  57.3737     10.9107  31.5843    332.217     5.7908      152.217     
1 1 1 27 10 41 o 12 126.728 3.04303 286.48      17.0424  291.469     21.334   92.8001    251.582     7.0263      251.582     
1 1 1 27 10 42 o 16 81.017  3.3285  115.181     11.8837  122.46      14.9256  86.1674    241.38      65.0023     241.38      
1 1 1 27 10 43 o 12 55.7641 4.01677 49.4221     9.71304  65.4688     12.4761  50.6191    61.6013     30.3614     61.6013     
1 1 1 27 10 44 o 16 25.8111 6.06711 15.8208     8.28484  6.02196     11.3761  8.75291    10.6286     49.8205     10.6286     
1 1 1 27 10 45 o 5  19.7737 5.55678 7.62669     7.65774  -1.95101    9.85104  1.18984    250.052     11.8488     70.0516     
1 1 1 27 10 46 o 12 48.8832 4.53253 44.9289     9.51204  44.3474     11.9441  40.3374    136.849     19.0138     136.849     
1 1 1 27 10 47 o 5  38.4489 5.70416 28.6362     9.91356  28.8565     11.3561  21.2007    201.696     5.90618     21.6957     
1 1 1 27 10 48 o 8  29.9057 5.79922 9.41574     9.08854  25.5216     9.82845  14.1759    358.496     5.44548     358.496     
1 1 1 27 10 49 o 2  49.8091 4.5351  51.6756     10.8169  41.6525     11.1183  20.7882    70.9596     25.2421     250.96      
1 1 1 27 10 50 o 1  142.301 2.83734 348.281     20.0288  383.414     20.3777  122.513    237.006     48.3404     237.006     
1 1 1 27 10 51 o 14 40.6827 5.27237 29.3554     10.3425  34.9761     10.3341  23.8086    270.512     5.03926     90.5117     
1 1 1 27 10 52 o 8  81.0167 3.53116 117.459     14.5455  123.672     13.9559  57.3067    137.157     4.22615     137.157     
1 1 1 27 10 53 o 17 59.6583 3.95328 73.8787     11.0667  59.2025     12.0016  47.7727    149.083     16.1577     149.083     
1 1 1 27 10 54 o 9  20.7751 5.8252  4.64136     8.53113  6.89014     9.52438  4.57805    29.516      12.9024     209.516     
1 1 1 27 10 55 o 16 52.5438 4.35965 53.5381     10.85    51.5087     11.6263  38.6566    325.667     8.20501     325.667     
1 1 1 27 10 56 o 6  27.1496 6.2905  16.6204     9.36951  12.8306     10.6095  14.9508    106.625     1.55093     106.625     
1 1 1 27 10 57 o 3  56.8903 4.31772 65.0083     12.0405  58.653      12.1516  35.4913    110.53      4.26382     290.53      
1 1 1 27 10 58 o 5  23.5289 6.14241 12.4341     9.33392  7.03086     10.1404  9.32786    327.195     0.0410762   147.194     
1 1 1 27 10 59 o 9  56.6405 4.06954 54.5349     11.516   67.7273     11.0528  33.3188    37.7335     7.68156     217.733     
1 1 1 27 10 60 o 3  34.002  5.82451 19.4981     10.0723  28.7262     9.78173  18.0132    344.053     4.64098     164.053     
1 1 1 27 10 61 o 10 18.669  5.60405 -4.53589    9.43532  6.82317     9.57882  2.10857    106.104     3.22751     286.104     
1 1 1 27 10 62 o 5  22.3231 5.99703 3.87428     9.93713  11.9847     9.21793  7.52959    312.617     0.970312    132.617     
1 1 1 27 10 63 o 14 20.5488 6.11402 6.67613     12.1614  1.93413     9.13157  4.88342    26.0094     0.278239    206.009     
1 1 1 27 10 64 o 4  26.4308 6.77446 14.5232     12.3258  13.7292     10.8076  5.81338    340.152     19.8204     160.152     
1 1 1 27 10 65 o 11 22.4296 6.45559 11.6497     12.3278  3.03104     10.6753  8.7601     301.779     3.61939     121.779     
1 1 1 27 10 66 o 19 40.2531 7.1709  35.2444     16.1206  38.9057     13.0334  30.4632    66.9191     13.5835     66.9191     
1 1 1 27 10 67 o 17 24.9942 6.8497  11.2509     12.4006  13.8377     12.1429  8.38453    155.278     9.8953      335.278     
1 1 1 27 10 68 o 3  26.4087 7.21512 15.6846     15.8024  15.1504     11.5954  10.428     0.781424    5.52808     180.781     
1 1 1 27 10 69 o 11 57.5125 6.14263 73.0686     18.3233  72.8573     15.7826  43.0845    320.818     15.228      320.818     
1 1 1 27 10 70 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 10 71 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 11 0  o 12 47.4882 3.73055 41.5279     8.59811  41.5279     8.59811  21.4812    180         11.684      8.6201e-06  
1 1 1 27 11 1  o 7  95.2606 2.73002 156.742     12.7177  166.466     13.2961  51.2226    57.9671     32.8688     237.967     
1 1 1 27 11 2  o 3  104.237 2.64814 187.862     13.7876  198.917     13.8262  69.3664    111.07      9.54128     291.07      
1 1 1 27 11 3  o 13 83.6528 2.74988 126.588     11.6582  122.756     11.3354  61.9254    171.425     10.7255     171.425     
1 1 1 27 11 4  f 0  40.9084 4.14143 28.3573     8.22409  32.6531     8.23674  49.2793    186.445     0           0           
1 1 1 27 11 5  f 0  138.665 2.43023 345.523     16.8965  337.869     16.8644  128.207    204.553     0           0           
1 1 1 27 11 6  o 2  197.454 2.51836 712.259     24.9027  673.544     24.9216  188.058    264.441     86.9723     264.441     
1 1 1 27 11 7  o 19 146.734 2.50709 374.715     18.4176  390.526     18.4485  91.5954    88.9926     31.182      268.993     
1 1 1 27 11 8  o 6  72.382  2.86903 97.2646     10.3718  89.7528     10.3466  26.8912    40.0952     46.2783     220.095     
1 1 1 27 11 9  o 19 68.4724 2.94057 84.359      10.0116  83.0692     10.0729  25.3573    147.184     42.9361     327.184     
1 1 1 27 11 10 o 9  45.3945 3.84853 41.5617     8.48695  33.2467     8.55938  12.4765    334.11      25.7207     154.11      
1 1 1 27 11 11 o 2  104.18  2.62985 190.397     13.2686  196.022     14.144   91.5994    167.107     38.4961     167.107     
1 1 1 27 11 12 o 2  145.359 2.50073 384.705     18.5412  366.503     17.8941  122.475    316.715     34.6765     316.715     
1 1 1 27 11 13 o 10 104.409 2.68272 199.884     14.0013  188.439     14.0162  47.4267    354.236     55.3111     174.236     
1 1 1 27 11 14 o 13 183.95  2.60097 600.685     23.4776  602.692     24.4677  165.45     334.486     62.4802     334.486     
1 1 1 27 11 15 o 6  42.8065 4.25605 29.8014     8.75388  37.2252     8.92379  13.6407    310.796     14.088      130.796     
1 1 1 27 11 16 o 19 84.4834 3.01363 124.65      12.9538  130.239     12.4607  43.3701    35.7336     31.9245     215.734     
1 1 1 27 11 17 o 9  146.263 2.73266 401.644     20.1078  360.819     19.8846  119.576    132.412     27.5728     132.412     
1 1 1 27 11 18 o 2  163.744 2.80125 482.709     23.0676  471.96      22.9052  113.343    150.109     12.0892     330.109     
1 1 1 27 11 19 f 0  147.029 2.79495 393.18      20.6477  377.266     20.4988  101.189    254.908     0           0           
1 1 1 27 11 20 o 14 118.494 2.81945 249.675     16.8274  251.024     16.6083  107.864    70.238      48.3        70.238      
1 1 1 27 11 21 o 16 69.3767 3.43919 96.2489     12.2532  77.0456     11.4689  33.8445    322.523     27.0929     142.523     
1 1 1 27 11 22 o 4  87.3511 3.12917 131.564     13.2593  141.488     14.0513  77.2339    29.9831     37.3118     29.9831     
1 1 1 27 11 23 o 13 76.1924 2.90049 105.524     10.9833  102.09      11.0807  67.5429    57.2927     42.5908     57.2927     
1 1 1 27 11 24 o 8  99.5271 2.61492 177.008     12.6907  176.361     13.3392  57.9071    89.1122     25.2925     269.112     
1 1 1 27 11 25 o 3  144.038 2.65934 391.529     19.1873  348.766     19.1388  126.969    269.583     47.8337     269.583     
1 1 1 27 11 26 o 6  40.5557 4.5156  28.0417     8.3475   32.6914     9.4127   7.36618    162.293     32.2094     342.293     
1 1 1 27 11 27 o 11 128.068 2.53404 299.564     15.8284  285.426     16.6293  109.761    250.352     37.6909     250.352     
1 1 1 27 11 28 o 18 22.4611 5.50046 11.3993     7.84047  4.78026     7.62895  5.30761    341.595     21.1961     341.595     
1 1 1 27 11 29 o 4  143.27  2.71128 374.492     19.3569  358.534     19.53    140.704    258.279     77.5699     258.279     
1 1 1 27 11 30 o 9  36.9297 5.10014 28.027      9.33697  23.2303     8.86689  2.55261    240.117     41.0726     60.1174     
1 1 1 27 11 31 o 10 151.741 2.83399 421.462     22.2066  401.929     20.8587  133.474    184.572     49.1716     184.572     
1 1 1 27 11 32 o 4  75.3285 3.25701 95.7125     12.445   108.613     11.9484  74.8609    323.938     49.0008     323.938     
1 1 1 27 11 33 o 1  68.212  3.60983 85.831      12.2792  82.4118     12.2183  63.8992    104.771     36.104      104.771     
1 1 1 27 11 34 o 15 56.9979 3.85318 58.3144     11.4131  59.8971     10.2743  51.135     128.661     28.82       128.661     
1 1 1 27 11 35 o 19 37.1047 5.01542 17.148      8.68586  36.0906     9.19808  11.877     197.535     24.2681     17.5348     
1 1 1 27 11 36 o 13 106.917 2.71302 204.268     13.9936  205.393     15.0161  89.4166    247.763     27.5387     247.763     
1 1 1 27 11 37 o 13 64.1951 3.28721 71.7996     10.1792  77.2979     10.8312  53.9107    47.2875     20.8221     47.2875     
1 1 1 27 11 38 o 14 51.0695 3.96983 50.4702     9.75765  45.2867     10.1645  40.2862    88.3949     14.0769     88.3949     
1 1 1 27 11 39 o 1  22.1674 5.34894 14.563      8.04072  -0.704599   8.01166  0.283021   227.58      23.4732     227.58      
1 1 1 27 11 40 o 17 96.2725 2.93314 168.161     13.8845  165.664     14.3434  75.2172    34.6219     15.4144     34.6219     
1 1 1 27 11 41 o 8  81.6916 3.13976 126.959     12.6621  114.456     12.9059  54.5531    154.446     4.86433     334.446     
1 1 1 27 11 42 o 17 20.241  5.56365 1.55294     7.8686   8.36667     8.63905  0.517082   161.882     16.7798     341.882     
1 1 1 27 11 43 o 7  30.0682 5.76549 16.6205     8.45399  18.6232     9.35947  13.3349    122.626     7.688       302.626     
1 1 1 27 11 44 o 3  86.694  3.04943 129.044     13.0884  142.911     13.3088  78.9383    148.063     38.4981     148.063     
1 1 1 27 11 45 o 10 20.0373 5.57801 8.62994     8.42992  -0.972805   8.82073  0.123504   117.451     19.7064     117.451     
1 1 1 27 11 46 o 5  113.404 2.81408 226.014     15.8042  237.891     16.1307  93.7032    359.501     29.5315     359.501     
1 1 1 27 11 47 f 0  25.5954 6.34912 7.45365     8.64375  16.4401     11.6573  21.9853    232.379     0           0           
1 1 1 27 11 48 f 0  45.6961 5.07451 43.825      10.5747  36.2051     11.6694  41.8433    307.213     0           0           
1 1 1 27 11 49 o 19 70.3741 3.65691 93.6623     12.0029  88.5619     13.4992  41.5126    209.809     13.5546     29.8086     
1 1 1 27 11 50 o 12 82.7767 3.3534  100.906     12.8916  152.537     14.6645  53.8808    72.0364     6.11149     252.036     
1 1 1 27 11 51 o 1  26.6924 6.4536  8.78759     10.1785  18.2647     11.0245  12.7758    10.0917     4.76058     190.092     
1 1 1 27 11 52 o 16 36.1012 6.19214 28.9338     10.5292  24.4079     11.7318  18.6132    315.402     9.04748     135.402     
1 1 1 27 11 53 o 10 61.0662 4.38476 81.0892     12.5104  61.0914     13.4732  32.8346    74.4001     16.9602     254.4       
1 1 1 27 11 54 o 19 19.0056 5.65476 8.25556     9.83824  -7.99307    9.93686  4.29104    291.162     8.23659     111.162     
1 1 1 27 11 55 o 6  29.2873 6.12325 24.0252     9.36643  9.89836     11.4965  12.2339    266.329     11.1976     86.3286     
1 1 1 27 11 56 o 5  60.3436 4.1895  76.2228     11.7266  62.6537     12.9551  40.2376    9.99168     0.121456    9.9913      
1 1 1 27 11 57 f 0  30.1841 6.33403 12.7555     9.79443  26.003      11.3105  17.2478    351.204     0           0           
1 1 1 27 11 58 o 1  59.8234 4.02579 68.2235     12.0693  67.8313     11.7771  36.3791    168.42      6.29471     348.42      
1 1 1 27 11 59 o 4  45.5924 4.89473 39.0881     10.7438  43.1141     10.9062  29.3704    192.088     0.794339    192.088     
1 1 1 27 11 60 o 17 30.3152 6.20051 22.4226     9.81654  16.4421     10.3356  8.98139    28.2036     19.0733     208.204     
1 1 1 27 11 61 o 18 36.3195 5.95246 21.6474     11.0219  33.7825     10.4791  16.4188    270.873     12.794      90.8733     
1 1 1 27 11 62 o 4  41.3611 5.92149 34.3626     12.885   36.7393     10.7512  29.4309    222.247     7.32681     222.247     
1 1 1 27 11 63 f 0  40.6628 6.4656  34.3674     14.6429  36.8693     11.0997  30.1824    60.2101     0           0           
1 1 1 27 11 64 o 15 70.6821 4.68992 112.886     18.2992  85.0434     14.6045  52.0909    163.045     11.8777     163.045     
1 1 1 27 11 65 f 0  35.0608 7.39403 28.3278     16.1245  29.8488     12.2774  10.4307    266.45      0           0           
1 1 1 27 11 66 o 14 37.6304 7.16865 30.7831     15.6547  36.4938     12.5153  22.9192    347.123     1.24766     347.123     
1 1 1 27 11 67 o 15 36.5535 6.97766 9.3216      16.2511  54.5293     15.5558  20.0435    169.26      13.7949     169.26      
1 1 1 27 11 68 o 15 25.4897 7.21688 6.73698     16.4146  19.0335     13.1944  7.36678    234.211     0.0401227   54.212      
1 1 1 27 11 69 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 12 0  f 0  178.118 2.57955 563.841     23.0038  563.841     23.0038  124.622    180         0           0           
1 1 1 27 12 1  o 4  132.275 2.54139 306.864     16.4986  315.81      17.1635  80.1302    156.237     33.2244     336.237     
1 1 1 27 12 2  f 0  63.1568 3.15647 69.1761     9.74249  73.6691     10.1103  61.0955    240.426     0           0           
1 1 1 27 12 3  o 5  193.934 2.73933 667.052     27.1242  671.186     26.1088  141.429    295.111     3.89362     115.111     
1 1 1 27 12 4  o 12 129.835 2.5583  298.424     16.553   301.542     16.706   99.625     105.496     10.7044     105.496     
1 1 1 27 12 5  f 0  195.637 2.65036 666.344     25.4696  695.394     26.5025  162.469    30.2336     0           0           
1 1 1 27 12 6  o 13 201.753 2.75577 730.772     27.2889  717.829     28.4132  177.995    119.499     58.4411     119.499     
1 1 1 27 12 7  o 4  74.8202 3.11645 101.367     11.204   98.7945     12.0342  55.5854    302.422     11.1035     302.422     
1 1 1 27 12 8  o 6  18.7639 5.30276 5.65286     7.50781  -0.325117   7.94214  15.6309    0.896292    40.5482     0.896292    
1 1 1 27 12 9  o 2  77.4156 2.99616 110.027     11.3871  104.142     11.7516  7.97024    335.527     94.9143     155.527     
1 1 1 27 12 10 o 11 86.9169 2.8962  136.595     12.4767  133.061     12.6775  39.0768    45.0176     45.8906     225.018     
1 1 1 27 12 11 o 10 56.9734 3.65095 61.3131     9.88329  55.6479     10.6567  34.5305    304.225     1.08882     124.225     
1 1 1 27 12 12 o 7  133.095 2.93744 311.048     18.6638  320.729     20.4553  56.7653    161.874     81.5718     341.874     
1 1 1 27 12 13 o 17 45.6252 4.81706 51.5511     10.0772  26.8019     10.3601  14.4566    28.5772     26.1753     208.577     
1 1 1 27 12 14 o 19 56.9946 3.86771 65.9508     10.7702  51.7658     10.8899  35.0856    197.835     18.5574     197.835     
1 1 1 27 12 15 o 11 48.2597 4.33625 45.2272     10.1125  39.7389     10.327   23.8482    179.821     5.14297     179.821     
1 1 1 27 12 16 o 3  102.113 2.92681 189.859     15.0977  182.507     14.795   101.64     260.476     63.733      260.476     
1 1 1 27 12 17 o 19 52.8342 3.76326 56.7163     9.45713  44.5687     9.98251  29.2326    40.3466     5.52182     220.347     
1 1 1 27 12 18 o 7  91.5708 2.80343 144.289     12.6429  155.271     13.0241  54.7867    295.188     20.3408     115.188     
1 1 1 27 12 19 o 13 133.154 2.57153 316.916     17.1305  315.089     17.1563  110.333    48.3099     28.6815     48.3099     
1 1 1 27 12 20 o 12 142.026 2.66595 350.311     18.7352  369.217     19.1803  138.181    265.861     72.7495     265.861     
1 1 1 27 12 21 o 12 173.38  2.71458 538.233     24.2753  533.571     22.8823  148.256    11.2811     44.2277     11.2811     
1 1 1 27 12 22 o 17 50.5766 3.92615 45.2083     9.54427  47.7135     10.0331  27.9474    244.065     2.68209     64.0647     
1 1 1 27 12 23 o 18 115.409 2.69606 231.346     14.756   244.282     16.3799  93.5198    163.388     22.6124     163.388     
1 1 1 27 12 24 o 13 78.8029 3.09421 110.472     12.7371  112.175     11.5652  54.261     253.569     0.475034    73.5694     
1 1 1 27 12 25 o 13 60.9164 3.76887 71.2544     12.1308  63.112      10.6587  47.44      87.38       18.3565     87.38       
1 1 1 27 12 26 o 11 75.0164 3.45925 98.5929     12.8759  104.034     12.9867  67.7363    104.786     35.423      104.786     
1 1 1 27 12 27 o 5  131.485 2.76256 322.857     18.6255  295.408     17.7421  109.833    38.7716     30.2395     38.7716     
1 1 1 27 12 28 o 2  86.7246 3.23691 148.99      15.0977  121.933     12.9657  76.7152    72.5748     31.8625     72.5748     
1 1 1 27 12 29 o 1  64.1366 3.67896 78.268      12.0597  70.7241     11.3883  54.635     7.01842     21.9765     7.01842     
1 1 1 27 12 30 o 7  112.8   2.81047 222.276     16.4144  233.402     15.2509  80.6758    338.438     1.02913     158.438     
1 1 1 27 12 31 o 1  52.2619 3.77645 59.8227     9.866    40.5691     9.39583  38.5001    325.714     7.1001      325.714     
1 1 1 27 12 32 o 7  173.3   2.62749 530.871     23.1415  543.057     22.482   165.029    130.067     79.9941     130.067     
1 1 1 27 12 33 o 10 29.9401 5.66945 18.3319     8.80415  16.0041     8.56485  10.857     345.72      12.2813     165.72      
1 1 1 27 12 34 o 19 119.884 2.64764 263.719     15.8019  251.32      15.961   101.998    358.898     32.6593     358.898     
1 1 1 27 12 35 o 9  95.0137 2.84071 168.029     14.3384  156.491     12.6458  62.4999    25.2407     10.183      205.241     
1 1 1 27 12 36 o 9  43.6914 4.56568 33.126      10.4449  38.1759     8.64843  33.3531    200.47      12.4507     200.47      
1 1 1 27 12 37 o 2  46.9172 4.32087 37.5827     10.4906  44.1973     9.05651  37.8144    24.2986     27.9769     24.2986     
1 1 1 27 12 38 o 10 57.8187 3.61498 64.5348     10.7768  57.6266     9.96176  50.9925    341.476     25.0453     341.476     
1 1 1 27 12 39 o 5  50.4983 3.88943 47.8506     10.111   46.007      9.24931  36.6799    175.162     5.9913      175.162     
1 1 1 27 12 40 o 4  42.3377 4.52861 42.3718     9.1835   25.835      9.02725  31.6777    304.238     10.2483     304.238     
1 1 1 27 12 41 o 6  41.5294 4.54403 33.9787     9.42846  30.9187     8.87817  23.2728    290.061     7.92377     110.061     
1 1 1 27 12 42 o 8  62.756  3.63196 68.7147     10.8964  75.4646     11.7539  40.7256    205.53      4.9671      25.5297     
1 1 1 27 12 43 o 12 85.6717 3.16976 141.185     12.7496  125.183     14.1953  80.4212    54.9241     42.4968     54.9241     
1 1 1 27 12 44 o 6  81.5773 3.16604 126.067     12.3601  115.602     13.3397  79.904     32.9347     48.033      32.9347     
1 1 1 27 12 45 o 12 25.187  6.01952 16.3445     9.43227  6.05416     9.38146  0.172421   125.232     30.7999     305.232     
1 1 1 27 12 46 o 4  92.8709 3.07061 158.481     13.4892  154.608     14.9502  74.2867    227.428     19.3983     227.428     
1 1 1 27 12 47 o 2  48.2222 4.54321 37.8368     10.0034  50.6032     11.3839  32.8108    25.5604     1.03195     25.5604     
1 1 1 27 12 48 o 9  34.138  5.53695 10.4562     9.92345  36.7823     9.97981  21.8251    253.3       0.98985     253.3       
1 1 1 27 12 49 o 12 42.6761 4.94636 34.8535     9.60167  35.6718     10.7959  36.0673    283.643     18.0472     283.643     
1 1 1 27 12 50 o 9  20.1761 5.7844  -1.11433    8.4554   9.4738      10.2478  1.50614    188.856     19.9681     8.85598     
1 1 1 27 12 51 o 2  38.1249 5.41003 24.814      9.50846  33.5175     10.4699  24.8772    254.234     0.709763    254.234     
1 1 1 27 12 52 o 1  36.351  5.73652 30.4877     9.82029  23.4201     10.6095  20.2636    198.023     6.13253     18.0232     
1 1 1 27 12 53 o 17 28.3786 6.62652 16.8919     10.2255  16.4016     11.7298  14.1641    203.643     5.01009     23.6433     
1 1 1 27 12 54 o 15 29.9562 6.50678 9.92642     10.488   27.9796     12.1052  14.4208    59.9528     7.37578     239.953     
1 1 1 27 12 55 o 3  90.8612 3.48969 148.122     15.2607  159.329     16.4049  66.3976    165.651     9.3412      165.651     
1 1 1 27 12 56 o 10 18.6907 5.75983 7.07815     10.5608  -13.5937    11.6861  1.59489    276.571     14.0522     96.5709     
1 1 1 27 12 57 o 1  71.2965 3.75236 88.145      12.5092  103.721     14.1291  64.6112    25.8729     35.274      25.8729     
1 1 1 27 12 58 o 9  22.1033 6.14571 5.02184     9.51651  10.4279     10.5367  6.89534    259.254     1.87235     79.2536     
1 1 1 27 12 59 o 3  67.2808 3.70809 81.5777     12.3836  88.9216     12.4038  59.223     234.31      30.0073     234.31      
1 1 1 27 12 60 o 12 18.8411 5.66468 5.96466     9.7985   -1.97428    9.2277   3.55026    324.124     11.7204     144.124     
1 1 1 27 12 61 o 3  60.0985 4.73658 74.9783     15.774   66.984      12.1278  54.8493    131.267     32.1526     131.267     
1 1 1 27 12 62 o 1  40.507  6.67085 32.1028     15.4963  40.0862     11.369   31.9367    191.487     24.955      191.487     
1 1 1 27 12 63 o 7  28.9199 7.48632 18.6836     17.7647  18.7207     11.3753  17.1205    302.175     7.18963     302.175     
1 1 1 27 12 64 o 19 31.3675 6.94964 4.7657      15.8018  36.6328     13.4713  18.1234    115.332     0.88338     115.332     
1 1 1 27 12 65 o 13 20.8225 6.53299 2.93576     15.1198  2.99865     12.0518  4.87282    333.975     5.32235     153.975     
1 1 1 27 12 66 o 1  17.8039 5.90421 -6.43487    14.3307  -5.16554    12.2397  0.452349   315.435     11.3706     135.435     
1 1 1 27 12 67 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 12 68 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 13 0  o 12 93.4345 3.29803 156.401     15.3545  156.401     15.3545  65.2631    1.24372e-05 9.59308     180         
1 1 1 27 13 1  o 8  71.1683 3.54527 97.1645     11.9731  84.9357     13.0067  33.2286    354.263     33.2541     174.262     
1 1 1 27 13 2  o 5  102.935 2.89334 190.131     14.8605  188.087     14.93    93.8956    115.394     42.4005     115.394     
1 1 1 27 13 3  o 12 156.026 2.9703  433.121     23.2122  435.413     23.1955  99.1647    105.987     32.1718     285.987     
1 1 1 27 13 4  o 1  72.7369 3.30942 90.7443     11.9934  99.0172     11.9862  45.4585    252.205     9.62977     72.2047     
1 1 1 27 13 5  o 6  142.781 2.8376  363.075     20.3328  363.988     20.2346  89.2499    214.83      31.7676     34.8301     
1 1 1 27 13 6  o 1  55.2391 3.82613 52.621      10.2015  57.7001     10.7106  28.3601    292.24      14.6732     112.24      
1 1 1 27 13 7  o 1  73.7383 3.22515 96.409      11.8264  98.441      11.8925  38.8808    197.037     25.5293     17.0369     
1 1 1 27 13 8  o 11 115.21  2.76468 232.078     16.6181  241.486     15.1932  102.568    344.135     39.8535     344.135     
1 1 1 27 13 9  o 8  133.79  2.79794 328.462     18.8743  310.211     18.5989  54.8189    194.056     87.4413     14.0555     
1 1 1 27 13 10 o 8  59.8411 3.63639 60.8793     11.1046  68.3083     10.4033  33.0441    36.5607     13.1809     216.561     
1 1 1 27 13 11 o 7  73.062  3.12032 100.793     11.6039  90.6068     11.1347  50.664     320.357     1.44288     320.357     
1 1 1 27 13 12 o 8  57.5042 3.4845  57.1829     10.421   62.0065     9.37368  39.8811    239.81      11.8416     239.81      
1 1 1 27 13 13 o 11 110.564 2.74481 222.579     15.7787  213.813     14.5867  65.5827    178.582     29.2608     358.582     
1 1 1 27 13 14 o 5  35.02   4.89688 23.2519     8.27261  22.5431     8.30581  6.50921    44.9216     9.80431     224.922     
1 1 1 27 13 15 f 0  68.7253 3.02135 84.7939     10.5834  84.5037     10.1206  54.9157    227.391     0           0           
1 1 1 27 13 16 o 16 126.265 2.56417 294.109     16.5131  274.682     15.9045  100.556    117.106     18.2989     117.106     
1 1 1 27 13 17 o 3  87.2077 2.75799 138.614     12.2423  133.254     11.8045  71.4494    214.464     21.9652     214.464     
1 1 1 27 13 18 o 16 88.6042 2.77877 149.995     12.5234  131.003     12.0756  45.01      107.655     36.6347     287.655     
1 1 1 27 13 19 o 9  35.2677 4.84768 22.4469     8.42519  24.0435     8.08497  9.02571    358.725     8.04793     178.725     
1 1 1 27 13 20 o 13 57.3154 3.58778 64.2681     11.058   54.65       9.35625  44.1145    205.375     23.2421     205.375     
1 1 1 27 13 21 o 5  105.374 3.03779 196.386     16.1374  201.309     15.8724  93.715     196.342     37.2117     196.342     
1 1 1 27 13 22 o 3  105.77  3.22622 197.582     18.1638  203.778     15.8309  87.9339    355.261     24.112      355.261     
1 1 1 27 13 23 o 2  50.4297 4.40804 55.5839     12.0169  38.4709     9.79754  23.0961    121.676     21.94       301.676     
1 1 1 27 13 24 o 1  103.904 3.12004 199.694     16.2083  187.705     16.1982  85.1984    108.058     20.7828     108.058     
1 1 1 27 13 25 o 16 66.4443 3.575   90.8726     12.213   69.4247     11.3466  33.1414    78.9809     28.1979     258.981     
1 1 1 27 13 26 f 0  56.1394 4.12376 50.7704     11.5084  64.6996     11.1362  45.8946    309.504     0           0           
1 1 1 27 13 27 o 10 80.1801 2.91952 110.209     11.5648  120.716     11.8094  51.6407    198.022     11.5693     18.022      
1 1 1 27 13 28 o 8  72.6085 3.03965 94.4924     10.9776  95.2034     11.0443  26.1501    309.717     51.877      129.717     
1 1 1 27 13 29 o 10 105.74  2.565   196.992     13.553   203.251     13.589   80.8271    163.878     9.229       163.878     
1 1 1 27 13 30 o 18 53.4269 3.52908 47.9157     9.29632  56.0288     9.33396  21.3836    194.94      31.9902     14.9395     
1 1 1 27 13 31 o 16 47.2973 4.18262 40.8413     9.32395  41.6513     10.0608  37.3148    291.429     13.4581     291.429     
1 1 1 27 13 32 o 14 76.2701 2.98761 108.102     11.6948  101.579     11.0572  51.3697    201.461     5.4722      21.4611     
1 1 1 27 13 33 o 6  38.3201 4.94367 37.4902     8.8084   19.2682     9.13709  22.9652    132.756     2.56991     312.756     
1 1 1 27 13 34 o 18 37.0776 4.81487 32.2024     8.65399  20.4121     8.46633  20.1577    153.935     12.8249     153.935     
1 1 1 27 13 35 o 7  69.4998 3.14769 93.4418     11.1733  81.6157     10.6291  57.5476    284.59      18.3499     284.59      
1 1 1 27 13 36 f 0  45.2548 4.21858 34.2537     9.46982  42.0185     9.0363   44.9472    87.6394     0           0           
1 1 1 27 13 37 o 9  83.5559 2.9071  138.973     12.2386  113.598     11.9617  51.0031    188.054     16.4914     8.05434     
1 1 1 27 13 38 o 15 52.8257 3.7458  46.9717     9.83849  55.7356     9.6347   25.7409    178.381     21.5434     358.381     
1 1 1 27 13 39 o 16 44.9819 4.45678 32.5051     9.96108  43.6552     9.22696  38.077     217.706     20.1013     217.706     
1 1 1 27 13 40 o 7  58.3701 3.63349 65.4753     10.7936  59.4788     10.2473  52.0528    104.384     25.6484     104.384     
1 1 1 27 13 41 o 12 34.2966 5.36213 26.5203     9.33255  19.4454     8.65944  21.0606    31.1336     0.487781    31.1337     
1 1 1 27 13 42 o 13 24.949  5.81492 16.9784     9.1122   5.23653     8.66266  4.53836    19.0705     20.6469     199.07      
1 1 1 27 13 43 o 14 24.48   5.66074 15.9745     8.56093  5.70584     8.17037  9.90991    158.272     0.170028    158.272     
1 1 1 27 13 44 o 3  24.8741 5.7298  17.2035     8.39691  3.69944     9.59712  9.0333     184.786     10.5903     4.78619     
1 1 1 27 13 45 o 2  35.0964 5.58538 23.4738     8.88319  25.3497     10.2908  14.7167    325.91      16.8514     145.91      
1 1 1 27 13 46 o 4  23.5769 5.89768 3.5229      8.27766  15.7724     9.90624  4.50382    198.58      19.5641     18.58       
1 1 1 27 13 47 o 4  34.6891 5.8734  19.7519     9.24197  29.3343     11.0112  24.3453    145.611     5.58758     145.611     
1 1 1 27 13 48 o 15 29.6286 6.16849 16.6746     9.21233  19.2723     10.3404  11.2884    20.657      15.0784     200.657     
1 1 1 27 13 49 o 3  52.2968 4.38709 55.5687     10.5188  48.8562     11.8027  27.0567    292.781     17.2267     112.781     
1 1 1 27 13 50 o 17 89.6147 3.15653 142.963     13.5851  152.515     14.6798  73.5264    138.331     23.3618     138.331     
1 1 1 27 13 51 o 16 31.1295 6.06146 15.1806     9.20357  25.6185     10.5773  10.7746    4.56661     18.2727     184.567     
1 1 1 27 13 52 o 15 23.6309 6.12319 8.5133      8.78622  12.2371     10.1881  9.45339    185.639     6.53046     5.63859     
1 1 1 27 13 53 o 11 75.9289 3.58694 104.214     12.7939  111.444     14.339   61.2044    66.6556     19.3145     66.6556     
1 1 1 27 13 54 o 1  39.4693 5.2555  34.7266     10.0982  28.2628     9.90926  29.5035    351.64      10.2412     351.64      
1 1 1 27 13 55 o 10 52.7017 4.37524 55.877      11.5295  51.5895     11.1391  32.8686    359.53      4.025       179.53      
1 1 1 27 13 56 o 18 52.5426 5.17483 58.9887     13.2416  51.3684     13.2047  35.1123    162.012     1.12373     162.012     
1 1 1 27 13 57 o 1  35.5357 6.34052 18.7342     11.4641  35.9534     11.8171  21.1728    277.448     1.65556     97.4477     
1 1 1 27 13 58 o 18 55.8499 5.03562 55.5107     14.663   68.1603     12.1197  43.6249    27.9527     13.8492     27.9527     
1 1 1 27 13 59 o 14 29.8298 7.05756 16.5985     12.2143  22.5199     12.7355  13.5534    148.118     9.14026     328.118     
1 1 1 27 13 60 o 6  19.7288 6.34925 7.92151     16.1438  -12.2467    11.0041  4.6098     82.615      10.6103     262.615     
1 1 1 27 13 61 o 15 71.0823 5.02638 101.566     18.5284  101.509     16.7186  56.3007    60.4093     18.625      60.4093     
1 1 1 27 13 62 o 17 29.1716 7.38547 28.169      14.9951  11.4571     13.2548  15.862     252.529     0.602142    72.5293     
1 1 1 27 13 63 o 11 27.7061 7.68993 6.9015      21.142   23.0625     13.761   13.758     1.51225     0.485355    1.51226     
1 1 1 27 13 64 o 15 22.342  6.75819 17.0954     15.1651  -5.06098    12.8398  3.74441    34.6916     0.618987    214.692     
1 1 1 27 13 65 o 4  20.625  6.54179 9.21971     15.3711  -4.23176    12.6868  2.24191    210.204     2.40033     30.2043     
1 1 1 27 13 66 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 14 0  o 4  51.1368 3.65604 47.9885     9.13212  47.9885     9.13212  35.4048    180         0.0842972   180         
1 1 1 27 14 1  o 13 69.5766 3.18877 86.0009     10.8974  87.7446     11.2199  29.9871    272.801     38.0526     92.801      
1 1 1 27 14 2  o 17 57.0695 3.47435 60.7085     9.87524  56.7653     9.79771  34.2706    34.0945     5.37503     214.094     
1 1 1 27 14 3  o 12 49.4127 4.15794 44.2112     10.0646  44.7738     10.1243  26.6769    345.614     9.48996     345.614     
1 1 1 27 14 4  o 18 77.4473 3.25926 118.84      13.0183  96.954      12.1405  61.6276    38.9772     16.9907     38.9772     
1 1 1 27 14 5  o 1  106.334 2.91729 212.362     15.6412  192.125     15.3737  111.159    296.458     74.8906     296.458     
1 1 1 27 14 6  o 18 86.8685 3.04817 144.136     13.039   126.385     13.3488  54.4704    251.232     15.2011     71.2321     
1 1 1 27 14 7  o 18 79.6509 3.24436 118.909     12.2106  108.841     13.4671  63.1341    246.165     16.1931     246.165     
1 1 1 27 14 8  o 19 20.1558 5.47767 6.47566     8.00638  3.59317     7.61794  12.1106    194.243     35.7267     194.243     
1 1 1 27 14 9  o 10 51.6246 3.694   47.4027     9.28288  49.1473     9.56874  12.4681    331.209     44.5918     151.209     
1 1 1 27 14 10 f 0  27.5706 5.50318 14.2139     7.87172  14.233      7.9971   21.9546    31.0299     0           0           
1 1 1 27 14 11 o 19 161.166 2.67287 467.668     22.0345  458.882     21.1389  133.954    62.3337     30.3942     62.3337     
1 1 1 27 14 12 o 9  89.1025 2.86259 146.472     13.0025  137.673     12.4968  74.5111    39.415      23.2958     39.415      
1 1 1 27 14 13 f 0  57.0808 3.6402  61.7492     10.5043  56.1505     10.0952  25.8291    310.758     0           0           
1 1 1 27 14 14 o 9  86.6162 3.11982 136.164     14.0894  132.908     12.8909  47.0296    240.208     30.8712     60.2083     
1 1 1 27 14 15 o 2  38.4277 5.02837 22.3553     9.13851  33.3413     9.44012  16.2319    68.4492     0.496528    68.4492     
1 1 1 27 14 16 o 4  87.6722 3.21222 141.809     14.346   134.209     13.786   62.4057    284.822     1.07823     104.822     
1 1 1 27 14 17 o 13 181.172 2.92439 605.139     26.0381  568.72      27.0054  179.477    43.8768     92.1716     43.8768     
1 1 1 27 14 18 o 3  60.8762 3.81985 66.3337     11.7226  68.0548     11.3309  44.8018    101.183     6.05424     101.183     
1 1 1 27 14 19 o 12 152.369 3.00216 404.388     23.3304  427.336     22.4243  123.966    331.785     23.6388     331.785     
1 1 1 27 14 20 o 5  77.7008 3.44241 117.088     13.8046  100.868     12.8665  64.6541    247.27      18.553      247.27      
1 1 1 27 14 21 o 13 56.9371 3.82391 58.3907     10.8127  59.4607     10.7459  45.9824    138.094     13.7717     138.094     
1 1 1 27 14 22 o 4  146.893 2.79005 383.808     21.2772  388.667     19.7213  128.847    213.09      42.1079     213.09      
1 1 1 27 14 23 o 19 156.811 2.58405 455.411     20.6404  423.685     19.9716  127.223    314.258     24.059      314.258     
1 1 1 27 14 24 o 3  54.577  3.86882 64.1859     9.79626  45.2688     10.5947  34.5449    188.51      6.99837     8.5101      
1 1 1 27 14 25 o 5  76.692  3.08919 109.437     12.0149  102.455     11.6324  54.5604    292.928     0.841833    112.928     
1 1 1 27 14 26 o 6  41.7907 4.5091  37.9663     9.5826   27.4662     8.65233  24.1138    188.854     7.24241     8.85443     
1 1 1 27 14 27 o 17 87.4716 2.8817  150.878     12.4021  124.806     12.6738  82.295     77.3113     39.9107     77.3113     
1 1 1 27 14 28 o 6  57.4821 3.44531 57.3647     9.85574  62.759      9.78551  35.1416    136.853     10.4065     316.853     
1 1 1 27 14 29 f 0  101.333 2.67895 191.014     13.7794  177.733     13.3793  71.3265    282.324     0           0           
1 1 1 27 14 30 o 15 44.0374 4.20035 37.7062     9.0786   34.265      8.97393  27.5411    57.8451     3.94191     237.845     
1 1 1 27 14 31 o 18 136.277 2.63886 344.67      18.5955  322.209     17.4192  115.418    32.2365     33.3568     32.2365     
1 1 1 27 14 32 o 14 89.0355 2.94029 149.33      13.2432  136.743     12.9159  54.8061    304.453     18.3284     124.453     
1 1 1 27 14 33 o 10 39.4849 4.73016 24.9875     8.79529  34.2886     9.17597  18.37      15.5102     16.107      195.51      
1 1 1 27 14 34 o 5  24.578  5.6291  11.9349     7.92937  10.4306     7.9219   4.75817    349.405     18.3843     169.405     
1 1 1 27 14 35 o 18 34.5394 5.04939 28.1901     8.32094  17.9995     8.59219  21.137     285.212     12.032      285.212     
1 1 1 27 14 36 o 1  39.7972 4.59707 31.3648     8.82941  28.5005     8.85928  30.0049    299.054     10.2761     299.054     
1 1 1 27 14 37 o 18 97.189  2.76058 173.787     13.2596  166.79      13.5637  61.7368    53.6874     15.3951     233.687     
1 1 1 27 14 38 o 10 36.7115 5.01043 33.7423     8.77595  18.8258     8.87861  27.1889    145.009     11.1809     145.009     
1 1 1 27 14 39 o 18 35.2737 5.21238 19.4555     8.89246  29.1162     8.97374  25.8158    347.61      11.6582     347.61      
1 1 1 27 14 40 o 14 73.9154 3.1271  106.776     11.4017  92.1268     11.5906  48.6353    323.292     6.87899     143.292     
1 1 1 27 14 41 o 13 23.7512 5.9354  11.6105     9.27776  8.3768      8.38204  6.37775    251.326     14.825      71.326      
1 1 1 27 14 42 o 12 50.397  4.09882 48.8247     10.3568  46.1697     9.97166  43.8686    282.835     20.0985     282.835     
1 1 1 27 14 43 o 3  41.054  4.84035 34.7507     9.76973  30.2599     9.43544  23.2678    316.501     8.84178     136.501     
1 1 1 27 14 44 o 18 42.1208 4.8862  34.9089     9.99492  33.7095     9.91749  22.3241    84.063      12.4382     264.063     
1 1 1 27 14 45 o 1  45.19   4.554   39.6339     10.1456  38.6387     9.89827  29.7255    121.872     1.67957     301.872     
1 1 1 27 14 46 o 18 86.0355 3.33739 126.269     14.1335  146.823     14.4944  64.6852    288.444     9.0101      288.444     
1 1 1 27 14 47 o 12 33.2112 6.08152 25.4836     9.3363   19.9622     11.3457  7.23712    194.992     29.7047     14.9918     
1 1 1 27 14 48 o 4  58.9759 4.21837 50.3284     11.3793  84.0622     12.8333  58.5024    165.256     38.5273     165.256     
1 1 1 27 14 49 o 10 20.0729 5.82487 1.7603      8.67843  7.39513     10.1506  6.22918    79.5153     4.88644     259.515     
1 1 1 27 14 50 o 17 93.8952 3.39631 168.556     14.4556  158.901     17.1557  70.0796    348.569     10.0032     348.569     
1 1 1 27 14 51 o 9  31.0595 6.33001 22.7833     9.85235  18.1075     11.1854  16.1112    249.815     5.93124     69.8153     
1 1 1 27 14 52 o 13 50.8267 4.47581 50.2868     11.0164  50.038      11.288   28.5816    1.44017     11.0728     181.44      
1 1 1 27 14 53 o 18 39.7154 5.35771 26.6432     10.1933  37.8981     10.2902  20.761     219.358     9.94474     39.3583     
1 1 1 27 14 54 o 5  24.7526 6.29909 12.2062     10.5488  11.913      9.40926  6.85709    139.093     14.8549     319.093     
1 1 1 27 14 55 o 4  37.8188 6.10631 24.373      12.1611  36.3172     10.7164  23.6469    80.2037     0.598246    260.204     
1 1 1 27 14 56 o 3  21.3111 6.18895 5.69039     10.6398  6.01222     10.5489  2.11367    274.245     20.6412     94.2449     
1 1 1 27 14 57 o 13 28.4715 6.37394 4.87012     11.6563  27.3963     11.3901  14.5257    62.5876     5.13971     242.588     
1 1 1 27 14 58 o 14 28.4535 7.0126  12.0779     14.917   21.4033     11.1075  16.8769    101.261     1.80884     101.261     
1 1 1 27 14 59 f 0  38.054  7.00046 35.224      15.0449  31.1022     11.9502  26.4903    240.721     0           0           
1 1 1 27 14 60 o 8  50.2235 6.15932 59.2781     16.4213  50.2049     13.4569  43.8959    276.821     24.4697     276.821     
1 1 1 27 14 61 o 12 21.8422 6.63262 11.4224     14.7976  1.52361     11.1696  4.684      282.19      13.5452     102.19      
1 1 1 27 14 62 f 0  14.9609 5.11993 -13.6475    13.5794  -10.4385    9.49645  5.28421    38.0227     0           0           
1 1 1 27 14 63 o 7  23.0976 7.19176 3.07911     19.2077  10.2147     14.0577  6.07205    282.578     8.46616     102.578     
1 1 1 27 14 64 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 14 65 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 15 0  o 9  98.2739 3.13087 173.003     15.3478  173.003     15.3478  96.9268    180         45.918      180         
1 1 1 27 15 1  o 7  86.4495 3.17706 139.505     13.6583  128.852     13.7538  38.4749    48.5796     49.4406     228.58      
1 1 1 27 15 2  o 9  27.879  5.99675 9.37325     9.20718  19.0678     9.56193  2.6667     160.277     13.4817     340.277     
1 1 1 27 15 3  o 17 95.1767 3.07814 162.466     15.5199  162.308     13.7068  93.7969    297.855     52.2569     297.855     
1 1 1 27 15 4  o 18 26.4971 5.76746 8.03981     8.56012  17.3293     8.80309  12.09      220.504     55.1908     220.504     
1 1 1 27 15 5  o 10 104.965 2.93409 188.71      15.3434  205.985     15.4451  77.5736    115.109     1.33482     115.109     
1 1 1 27 15 6  o 1  111.038 2.88135 216.813     15.2707  224.5       16.7295  80.6098    330.683     2.09582     150.683     
1 1 1 27 15 7  o 1  56.2772 3.70721 56.2505     9.97534  58.5591     10.693   41.6516    94.5949     8.09921     94.5949     
1 1 1 27 15 8  o 7  34.1852 5.38158 21.5205     9.2027   22.7458     8.76421  13.4612    7.22885     6.921       187.229     
1 1 1 27 15 9  o 4  105.155 2.95593 195.493     15.3364  200.672     15.7561  60.8372    79.9334     33.3636     259.933     
1 1 1 27 15 10 o 12 27.5879 5.44523 5.98146     8.85109  21.3657     8.19582  1.6517     50.0905     35.3337     50.0905     
1 1 1 27 15 11 o 14 58.224  4.18449 50.9145     12.5388  73.7486     10.6317  36.9927    176.243     7.55198     356.243     
1 1 1 27 15 12 o 8  80.9719 3.59929 112.933     15.6987  123.825     13.0732  45.9037    273.384     26.3402     93.3839     
1 1 1 27 15 13 o 12 59.3205 4.03288 74.6832     12.7957  54.2793     10.8809  42.8467    217.066     2.3843      217.066     
1 1 1 27 15 14 o 13 52.1139 4.21337 54.0259     11.3715  45.6016     10.2474  16.1061    72.5782     42.2837     252.578     
1 1 1 27 15 15 o 9  44.3746 4.49853 38.2569     9.96538  34.6052     9.4704   25.7867    168.431     8.78582     348.431     
1 1 1 27 15 16 o 6  82.7981 3.03924 123.026     12.7947  123.34      12.3356  59.7833    2.51281     1.04132     182.513     
1 1 1 27 15 17 o 18 78.9894 2.9865  116.067     11.9921  108.248     11.5662  78.0511    220.725     43.7248     220.725     
1 1 1 27 15 18 o 9  94.0537 2.91615 167.948     13.7501  149.892     13.6443  85.9675    233.966     35.2982     233.966     
1 1 1 27 15 19 o 1  73.2091 3.31714 97.1698     11.6343  96.3593     12.5535  57.0143    136.478     8.78375     136.478     
1 1 1 27 15 20 o 16 63.4648 3.39604 73.7536     10.4216  72.085      11.0023  35.3028    359.734     20.5891     179.734     
1 1 1 27 15 21 o 6  30.0547 5.76422 10.4321     9.75475  23.6148     8.95603  3.55118    327.214     31.7464     147.214     
1 1 1 27 15 22 o 16 127.952 2.86522 302.25      17.4245  285.735     19.1674  102.127    43.7741     16.2253     43.7741     
1 1 1 27 15 23 o 19 70.9683 3.2704  91.5205     11.2441  90.6553     11.8782  54.702     122.907     7.8491      122.907     
1 1 1 27 15 24 o 5  79.2162 3.12899 124.891     11.7971  102.201     12.7262  54.8164    16.7911     4.88782     196.791     
1 1 1 27 15 25 o 8  65.2496 3.83318 77.7079     10.7949  77.8382     13.8241  29.1407    139.457     35.6441     319.457     
1 1 1 27 15 26 o 13 53.8175 3.90363 51.9814     10.1128  54.3878     10.6465  31.9676    13.8304     11.7274     193.83      
1 1 1 27 15 27 o 18 26.1656 5.81568 14.3594     8.53049  11.3277     8.53736  5.34526    220.41      20.2774     40.4104     
1 1 1 27 15 28 o 4  86.4714 3.08082 133.161     13.3958  137.103     13.2134  76.0827    79.6329     28.0256     79.6329     
1 1 1 27 15 29 o 13 23.2268 5.72564 11.3157     7.9318   6.94454     8.68673  2.93937    271.808     34.199      271.808     
1 1 1 27 15 30 o 16 20.589  5.23416 -4.43864    7.84658  13.2892     8.13169  0.59839    220.656     0.693537    40.6556     
1 1 1 27 15 31 o 18 105.349 2.92259 208.587     14.5286  192.131     16.1344  104.537    215.338     57.7172     215.338     
1 1 1 27 15 32 o 13 45.43   4.30335 41.6309     9.09818  35.5436     9.8455   24.2892    31.2553     13.9998     211.255     
1 1 1 27 15 33 o 17 74.5783 3.19621 101.148     11.4096  100.814     12.3465  44.245     199.007     18.2336     19.0067     
1 1 1 27 15 34 o 3  28.8334 5.66859 11.6179     8.30473  20.9339     9.01244  15.2946    156.695     0.503708    336.695     
1 1 1 27 15 35 o 8  28.215  5.49204 23.4223     8.48035  6.39494     9.15645  11.2577    326.68      4.59459     326.68      
1 1 1 27 15 36 f 0  17.6766 5.19205 5.77038     7.75728  -4.59333    8.28055  21.5196    127.812     0           0           
1 1 1 27 15 37 o 12 48.1784 4.43335 44.5659     9.53032  42.6891     11.216   25.6232    272.395     15.5755     92.3951     
1 1 1 27 15 38 o 10 89.7496 3.01715 150.507     12.8212  141.969     14.1531  62.6575    69.1698     2.84146     249.17      
1 1 1 27 15 39 o 14 106.269 2.89648 210.558     14.7953  198.994     15.9302  83.9311    154.219     15.9565     154.219     
1 1 1 27 15 40 o 7  16.4334 5.10595 -3.31845    7.92598  0.965498    8.38159  1.68433    162.379     4.15282     342.379     
1 1 1 27 15 41 o 15 19.062  5.45715 7.52638     8.29647  -1.75552    8.62801  5.1563     216.248     5.31402     36.2481     
1 1 1 27 15 42 o 12 51.8287 4.17997 47.0039     10.2162  54.5549     11.1118  42.6017    219.95      14.2785     219.95      
1 1 1 27 15 43 o 10 16.8839 5.14357 4.40308     8.11569  -6.45639    8.50277  2.82012    217.194     4.64191     37.1938     
1 1 1 27 15 44 o 17 18.8347 5.3982  -4.96544    8.33782  9.26732     8.81656  3.50153    195.215     13.1163     15.2152     
1 1 1 27 15 45 o 18 28.4804 6.05668 14.7709     9.14552  18.6884     9.60167  12.7179    60.949      10.5137     240.949     
1 1 1 27 15 46 f 0  72.4949 3.65866 101.455     13.1623  95.1942     13.232   36.0808    124.895     0           0           
1 1 1 27 15 47 o 17 27.7757 6.22141 13.7523     9.64713  18.3111     9.88418  16.2825    295.904     0.776959    295.904     
1 1 1 27 15 48 o 5  36.6883 6.1622  32.0215     10.5651  24.7557     11.9162  22.9847    306.728     1.35406     126.728     
1 1 1 27 15 49 o 2  25.779  6.40757 12.1983     9.92369  14.5891     10.6088  11.0161    149.917     7.59061     329.917     
1 1 1 27 15 50 o 13 58.0368 4.02674 60.6421     11.493   68.0424     11.5974  47.4563    158.979     16.7584     158.979     
1 1 1 27 15 51 o 13 18.9038 5.69755 2.5317      10.0505  2.53817     8.93983  2.94682    80.1477     9.78612     260.148     
1 1 1 27 15 52 o 18 16.0639 5.11729 -14.1987    9.74404  2.96766     8.9703   3.27639    21.6123     22.4786     21.6123     
1 1 1 27 15 53 f 0  50.7358 4.98228 51.4746     12.417   50.8895     12.2359  26.9247    229.549     0           0           
1 1 1 27 15 54 o 13 20.22   5.88915 11.527      10.8094  -5.66548    9.84183  5.93756    238.192     0.218314    58.1917     
1 1 1 27 15 55 o 12 20.4621 6.38094 6.62717     15.2036  -1.95036    9.82444  6.64268    197.856     7.44487     17.8562     
1 1 1 27 15 56 o 2  21.5261 6.19772 4.22764     10.917   8.78402     10.3059  1.07541    296.504     0.351834    296.504     
1 1 1 27 15 57 o 10 23.2174 6.68828 11.1921     12.0535  6.084       12.6605  6.01747    254.989     2.37333     254.989     
1 1 1 27 15 58 o 5  21.382  6.45325 11.4107     13.9363  -0.258462   10.5032  7.68019    316.44      4.80712     136.44      
1 1 1 27 15 59 f 0  55.9763 5.64028 76.3011     17.3769  57.8731     13.4255  33.6942    124.741     0           0           
1 1 1 27 15 60 o 16 27.2005 7.35252 16.8736     15.7161  18.2932     12.5687  6.19485    229.238     2.82749     229.238     
1 1 1 27 15 61 o 6  24.2317 7.31974 13.3011     16.1983  9.24411     15.2833  8.23185    192.11      4.29737     12.1105     
1 1 1 27 15 62 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 15 63 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 16 0  o 5  10.2465 4.91961 -3.92762    7.61124  -3.92762    7.61124  1.4263     0.000363804 3.49306     0.000363804 
1 1 1 27 16 1  o 9  46.6824 4.38749 37.2757     10.1256  43.1699     9.80801  39.9012    156.059     25.9518     156.059     
1 1 1 27 16 2  o 14 73.8314 3.46013 102.077     12.3949  94.8501     13.0174  63.9767    121.252     21.1929     121.252     
1 1 1 27 16 3  o 13 59.0001 3.97292 60.0554     11.8202  66.8846     11.3197  49.1613    141.05      15.2961     141.05      
1 1 1 27 16 4  o 18 50.449  4.7661  54.5693     11.4479  40.2014     11.7259  12.5071    189.589     47.689      9.58943     
1 1 1 27 16 5  o 13 22.1487 5.83346 12.2735     9.74671  0.909908    8.34268  2.08727    209.552     14.5973     29.5523     
1 1 1 27 16 6  o 8  82.2486 3.38326 111.616     14.4546  132.848     13.0586  83.4537    150.612     48.5337     150.612     
1 1 1 27 16 7  o 9  124.934 3.07354 275.864     19.3598  284.722     19.0583  96.7694    307         7.45987     307         
1 1 1 27 16 8  f 0  121.058 3.03591 261.455     19.044   264.821     17.6979  101.595    151.462     0           0           
1 1 1 27 16 9  o 9  61.903  3.6371  68.6211     11.2811  70.4732     11.0753  37.6414    284.454     14.1844     104.454     
1 1 1 27 16 10 o 12 98.1824 2.92883 174.295     14.0465  171.879     14.6971  86.2146    331.398     27.9286     331.398     
1 1 1 27 16 11 o 15 37.6154 4.96945 28.0716     8.79172  25.31       9.23169  25.9817    229.188     12.2887     229.188     
1 1 1 27 16 12 o 19 156.066 2.81235 448.697     21.5841  424.5       22.3444  136.124    126.38      39.6531     126.38      
1 1 1 27 16 13 o 9  40.9042 4.50296 32.9404     8.65764  29.4258     9.14284  7.94155    334.028     41.6563     154.028     
1 1 1 27 16 14 o 6  21.3561 5.41859 10.6441     7.50967  2.74776     7.88397  5.04139    39.5536     34.6307     39.5536     
1 1 1 27 16 15 o 11 18.1233 5.21109 3.75579     7.32311  1.59018     7.57087  3.99233    196.157     23.8796     196.157     
1 1 1 27 16 16 o 4  21.5636 5.45046 10.8403     7.43562  2.79214     8.19819  1.97699    137.874     15.5367     317.874     
1 1 1 27 16 17 o 5  62.4863 3.29097 67.3799     10.0802  74.1613     10.3762  38.6376    337.232     12.8205     157.232     
1 1 1 27 16 18 o 7  127.561 2.71607 294.975     16.8994  289.054     17.7647  82.0156    157.315     25.0916     337.315     
1 1 1 27 16 19 o 12 26.8491 5.59116 15.4126     7.89427  11.9132     8.27488  4.52892    147.692     23.9731     327.692     
1 1 1 27 16 20 o 13 56.7928 3.6419  59.1844     10.2462  58.5964     10.2589  30.8931    223.887     19.5809     43.8867     
1 1 1 27 16 21 o 9  52.9434 3.79544 51.7095     10.0933  51.0984     9.76749  35.2133    154.258     4.18417     334.258     
1 1 1 27 16 22 o 17 24.281  5.25184 18.1058     7.87924  1.62298     8.00114  7.55412    217.24      6.86708     37.2399     
1 1 1 27 16 23 o 15 61.1961 3.47756 69.8274     10.5074  66.6885     10.6343  50.7401    351.215     15.0152     351.215     
1 1 1 27 16 24 o 6  75.25   3.24196 113.956     11.8083  91.974      12.3416  52.4142    188.06      4.1513      8.0601      
1 1 1 27 16 25 o 19 96.7544 2.83765 154.318     13.6683  183.768     13.7109  80.0646    308.027     19.1381     308.027     
1 1 1 27 16 26 o 18 29.1169 5.84342 16.3693     8.72085  16.6432     9.12261  10.0639    244.071     16.2685     64.0706     
1 1 1 27 16 27 o 7  31.1497 5.57156 23.148      9.18256  14.9605     8.38385  17.6897    333.232     1.24774     153.232     
1 1 1 27 16 28 o 8  37.5301 5.02437 31.7262     8.98956  22.5637     9.14198  26.9627    256.213     6.54084     256.213     
1 1 1 27 16 29 o 12 48.8485 4.04136 41.6441     9.76547  46.944      9.59684  43.1399    106.685     21.0297     106.685     
1 1 1 27 16 30 o 13 50.0334 3.96855 45.9609     9.74723  46.761      9.81129  32.2851    245.326     5.27398     65.3259     
1 1 1 27 16 31 o 6  17.6549 5.11652 -4.26003    7.77964  6.39617     7.60147  0.46171    258.858     11.9005     78.858      
1 1 1 27 16 32 o 9  18.1768 5.33381 3.0623      7.99297  1.5128      7.98625  1.30379    52.789      11.0745     232.789     
1 1 1 27 16 33 o 19 67.0302 3.44138 83.8097     11.3131  80.6116     11.6359  43.2494    299.1       9.26119     119.1       
1 1 1 27 16 34 o 16 48.8915 4.09489 48.1957     9.98853  41.1365     9.6558   23.3945    272.98      21.9931     92.9801     
1 1 1 27 16 35 o 3  41.6776 4.74902 28.929      9.6662   37.6973     9.32527  20.9992    110.471     15.567      290.471     
1 1 1 27 16 36 o 6  15.2212 4.85853 -3.19439    7.78373  -3.12561    7.95596  0.360324   333.799     8.23916     153.799     
1 1 1 27 16 37 o 9  42.2678 4.68867 37.038      9.68648  31.5726     9.49052  39.7873    356.409     26.4105     356.409     
1 1 1 27 16 38 o 8  45.108  4.60538 36.3515     10.4288  41.5711     9.65684  32.6656    261.548     3.40909     261.548     
1 1 1 27 16 39 o 4  35.8594 5.4285  24.3535     9.4226   26.9606     9.50343  30.0199    340.301     16.257      340.301     
1 1 1 27 16 40 o 8  30.581  5.96652 22.8625     9.78341  15.538      9.28627  18.3131    162.818     2.20045     342.818     
1 1 1 27 16 41 o 5  62.8397 3.80989 69.2037     11.0809  78.8962     12.6948  63.7738    78.2556     41.0016     78.2556     
1 1 1 27 16 42 o 4  30.7109 5.71171 25.476      9.23485  13.3544     9.14028  21.0234    54.0477     4.36471     54.0477     
1 1 1 27 16 43 o 13 60.3987 3.74856 70.9917     11.1715  66.1363     11.2726  50.639     283.321     17.4325     283.321     
1 1 1 27 16 44 o 5  35.5691 5.54306 29.0532     9.61343  22.8656     9.64955  29.4929    347.065     16.9831     347.065     
1 1 1 27 16 45 o 1  18.9949 5.4878  8.32784     8.63325  -2.61262    8.82946  4.32205    45.1187     1.77634     225.119     
1 1 1 27 16 46 o 18 14.8109 4.81292 -0.723224   8.45341  -9.60381    8.20987  0.2124     199.506     1.60308     19.5065     
1 1 1 27 16 47 o 17 45.7956 5.26466 47.7933     11.6835  36.9706     11.5243  40.3325    115.334     21.5873     115.334     
1 1 1 27 16 48 o 4  43.6343 5.51369 52.9275     12.0902  26.824      10.8844  26.538     168.714     5.07879     348.714     
1 1 1 27 16 49 o 9  52.2763 4.64501 54.2116     12.7752  53.073      10.9312  46.7649    32.709      24.8327     32.709      
1 1 1 27 16 50 o 5  19.5409 5.9118  3.68334     10.8035  1.91165     9.76779  4.63027    28.8289     8.19332     208.829     
1 1 1 27 16 51 o 18 59.7676 4.83429 56.9326     14.239   84.8526     13.2443  48.499     324.896     15.9718     324.896     
1 1 1 27 16 52 o 16 53.7156 5.08112 50.2875     13.6401  65.2322     12.5112  47.0518    77.8648     22.434      77.8648     
1 1 1 27 16 53 o 17 18.5794 5.6619  8.14267     10.4501  -9.61648    10.1024  0.433098   340.349     20.4129     160.349     
1 1 1 27 16 54 o 8  54.3234 5.20278 64.3204     13.5969  55.5589     13.8793  47.2948    341.577     22.4331     341.577     
1 1 1 27 16 55 f 0  38.5941 6.67425 44.6812     12.9875  23.2234     13.6186  27.0918    51.4801     0           0           
1 1 1 27 16 56 o 12 27.6964 6.82917 25.0534     12.4398  8.53742     12.3158  14.1143    166.032     4.16258     346.032     
1 1 1 27 16 57 o 1  30.4662 7.65268 4.5616      16.1994  38.9761     17.0352  17.2248    19.5868     0.553242    199.587     
1 1 1 27 16 58 o 8  29.5104 7.54681 34.9824     16.7055  9.79134     13.3435  16.0204    114.449     6.24486     114.449     
1 1 1 27 16 59 o 19 37.9444 7.83889 47.9196     17.1944  29.5718     14.9342  25.3875    354.454     6.11061     354.454     
1 1 1 27 16 60 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 16 61 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 17 0  o 14 22.7196 7.19673 13.6372     8.73084  13.6372     8.73084  5.54452    360         12.5411     180         
1 1 1 27 17 1  o 15 67.5053 3.35306 91.5845     11.0164  73.9316     11.3713  49.9711    278.282     1.60891     278.282     
1 1 1 27 17 2  o 17 20.4546 5.27116 -6.06472    7.83194  13.3932     8.57582  2.51351    352.806     26.7329     352.806     
1 1 1 27 17 3  o 17 39.9614 4.85985 24.56       9.01679  36.092      9.65731  25.6435    186.582     2.03302     6.58226     
1 1 1 27 17 4  o 18 108.992 2.87144 217.6       15.1335  209.405     16.1373  74.1486    307.945     14.4079     127.945     
1 1 1 27 17 5  o 2  59.6553 3.88256 68.3944     10.3643  61.7841     12.3356  59.4949    26.69       37.2224     26.69       
1 1 1 27 17 6  o 8  72.4929 3.42307 101.541     11.8841  89.1394     12.7236  60.2559    80.2498     14.9461     80.2498     
1 1 1 27 17 7  o 1  86.4581 3.28959 147.256     12.572   123.446     15.3277  45.9002    2.5552      36.602      182.555     
1 1 1 27 17 8  o 8  120.473 2.73624 264.964     15.8671  256.163     17.0806  98.8177    317.312     17.9668     317.312     
1 1 1 27 17 9  o 9  177.483 2.77666 581.258     24.3696  549.401     24.987   132.156    149.883     2.0993      329.883     
1 1 1 27 17 10 o 5  25.3237 5.85204 8.59099     8.75492  14.5629     8.62924  5.58212    236.506     0.582254    56.5058     
1 1 1 27 17 11 o 13 51.8197 4.02421 47.8311     10.2119  51.0335     10.3396  48.9841    20.1968     29.1135     20.1968     
1 1 1 27 17 12 o 11 27.2123 6.03511 13.9092     9.49944  14.0249     8.82636  7.51214    198.623     17.7651     18.6227     
1 1 1 27 17 13 o 7  76.4961 3.21155 107.125     12.3946  104.705     12.1182  63.2362    132.638     14.8192     132.638     
1 1 1 27 17 14 o 3  57.5803 3.59679 60.7344     10.4571  60.3434     10.0846  29.9885    357.281     23.4731     177.281     
1 1 1 27 17 15 o 18 38.6371 4.68748 29.0611     8.73433  27.3272     8.75945  7.7433     186.284     38.8527     6.28395     
1 1 1 27 17 16 o 19 27.5287 5.69821 10.5885     9.16906  17.9684     8.05851  7.76031    27.7369     18.4668     207.737     
1 1 1 27 17 17 o 10 16.9077 5.06523 5.05081     7.77672  -8.03732    8.29856  0.0738312  179.778     2.82202     179.778     
1 1 1 27 17 18 o 2  59.2617 3.53177 60.648      10.0859  67.7181     10.6972  50.822     182.808     17.6659     182.808     
1 1 1 27 17 19 o 3  49.4539 4.17553 42.9483     10.2829  47.849      9.94619  39.4637    90.9496     10.4944     90.9496     
1 1 1 27 17 20 o 4  40.3395 4.61975 27.7211     9.00545  33.8444     8.96705  29.9069    36.6664     6.65801     36.6664     
1 1 1 27 17 21 o 18 21.5021 5.48776 13.5406     8.74096  -0.897691   7.82264  4.72342    26.3882     6.77821     206.388     
1 1 1 27 17 22 o 17 55.7924 3.62534 57.0928     9.9569   57.074      10.0889  41.0407    354.672     2.76452     354.672     
1 1 1 27 17 23 o 8  33.8283 5.33682 22.0114     9.00368  22.4561     8.63151  13.8131    195.261     9.03313     195.261     
1 1 1 27 17 24 f 0  47.9028 4.25934 43.7138     9.61188  41.8979     10.3419  48.5796    42.6242     0           0           
1 1 1 27 17 25 o 16 13.1155 4.35261 -6.10477    7.39893  -7.70658    7.09684  6.05188    213.642     21.016      213.642     
1 1 1 27 17 26 o 1  27.7725 5.73214 15.0712     8.79795  14.957      8.15197  14.3802    122.394     1.1444      302.394     
1 1 1 27 17 27 o 2  20.4706 5.56074 8.27571     8.32405  3.113       7.91498  3.18006    38.4112     13.6471     218.411     
1 1 1 27 17 28 f 0  36.6048 5.74867 22.963      11.436   29.719      9.15462  24.2674    56.4495     0           0           
1 1 1 27 17 29 o 18 51.9907 4.04304 47.6776     10.0547  52.9348     10.667   38.7098    100.014     4.37683     100.014     
1 1 1 27 17 30 o 18 34.8498 5.2796  18.8627     9.06129  28.8888     8.88815  20.7076    17.4096     4.73258     197.41      
1 1 1 27 17 31 o 12 15.889  4.97244 -0.186878   7.80898  -3.38467    7.91005  0.514872   248.691     3.01491     68.6914     
1 1 1 27 17 32 o 11 24.8471 5.85608 10.2397     8.58484  13.0047     8.56586  9.34       304.627     3.49578     304.627     
1 1 1 27 17 33 o 7  148.401 2.66937 404.976     20.0177  391.471     19.6545  122.979    85.6259     29.3231     85.6259     
1 1 1 27 17 34 o 18 39.4095 5.02315 29.0075     9.58932  31.5151     9.51253  30.6824    138.092     8.49217     138.092     
1 1 1 27 17 35 o 5  22.3016 5.83524 10.6249     8.96578  6.00473     8.45779  9.0402     338.927     6.63907     158.927     
1 1 1 27 17 36 o 8  18.4502 5.10003 -11.769     8.46001  11.0601     8.17035  2.31433    171.712     15.9761     351.712     
1 1 1 27 17 37 o 7  37.168  5.33594 23.3912     9.7633   31.9819     9.41473  33.0526    66.4673     21.445      66.4673     
1 1 1 27 17 38 o 3  51.0733 4.19105 50.6538     10.704   48.6214     10.353   27.2612    14.1879     17.6398     194.188     
1 1 1 27 17 39 o 2  47.081  4.6303  44.5114     10.9151  41.4984     10.3467  37.4082    1.75575     10.0312     1.75575     
1 1 1 27 17 40 o 13 54.5464 4.04258 61.8695     11.0138  51.4428     10.6992  55.8656    223.25      38.118      223.25      
1 1 1 27 17 41 o 1  16.1771 5.11843 -1.33173    8.5692   -2.32267    8.48087  1.2654     172.302     11.9817     352.302     
1 1 1 27 17 42 o 16 65.6361 3.72345 78.2127     12.2815  84.0994     11.9765  54.7842    159.528     17.5486     159.528     
1 1 1 27 17 43 o 7  22.1398 6.05128 10.7243     10.1382  5.6602      9.02078  3.91001    271.257     18.8254     91.2567     
1 1 1 27 17 44 f 0  38.2119 6.02519 28.7536     11.5856  32.7856     10.921   21.7981    280.469     0           0           
1 1 1 27 17 45 o 1  59.8137 4.07374 70.9461     12.8589  66.1754     11.242   39.0406    272.514     5.05887     92.5143     
1 1 1 27 17 46 o 7  18.6218 5.46484 -9.03605    10.6108  8.54469     8.39386  0.821471   325.189     17.5689     145.189     
1 1 1 27 17 47 o 9  20.3409 5.95007 6.47724     10.8408  3.68197     8.88815  5.54292    150.354     7.61162     330.354     
1 1 1 27 17 48 o 1  88.1513 3.598   130.053     16.2894  163.021     14.9722  67.2238    323.606     11.0633     323.606     
1 1 1 27 17 49 o 14 22.8299 6.1075  1.31202     11.0879  14.3627     9.60082  10.3735    143.823     1.53053     143.823     
1 1 1 27 17 50 o 16 65.4501 4.27228 72.51       14.4208  93.4416     12.6717  55.5517    146.929     21.1073     146.929     
1 1 1 27 17 51 o 12 22.8871 6.26276 7.78462     11.3327  10.5264     9.34863  9.62538    239.573     3.19198     239.573     
1 1 1 27 17 52 o 11 17.5459 5.58725 1.16416     10.838   -4.47762    9.88081  4.06643    337.222     3.11025     157.222     
1 1 1 27 17 53 o 8  51.3027 5.87449 65.9703     14.6773  46.6363     14.2176  37.1955    196.427     5.45301     196.427     
1 1 1 27 17 54 o 16 18.8172 5.99595 -0.684106   12.6975  -0.170785   11.1519  4.78284    18.1942     6.56502     198.194     
1 1 1 27 17 55 o 18 24.6018 6.92673 16.8754     13.8128  8.61604     11.9127  10.1796    131.271     2.2782      131.271     
1 1 1 27 17 56 o 4  23.1388 7.00987 9.27144     17.4825  8.90718     11.8224  6.32653    4.55332     0.221732    4.55331     
1 1 1 27 17 57 o 14 32.1343 8.39114 28.9915     28.5173  30.1443     13.3558  18.4626    178.999     1.93739     178.999     
1 1 1 27 17 58 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 17 59 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 18 0  o 10 57.444  3.79364 60.7436     10.6895  60.7436     10.6895  14.5081    179.999     13.1848     179.999     
1 1 1 27 18 1  o 11 109.298 2.94985 217.725     16.1048  213.17      16.1489  95.1365    354.114     27.0472     354.114     
1 1 1 27 18 2  o 8  73.295  3.25476 97.2267     11.6914  97.676      12.0952  41.0192    321.775     26.6065     141.775     
1 1 1 27 18 3  o 8  38.9975 5.11634 35.1207     9.16605  23.4096     9.88944  14.6219    121.119     25.4802     301.119     
1 1 1 27 18 4  o 13 95.4809 2.73148 160.379     12.7323  167.832     13.3553  74.2734    93.1392     6.29048     93.1392     
1 1 1 27 18 5  o 8  19.9314 5.45556 0.000395867 7.62438  9.20083     8.49157  2.16904    18.4745     10.9048     198.475     
1 1 1 27 18 6  o 7  27.2664 5.4839  8.66261     8.3691   19.4819     8.07258  4.04539    119.503     27.3268     299.503     
1 1 1 27 18 7  o 4  24.8082 5.80543 11.2987     8.08058  11.2882     8.72634  7.61676    203.464     1.03301     23.4642     
1 1 1 27 18 8  o 9  34.6942 5.50401 20.9374     8.59086  25.957      10.0986  7.23363    43.5968     33.7694     223.597     
1 1 1 27 18 9  o 15 70.7631 3.23205 94.1413     11.2259  87.7035     11.5473  59.1822    262.227     14.9342     262.227     
1 1 1 27 18 10 o 19 33.9553 5.43262 26.14       8.92224  18.7453     9.21338  12.8258    222.487     20.452      42.4874     
1 1 1 27 18 11 o 17 76.5799 3.26851 110.469     12.1031  102.57      12.8125  54.4314    300.481     4.14902     120.481     
1 1 1 27 18 12 o 16 43.164  4.94581 38.7941     9.68015  32.0797     10.7793  25.7533    23.0282     8.90595     203.028     
1 1 1 27 18 13 o 3  98.7104 2.88895 179.586     13.4187  172.185     15.0119  81.4191    306.573     16.2754     306.573     
1 1 1 27 18 14 o 10 18.9353 5.608   3.75267     8.13933  -0.393712   9.97058  1.43055    265.301     11.4492     85.3012     
1 1 1 27 18 15 f 0  20.0681 5.76629 1.24702     8.35553  6.52589     9.879    7.32774    309.639     0           0           
1 1 1 27 18 16 o 1  17.3223 5.30006 1.62973     8.49505  -2.42411    8.53238  0.194668   88.7192     12.364      88.7192     
1 1 1 27 18 17 o 8  25.3678 5.95044 14.1799     8.81381  9.49399     9.02676  10.6236    341.934     3.27243     161.934     
1 1 1 27 18 18 o 2  46.1887 4.52651 42.1427     9.88461  38.1267     10.4353  37.8726    47.4485     12.3813     47.4485     
1 1 1 27 18 19 o 8  76.0123 3.20929 99.9894     12.2264  110.186     12.0802  52.2028    149.334     7.25399     329.334     
1 1 1 27 18 20 o 3  45.5203 4.45817 41.9674     9.99264  36.0375     9.76563  37.3579    287.741     12.4698     287.741     
1 1 1 27 18 21 o 18 51.1148 3.89507 47.8257     9.709    48.9076     9.93166  24.4774    295.721     24.7118     115.721     
1 1 1 27 18 22 o 19 68.3261 3.46991 89.3394     11.8231  81.5604     11.7631  46.7942    237.765     5.99581     57.7652     
1 1 1 27 18 23 o 19 31.7451 5.12543 33.8176     8.88182  5.92038     8.94388  6.30998    347.681     30.9191     167.681     
1 1 1 27 18 24 o 3  37.2624 5.31864 27.4075     8.99896  26.6767     10.161   9.47095    178.455     33.4033     358.455     
1 1 1 27 18 25 o 19 18.829  5.36432 6.70783     7.90952  -0.542179   8.13694  4.01419    282.568     30.4891     282.568     
1 1 1 27 18 26 o 18 52.8001 3.96329 51.5677     10.0352  52.1362     10.6114  52.9001    220.824     33.6081     220.824     
1 1 1 27 18 27 o 6  59.7682 3.85996 59.9314     10.9188  72.8428     11.9408  31.3642    218.212     23.9772     38.212      
1 1 1 27 18 28 o 2  26.8085 5.89273 18.2134     9.07621  9.68937     8.8849   5.90312    59.5667     48.7262     59.5667     
1 1 1 27 18 29 o 12 54.5187 4.11508 60.0015     11.0976  51.5919     10.9872  38.1322    299.996     1.86198     119.996     
1 1 1 27 18 30 o 15 23.6833 5.66509 15.7149     8.48534  3.66703     8.67715  10.017     138.573     8.39712     318.573     
1 1 1 27 18 31 o 8  42.0409 4.78545 29.1255     9.53808  39.5845     9.81514  23.997     240.48      11.1184     60.4796     
1 1 1 27 18 32 o 11 35.1259 5.61017 22.5071     9.44149  27.3117     9.86622  28.3451    215.148     11.5503     215.148     
1 1 1 27 18 33 o 16 64.599  3.53987 74.5942     11.2002  80.4296     11.538   49.8727    236.24      6.91104     236.24      
1 1 1 27 18 34 o 4  48.7322 4.46516 45.8367     10.0597  45.3978     11.182   28.1376    66.6015     12.9487     246.602     
1 1 1 27 18 35 o 4  16.0622 5.05091 -2.41375    8.23857  -0.645479   8.12025  1.53685    224.367     12.0333     44.3671     
1 1 1 27 18 36 o 10 31.721  5.71191 27.4433     9.40718  14.3022     9.36762  23.2825    309.602     6.70172     309.602     
1 1 1 27 18 37 o 12 21.2454 5.56256 -1.47028    8.68181  13.7991     8.73201  8.1722     277.362     6.95851     97.3623     
1 1 1 27 18 38 o 6  37.7983 5.58049 33.9414     10.0946  24.9246     10.3753  25.2343    261.487     0.538584    81.4867     
1 1 1 27 18 39 o 7  66.178  3.7614  89.7858     12.6947  75.828      12.0205  62.7876    94.2371     32.518      94.2371     
1 1 1 27 18 40 o 6  25.4367 6.21303 4.50609     10.7476  19.4745     10.134   4.40361    37.1758     24.0624     217.176     
1 1 1 27 18 41 o 11 38.6911 5.92025 32.7241     11.3807  30.1308     10.9139  33.0457    265.05      18.0144     265.05      
1 1 1 27 18 42 o 13 23.074  6.26467 4.92375     10.5153  13.1204     10.3389  8.68275    97.316      7.76504     277.316     
1 1 1 27 18 43 o 10 54.8564 4.68464 50.6922     12.9284  68.1503     11.6579  43.0725    129.254     10.5961     129.254     
1 1 1 27 18 44 o 2  52.283  4.71964 62.6589     12.7604  45.9505     11.3417  51.8435    53.5649     35.4115     53.5649     
1 1 1 27 18 45 o 10 27.0463 6.42402 10.6709     11.6901  19.2294     9.78824  7.93732    32.7747     18.4694     212.775     
1 1 1 27 18 46 o 14 57.5748 4.51634 61.6818     13.3985  67.8925     12.0319  54.3342    317.314     30.2436     317.314     
1 1 1 27 18 47 o 12 23.5853 6.28486 7.70232     11.3022  12.3538     9.36358  9.78634    29.1631     8.33551     209.163     
1 1 1 27 18 48 o 6  74.0362 4.00113 96.6155     15.1143  113.714     14.129   59.912     173.107     16.4121     173.107     
1 1 1 27 18 49 o 13 20.3403 6.09539 3.06273     12.2268  5.21279     9.45457  7.05323    272.496     0.295842    272.496     
1 1 1 27 18 50 o 1  23.6527 7.00251 9.28329     16.5137  8.44038     11.4783  11.6921    155.506     1.48678     335.506     
1 1 1 27 18 51 o 2  22.5513 6.35043 2.22143     13.1764  12.7576     9.84458  9.03413    57.1773     7.13268     237.177     
1 1 1 27 18 52 o 12 23.6696 6.6463  15.8885     13.3584  6.80701     10.1785  9.05232    191.867     2.61688     191.867     
1 1 1 27 18 53 o 16 17.5951 5.85372 6.4946      15.6456  -12.2862    8.72393  1.41335    316.884     13.1146     136.884     
1 1 1 27 18 54 f 0  26.5632 6.91865 -8.08933    18.8467  27.5919     12.7749  8.31307    225.215     0           0           
1 1 1 27 18 55 o 18 22.1174 7.32122 -9.3055     33.1248  5.30542     11.9105  4.40709    235.162     1.57054     55.1617     
1 1 1 27 18 56 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 18 57 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 19 0  o 8  53.2921 3.66553 52.4334     9.56244  52.4334     9.56244  63.1864    180         46.9906     180         
1 1 1 27 19 1  o 6  36.4904 4.97178 20.3734     8.72189  31.2042     8.73677  19.7968    131.04      10.5406     311.04      
1 1 1 27 19 2  o 9  57.3286 3.54895 58.9614     10.0361  61.5322     10.1487  61.466     308.272     50.2705     308.272     
1 1 1 27 19 3  f 0  23.585  5.68866 6.09738     8.3863   13.2665     8.20542  19.0303    274.084     0           0           
1 1 1 27 19 4  o 16 109.095 2.72374 214.136     15.1833  214.944     14.5435  84.5286    232.925     5.29742     232.925     
1 1 1 27 19 5  o 1  26.2674 5.81108 13.3407     8.50937  13.0599     8.48348  9.75435    37.9685     2.28805     37.9685     
1 1 1 27 19 6  o 11 65.8906 3.51164 82.297      11.4131  76.5792     11.5863  54.7376    218.378     13.0146     218.378     
1 1 1 27 19 7  o 16 24.8418 5.93547 9.18542     9.52604  13.0169     8.27342  10.0511    35.865      5.49662     215.865     
1 1 1 27 19 8  o 14 26.0896 5.78117 15.2849     8.50055  10.6173     8.46745  9.68976    79.7036     2.24598     79.7036     
1 1 1 27 19 9  o 2  97.7574 2.82838 180.666     13.5235  164.715     14.0738  81.9062    37.2044     17.9027     37.2043     
1 1 1 27 19 10 o 3  59.2897 3.58133 59.6461     10.3291  69.5163     10.725   56.5639    331.669     28.4763     331.669     
1 1 1 27 19 11 o 9  45.8481 4.2272  45.0614     9.44232  33.9124     9.34416  39.9168    215.791     16.9386     215.791     
1 1 1 27 19 12 o 15 70.6699 3.31779 101.253     11.735   81.3875     11.5375  62.1938    197.756     20.8726     197.756     
1 1 1 27 19 13 o 15 68.6766 3.23546 83.7362     11.1309  88.119      11.0027  56.2037    127.902     11.7006     127.902     
1 1 1 27 19 14 o 17 59.3292 3.66217 62.6766     10.897   66.8313     10.6397  46.2476    123.063     6.35794     123.063     
1 1 1 27 19 15 o 7  40.0357 4.80085 24.3913     9.26598  37.4277     9.03084  20.6763    128.217     15.0203     308.217     
1 1 1 27 19 16 o 10 54.4287 4.07311 56.4587     10.6189  53.7336     11.2261  41.3891    15.7018     4.42057     15.7018     
1 1 1 27 19 17 f 0  72.9878 3.49738 100.093     12.5012  95.0908     12.9095  34.3697    28.5512     0           0           
1 1 1 27 19 18 o 3  130.947 2.99283 313.79      18.6545  307.827     20.5049  126.68     321.56      58.1335     321.56      
1 1 1 27 19 19 f 0  36.5448 5.61808 36.0736     9.27383  17.0302     11.0607  35.8127    300.171     0           0           
1 1 1 27 19 20 o 17 39.6351 5.50765 23.7196     9.95398  38.6887     11.176   24.1443    74.7772     6.99729     254.777     
1 1 1 27 19 21 o 11 91.9203 3.20026 155.508     14.2919  152.596     15.0801  83.8181    141.55      31.9426     141.55      
1 1 1 27 19 22 o 4  17.4245 5.51914 -5.74621    9.68685  -0.268594   10.2885  0.694129   100.674     16.2482     280.674     
1 1 1 27 19 23 o 14 20.0735 5.70237 9.91692     9.00968  -6.7362     10.5197  3.59941    36.602      0.397247    216.602     
1 1 1 27 19 24 o 12 18.8463 5.52573 -2.9029     8.73402  6.83216     9.01093  4.88808    22.7577     8.37639     202.758     
1 1 1 27 19 25 o 8  18.4294 5.55721 0.0651763   8.83179  2.73941     9.28269  4.77456    248.927     6.95173     68.9272     
1 1 1 27 19 26 o 8  84.763  3.12143 135.079     13.2122  127.899     13.207   69.2453    353.964     13.8889     353.964     
1 1 1 27 19 27 o 8  17.6658 5.23825 -3.38199    8.1607   5.55827     8.08763  2.51195    359.367     13.8        179.367     
1 1 1 27 19 28 o 12 51.3082 4.35333 54.0761     10.3088  46.3469     11.399   34.3255    39.7362     5.12341     219.736     
1 1 1 27 19 29 o 4  32.6053 5.94021 26.1353     10.4688  17.9389     9.17888  22.5495    92.6201     2.06929     92.6201     
1 1 1 27 19 30 o 13 22.8764 5.94513 9.70153     8.76484  8.95429     9.14244  3.70431    308.836     22.2996     128.836     
1 1 1 27 19 31 o 17 22.1934 5.63852 15.1173     8.8575   -0.292935   8.8444   6.08817    59.8625     15.6934     239.862     
1 1 1 27 19 32 o 16 31.3759 6.13861 18.3323     9.86799  23.0809     10.1648  15.2516    291.428     11.881      111.428     
1 1 1 27 19 33 o 8  32.5915 5.79749 19.5502     9.41741  24.7243     9.57155  20.0444    185.827     3.43335     5.82654     
1 1 1 27 19 34 o 12 27.6753 6.10311 15.7033     9.28905  16.3535     9.47055  18.1611    20.45       3.90029     20.45       
1 1 1 27 19 35 o 4  21.3757 6.03136 9.68683     9.88817  3.20266     9.89655  5.16997    88.9991     15.3705     268.999     
1 1 1 27 19 36 o 17 30.9083 6.6955  21.4246     11.113   20.2977     11.6064  17.9189    263.406     11.9373     263.406     
1 1 1 27 19 37 o 2  21.3656 6.1739  6.32578     10.847   6.04211     10.1046  6.38706    133.942     0.456588    133.942     
1 1 1 27 19 38 o 14 19.1815 5.77669 6.66122     10.109   -2.51398    9.86381  4.19778    229.606     2.01329     49.6055     
1 1 1 27 19 39 o 4  20.4869 6.02774 8.62559     10.1602  -0.803666   10.9847  6.24326    338.035     6.69852     158.035     
1 1 1 27 19 40 o 4  21.0095 5.87903 12.9317     10.287   -1.2239     9.11262  6.65206    153.516     2.73648     333.516     
1 1 1 27 19 41 o 16 25.981  6.35768 19.7516     11.0958  8.32711     9.59607  12.6327    145.9       4.74293     325.9       
1 1 1 27 19 42 o 4  52.9539 4.69673 58.322      12.8396  52.6026     11.5473  53.531     169.316     36.6097     169.316     
1 1 1 27 19 43 o 2  64.3289 4.21196 81.0467     13.8915  78.8134     12.9472  49.023     258.518     7.43506     258.518     
1 1 1 27 19 44 o 15 34.5761 6.42855 22.4072     12.5755  29.7721     10.4373  25.4402    81.9781     6.43251     81.9781     
1 1 1 27 19 45 o 9  22.746  6.29011 14.3191     11.527   3.35564     9.69746  11.7021    223.49      0.753686    223.49      
1 1 1 27 19 46 o 3  24.8642 6.45822 22.1922     12.6346  1.93858     9.91321  14.5334    332.845     2.531       332.845     
1 1 1 27 19 47 o 18 26.5062 6.77031 18.8742     12.9669  12.1634     10.0906  10.8047    193.679     11.7776     13.679      
1 1 1 27 19 48 o 4  26.2566 7.09794 22.6782     15.5299  8.61413     10.5284  15.9134    9.27495     4.35601     9.27495     
1 1 1 27 19 49 o 1  38.5698 7.33293 45.9226     17.5655  27.92       11.4768  31.141     356.539     13.9899     356.539     
1 1 1 27 19 50 o 6  34.3051 7.26057 29.2201     16.5806  29.4255     11.1651  25.5553    157.308     11.1008     157.308     
1 1 1 27 19 51 o 14 28.1618 7.87275 19.4984     22.6301  20.5212     12.6289  14.9699    51.101      4.96742     51.101      
1 1 1 27 19 52 o 14 28.6409 7.69349 24.427      16.8808  19.8405     13.623   13.1807    28.0025     6.75511     208.003     
1 1 1 27 19 53 o 12 26.3279 7.83492 17.1855     18.3497  17.7956     16.8755  10.0036    152.372     1.43779     152.372     
1 1 1 27 19 54 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 20 0  o 7  52.0409 3.9105  50.4352     9.90902  50.4352     9.90902  61.324     5.25651e-06 44.231      5.25651e-06 
1 1 1 27 20 1  o 19 61.1807 3.42893 64.73       10.4607  72.597      10.3559  69.1535    237.6       58.3955     237.6       
1 1 1 27 20 2  o 18 56.4947 3.75162 59.8398     10.6788  58.0672     10.3161  60.8543    282.015     43.8632     282.015     
1 1 1 27 20 3  o 4  59.0144 3.63988 57.8157     10.837   70.762      10.3038  59.9407    69.0544     35.6077     69.0544     
1 1 1 27 20 4  o 3  53.1302 3.99002 51.9279     10.1955  53.0292     10.7243  47.4193    268.099     18.7157     268.099     
1 1 1 27 20 5  o 4  37.9263 4.91434 30.568      8.96988  24.9474     8.98792  30.2794    220.094     10.0566     220.094     
1 1 1 27 20 6  f 0  73.2239 3.14939 96.0127     11.4281  99.3347     11.5758  46.2346    68.5264     0           0           
1 1 1 27 20 7  o 13 24.9514 5.88933 11.3245     8.55871  12.0312     8.7231   12.0262    346.926     1.04863     166.926     
1 1 1 27 20 8  o 9  33.5306 5.30496 32.9402     9.08492  12.1323     8.99351  22.1462    238.263     14.6281     238.263     
1 1 1 27 20 9  o 6  44.3083 4.83356 39.4532     10.8447  35.6591     9.93742  16.7413    132.993     31.047      312.993     
1 1 1 27 20 10 o 15 49.0575 4.45648 42.6068     10.271   48.3067     11.1407  26.7087    102.805     18.2013     282.805     
1 1 1 27 20 11 o 4  39.101  5.19525 35.4565     10.1229  24.4513     9.46124  9.28456    256.668     37.9932     76.6675     
1 1 1 27 20 12 o 14 67.0058 3.62824 84.6728     12.2748  80.7798     11.9074  60.6479    172.515     22.8642     172.515     
1 1 1 27 20 13 o 10 42.948  5.02044 31.4817     9.93725  39.9428     10.9099  35.0427    274.94      10.0714     274.94      
1 1 1 27 20 14 o 13 51.0299 4.37119 39.2084     10.0466  60.0808     11.7321  41.0163    336.541     8.39189     336.541     
1 1 1 27 20 15 f 0  73.3449 3.6915  99.8942     12.3602  98.7541     14.4811  47.9274    358.481     0           0           
1 1 1 27 20 16 o 17 63.2374 3.86266 77.2987     11.7092  71.372      12.4625  55.5289    180.124     18.4122     180.124     
1 1 1 27 20 17 o 19 62.7859 3.67919 70.8294     10.9839  75.2478     11.9608  59.1767    225.326     26.7769     225.326     
1 1 1 27 20 18 o 1  58.9232 3.84965 66.8711     10.8175  62.5416     11.5972  51.8728    140.781     17.8516     140.781     
1 1 1 27 20 19 o 10 87.7825 3.17033 142.152     13.1342  139.974     14.6078  70.4041    175.334     10.1546     175.334     
1 1 1 27 20 20 o 16 24.136  5.94085 15.2519     8.97852  5.08878     9.55155  0.465059   198.336     31.8549     18.3357     
1 1 1 27 20 21 o 7  66.7879 3.67016 89.7957     11.4745  76.2011     12.67    53.7473    29.3522     9.24921     29.3522     
1 1 1 27 20 22 o 17 56.0476 4.21941 57.828      11.7072  61.1798     11.6181  43.4577    201.88      5.31255     201.88      
1 1 1 27 20 23 o 14 60.8836 4.18744 76.2689     11.615   64.2387     13.2567  57.5394    294.9       26.9092     294.9       
1 1 1 27 20 24 o 4  27.7006 6.35338 17.2254     9.2439   13.6533     11.2452  16.9868    94.5954     1.0157      274.595     
1 1 1 27 20 25 o 4  33.4686 5.81991 40.7636     11.3407  4.37954     11.7723  17.3821    88.9368     11.7041     268.937     
1 1 1 27 20 26 o 6  27.1165 6.5481  10.2547     9.91969  19.7803     11.7207  7.29956    141.697     22.1868     321.698     
1 1 1 27 20 27 o 7  22.6339 6.26334 9.74985     9.75854  6.17784     11.0795  10.9346    179.609     3.49668     359.609     
1 1 1 27 20 28 o 18 94.6052 3.37053 175.217     15.4692  157.335     16.2847  79.8654    223.255     20.3488     223.255     
1 1 1 27 20 29 o 16 26.8251 6.39287 21.653      10.6412  5.89667     11.4582  13.592     182.016     7.21447     2.01639     
1 1 1 27 20 30 o 14 73.1462 3.97758 95.4004     14.6698  108.078     14.1678  56.4335    117.009     6.13613     117.009     
1 1 1 27 20 31 o 4  17.9087 5.64735 -4.78454    9.67284  2.24788     10.9721  2.73084    91.0945     27.4063     91.0945     
1 1 1 27 20 32 o 7  74.6739 4.2878  125.784     14.8484  89.9967     16.1949  63.8774    75.5376     19.4472     75.5376     
1 1 1 27 20 33 o 14 61.2663 4.54417 73.0391     12.8936  73.4256     14.5218  51.5803    320.375     15.4659     320.375     
1 1 1 27 20 34 o 5  22.2394 6.35455 2.28428     10.3592  12.1696     11.8908  9.00522    64.7433     0.0363858   244.743     
1 1 1 27 20 35 o 11 19.3945 5.95106 -3.45066    9.86833  6.74856     11.7852  4.5977     73.993      10.1054     253.993     
1 1 1 27 20 36 o 5  58.6553 4.95676 66.3008     13.2316  71.0779     15.2905  58.1349    113.286     35.0147     113.286     
1 1 1 27 20 37 o 1  36.829  6.35881 25.6012     12.2863  33.6374     11.1911  22.7922    299.508     3.60283     119.508     
1 1 1 27 20 38 o 11 30.3499 6.60413 27.5198     11.936   13.3781     10.8577  20.0044    352.71      10.7345     352.71      
1 1 1 27 20 39 o 19 39.0821 6.12049 40.3983     12.5364  25.8555     10.9532  35.1091    255.037     23.9859     255.037     
1 1 1 27 20 40 o 2  43.0575 6.43048 37.2935     15.4856  42.9697     11.2566  35.4442    276.668     12.8612     276.668     
1 1 1 27 20 41 o 1  29.1452 6.66183 29.3568     12.9235  7.88365     10.8713  19.9338    37.1544     4.40884     37.1544     
1 1 1 27 20 42 o 2  21.0408 6.25343 -3.49595    12.3633  10.294      11.2129  0.125826   88.3338     27.1314     88.3338     
1 1 1 27 20 43 o 8  29.9872 7.28291 31.2491     16.1572  12.1489     10.5643  10.4311    88.3358     19.0079     268.336     
1 1 1 27 20 44 o 9  52.772  7.1477  73.1886     17.8237  54.8467     18.4369  45.4907    232.332     18.5687     232.332     
1 1 1 27 20 45 o 17 40.9521 7.39635 59.6205     17.5448  24.0292     14.5099  36.3174    45.7715     20.3507     45.7715     
1 1 1 27 20 46 o 3  22.0399 6.84649 2.9973      15.7908  6.63565     13.5541  4.36846    198.73      1.35444     198.73      
1 1 1 27 20 47 o 11 19.842  6.28407 15.0187     15.3647  -19.5026    11.8208  3.1072     347.341     0.256821    167.341     
1 1 1 27 20 48 o 13 21.8851 6.7619  16.145      15.8364  -4.96946    12.8736  7.09313    282.922     0.692074    102.922     
1 1 1 27 20 49 o 8  27.8555 7.71767 21.0724     17.8749  19.9873     13.8091  14.5155    184.171     1.25226     4.17144     
1 1 1 27 20 50 o 7  24.8313 7.30783 19.9984     16.7388  9.16771     13.2767  9.99751    285.809     4.24925     105.809     
1 1 1 27 20 51 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 20 52 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 21 0  o 18 58.983  3.70724 64.2831     10.7498  64.2831     10.7498  54.4325    1.55723e-05 18.9113     1.55723e-05 
1 1 1 27 21 1  o 8  44.5254 4.44768 37.3896     9.61691  38.1085     9.67936  16.1446    216.18      33.4237     36.18       
1 1 1 27 21 2  o 5  40.4196 4.92109 37.4225     9.60206  26.3626     9.47337  26.5482    278.765     4.97024     98.7654     
1 1 1 27 21 3  o 14 66.4002 3.50726 95.1258     11.7057  68.5992     11.2724  74.11      178.651     51.6057     178.651     
1 1 1 27 21 4  o 10 40.4975 4.85343 26.0006     9.36672  37.9863     9.44457  26.3707    149.369     5.51931     329.369     
1 1 1 27 21 5  o 15 50.6429 4.02032 51.6252     10.0636  44.7525     9.94816  38.4146    353.802     2.55761     353.802     
1 1 1 27 21 6  o 18 28.1702 5.82029 14.8923     8.783    16.9313     8.70565  18.5541    164.203     1.5637      164.203     
1 1 1 27 21 7  o 4  45.0264 4.54818 41.2173     9.78582  36.4018     10.0902  32.5442    82.6444     0.285415    262.644     
1 1 1 27 21 8  o 16 36.0668 5.63388 33.3995     9.84303  19.239      10.1916  27.6396    348.023     5.54171     348.023     
1 1 1 27 21 9  o 11 15.9528 5.06203 -2.69942    7.94567  -2.27115    8.83444  1.89596    258.951     3.53667     78.951      
1 1 1 27 21 10 o 7  59.1214 3.84823 70.3134     10.8113  60.4004     11.5812  46.8493    188.468     6.20873     188.468     
1 1 1 27 21 11 o 5  49.9014 4.52162 47.9677     10.7013  47.2224     11.3704  46.4445    62.7824     21.093      62.7824     
1 1 1 27 21 12 o 18 81.5029 3.31034 126.094     12.7312  118.418     14.0952  80.6082    340.636     39.7247     340.636     
1 1 1 27 21 13 o 14 94.3955 3.0218  162.961     13.8242  162.891     14.6763  69.9401    213.268     2.1292      33.2679     
1 1 1 27 21 14 o 2  24.0647 6.11892 15.3341     9.15451  2.69966     11.2981  13.6909    42.8401     2.32339     42.8401     
1 1 1 27 21 15 o 17 46.6687 5.15359 51.7335     11.4406  34.6013     11.4847  41.8845    79.8138     17.2338     79.8138     
1 1 1 27 21 16 o 13 51.2353 4.56388 56.7619     10.8075  44.5249     11.7351  35.9339    328.353     3.22796     148.352     
1 1 1 27 21 17 o 19 39.2566 5.62117 33.9896     10.078   28.4438     11.2316  33.7469    214.758     13.3003     214.758     
1 1 1 27 21 18 o 13 46.9444 4.92404 41.5275     10.6046  44.8727     11.8587  29.4705    16.0835     9.51053     196.083     
1 1 1 27 21 19 o 19 34.7797 6.38147 24.2222     10.0941  26.9944     12.3622  12.505     313.042     24.6164     133.042     
1 1 1 27 21 20 o 2  65.9872 4.04582 84.0709     11.649   80.9274     14.5445  54.9453    318.4       12.4824     318.4       
1 1 1 27 21 21 o 9  50.414  4.5373  46.3707     10.3274  52.2569     12.0787  49.979     42.7913     28.4012     42.7913     
1 1 1 27 21 22 o 18 22.6105 5.90607 16.2133     9.87115  -2.00603    9.95301  8.18258    50.893      12.145      230.893     
1 1 1 27 21 23 o 14 27.5453 5.64025 26.2166     9.33538  1.34754     10.5883  12.034     208.301     13.1447     28.3007     
1 1 1 27 21 24 o 14 18.009  5.49611 3.28704     8.63067  -1.45124    9.69255  2.62341    280.85      0.643843    100.85      
1 1 1 27 21 25 o 9  58.7788 4.10424 58.5058     11.2558  74.3411     12.5961  57.5571    195.889     30.471      195.889     
1 1 1 27 21 26 o 10 34.0344 6.65352 25.358      10.9436  25.4899     12.5586  28.5981    169.227     16.3643     169.227     
1 1 1 27 21 27 o 19 41.1195 6.11596 37.4327     11.5333  34.1977     12.8557  36.4338    15.1        17.1229     15.1        
1 1 1 27 21 28 o 6  18.4784 5.74809 4.24438     9.77642  -6.61817    11.6863  3.83252    219.682     12.0319     39.6822     
1 1 1 27 21 29 o 1  18.3779 5.89132 0.357674    9.74018  -6.80464    14.1159  4.24263    28.8873     3.02235     208.887     
1 1 1 27 21 30 o 8  51.4849 7.22493 72.4293     19.9584  47.6631     16.138   39.5841    318.677     6.25098     318.677     
1 1 1 27 21 31 o 1  39.8728 7.59414 40.9322     14.1755  33.4265     17.458   21.6447    87.9342     12.0931     267.934     
1 1 1 27 21 32 o 9  57.2137 6.47962 65.2726     15.8404  75.9508     19.988   50.6405    298.52      20.5002     298.52      
1 1 1 27 21 33 o 7  29.3021 7.52067 15.0667     13.4374  23.9098     15.2094  18.3646    134.278     6.23899     134.278     
1 1 1 27 21 34 o 19 37.0089 6.5063  53.2544     14.338   7.73742     14.4146  19.8947    216.368     10.9705     36.3675     
1 1 1 27 21 35 o 2  58.5708 5.46719 64.4589     16.5203  76.086      14.1708  54.9371    33.8304     27.3596     33.8304     
1 1 1 27 21 36 o 19 18.3016 5.77216 3.46508     11.4534  -5.30019    10.2067  2.27145    216.93      15.9857     36.9302     
1 1 1 27 21 37 o 12 55.4498 5.56308 68.5126     15.0526  58.3482     14.9041  47.9552    170.18      17.5735     170.18      
1 1 1 27 21 38 o 3  44.4706 6.49257 48.5588     14.3396  38.1504     13.6648  38.4918    174.007     16.1074     174.007     
1 1 1 27 21 39 o 19 26.4508 7.29603 14.5878     15.9225  14.1935     12.1838  15.7479    125.303     7.68376     125.303     
1 1 1 27 21 40 o 19 73.4854 5.91839 123.981     22.5133  105.016     20.3163  58.2818    56.401      11.249      56.4011     
1 1 1 27 21 41 o 11 20.2593 6.51846 6.87432     15.141   -13.2635    14.8682  4.06368    127.287     0.855536    127.287     
1 1 1 27 21 42 o 13 22.8596 7.08042 1.32657     16.0221  9.79406     15.3008  11.3889    88.6077     1.36954     88.6077     
1 1 1 27 21 43 o 11 23.1697 7.12389 0.457454    16.0856  12.8177     15.4485  11.1972    283.367     1.32745     103.367     
1 1 1 27 21 44 o 15 19.3976 6.35945 -14.1332    15.3669  4.34943     14.9534  4.35745    104.194     11.5626     284.194     
1 1 1 27 21 45 o 6  36.4887 8.26503 49.3714     18.048   26.5128     17.9299  28.3154    24.0064     13.3745     24.0064     
1 1 1 27 21 46 o 9  29.1557 8.09362 28.9468     17.3045  18.7812     17.7954  13.8295    92.9019     6.73424     92.9019     
1 1 1 27 21 47 o 7  27.4299 7.77537 33.1321     17.8849  4.81374     17.052   13.5737    223.542     2.33269     43.5425     
1 1 1 27 21 48 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 21 49 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 22 0  o 7  12.5444 5.71061 0.862876    8.26266  0.862876    8.26266  0.0153649  180         1.49558     180         
1 1 1 27 22 1  o 4  37.6441 5.25363 26.1074     9.53221  30.6806     9.57929  16.5527    31.7293     21.7874     211.729     
1 1 1 27 22 2  o 15 21.4128 5.9615  9.09693     10.1077  4.52614     8.72562  3.16931    27.3876     35.6707     27.3876     
1 1 1 27 22 3  o 13 17.7893 5.14921 -6.7417     8.22495  8.08612     7.94405  4.59407    96.8166     9.61352     276.817     
1 1 1 27 22 4  o 11 29.2759 6.10875 18.753      9.22277  16.7749     9.99717  20.3153    3.10465     2.23131     3.10464     
1 1 1 27 22 5  o 6  20.6068 5.7904  8.56594     8.61178  2.00397     9.76434  8.57236    121.728     0.352367    121.728     
1 1 1 27 22 6  o 6  38.566  5.49981 35.1163     9.60872  25.2609     10.8277  26.8537    323.637     1.56042     143.637     
1 1 1 27 22 7  o 12 19.6906 5.73684 1.06073     8.54634  7.05452     9.85665  7.67565    6.32969     5.21695     186.33      
1 1 1 27 22 8  o 15 42.0732 5.38467 38.9766     10.1174  32.1982     11.5614  34.1665    206.358     8.0058      206.358     
1 1 1 27 22 9  o 9  56.5127 4.31859 50.5346     11.7866  72.7064     11.8912  53.0967    17.2232     23.107      17.2232     
1 1 1 27 22 10 o 6  59.8288 4.1015  81.0599     11.2552  56.0073     12.32    37.9825    13.5226     13.4796     193.523     
1 1 1 27 22 11 f 0  44.1439 5.2334  48.5948     10.6869  30.1324     11.1465  24.2798    343.585     0           0           
1 1 1 27 22 12 o 6  59.3543 4.00942 65.8811     11.1348  67.9598     12.4013  28.9588    71.5363     30.9552     251.536     
1 1 1 27 22 13 o 18 31.4346 6.55094 23.137      9.97204  18.9272     12.476   14.5887    2.32887     14.9298     182.329     
1 1 1 27 22 14 o 18 84.447  3.57822 131.006     14.2503  135.827     15.8715  70.5328    191.848     14.2391     191.848     
1 1 1 27 22 15 o 9  60.9837 3.96652 64.8574     11.4882  76.7833     12.4817  56.2749    233.635     22.6178     233.635     
1 1 1 27 22 16 f 0  29.8563 6.20309 20.8224     9.34532  16.935      10.6643  8.95875    81.8253     0           0           
1 1 1 27 22 17 o 10 18.8862 5.66596 2.0752      8.70332  3.48378     9.90831  6.06099    349.511     7.69775     169.511     
1 1 1 27 22 18 o 3  44.5023 5.01822 37.6924     10.3386  41.5808     11.299   32.896     258.3       1.52492     258.3       
1 1 1 27 22 19 o 17 61.1635 4.11628 69.1891     11.9537  74.4643     12.9791  43.0102    110.657     4.59398     290.657     
1 1 1 27 22 20 o 4  34.2154 6.1201  33.8088     10.5353  16.4872     11.4984  17.4043    135.726     13.4001     315.726     
1 1 1 27 22 21 o 8  33.8363 6.88135 16.481      12.4263  35.037      13.2517  22.0584    172.388     2.1582      352.388     
1 1 1 27 22 22 o 4  23.6261 6.86409 5.05681     13.9876  11.1127     12.4621  9.92177    125.769     9.13368     305.769     
1 1 1 27 22 23 o 1  30.8032 7.34575 20.5643     12.4669  22.664      14.4305  22.8443    114.679     9.75773     114.679     
1 1 1 27 22 24 o 1  57.8017 5.62261 69.8778     14.3608  67.4227     17.0449  38.5267    265.839     7.57097     85.8391     
1 1 1 27 22 25 o 2  72.4938 4.96543 115.23      16.8384  94.474      18.3182  66.7915    21.1504     27.3432     21.1504     
1 1 1 27 22 26 o 19 36.7018 7.08795 33.2631     12.2642  28.1994     14.9368  15.1421    28.2335     21.3493     208.234     
1 1 1 27 22 27 o 3  18.3357 5.86564 -3.45933    10.5062  -0.0849927  12.478   4.06174    12.1397     7.03157     192.14      
1 1 1 27 22 28 o 15 22.8814 6.64904 4.48398     11.7089  11.4318     12.8956  8.99026    59.1377     7.35163     239.138     
1 1 1 27 22 29 o 8  59.7017 5.42129 86.0561     14.3631  60.4281     16.1503  49.4576    263.042     12.855      263.042     
1 1 1 27 22 30 o 17 16.4146 5.57057 -8.66117    10.0654  -15.4273    15.9921  1.70929    213.205     10.2944     33.2046     
1 1 1 27 22 31 o 2  28.4907 6.86483 24.7854     12.5456  10.8167     11.8384  15.7718    236.781     4.98589     56.7806     
1 1 1 27 22 32 o 7  35.0622 6.72164 24.5471     12.5171  30.7786     11.8857  29.9281    86.2824     16.6991     86.2824     
1 1 1 27 22 33 o 11 24.8234 6.73925 -3.12739    14.9063  19.6666     12.03    11.0556    26.5682     9.29874     206.568     
1 1 1 27 22 34 o 2  42.4436 8.64272 44.5918     17.0554  47.6652     22.0202  34.7787    269.189     11.7543     269.189     
1 1 1 27 22 35 o 11 25.3082 7.85298 0.659668    16.7966  16.7533     21.3176  12.08      274.548     5.80378     274.548     
1 1 1 27 22 36 o 1  35.5414 9.29063 28.7083     21.6974  42.4708     22.5618  16.6561    63.0439     15.2887     243.044     
1 1 1 27 22 37 o 18 49.1937 9.02511 75.0631     22.7388  55.146      22.7138  46.4628    304.663     26.5402     304.663     
1 1 1 27 22 38 o 19 29.2902 8.69061 35.0399     22.6348  0.239431    23.8758  18.1424    345.526     0.140779    345.525     
1 1 1 27 22 39 o 17 24.6259 7.74432 16.9336     22.3393  2.69042     15.481   11.6203    282.835     4.58876     282.835     
1 1 1 27 22 40 o 3  29.2427 8.12948 3.59681     22.5486  33.2141     17.5119  15.7416    257.202     5.43584     77.2016     
1 1 1 27 22 41 o 1  51.4179 7.74453 60.5321     18.9538  73.8034     19.7776  43.3426    75.3338     16.0276     75.3338     
1 1 1 27 22 42 o 8  25.1361 7.56681 5.48574     16.615   21.4329     17.4889  11.971     347.806     3.31024     167.806     
1 1 1 27 22 43 o 18 30.1893 8.28481 26.9562     17.8734  27.5033     17.984   18.5812    187.87      6.32509     187.87      
1 1 1 27 22 44 o 10 46.3893 8.48435 71.6261     20.2753  52.6332     19.9943  37.609     239.538     14.3518     239.538     
1 1 1 27 22 45 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 22 46 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 23 0  o 7  15.772  6.56285 6.22072     8.80622  6.22072     8.80622  3.5897     180         5.68764     360         
1 1 1 27 23 1  o 16 56.3198 4.20991 52.4014     11.1248  70.4648     12.1924  49.2712    351.017     14.9659     351.017     
1 1 1 27 23 2  o 18 20.2714 5.86278 -3.34289    9.86389  10.7177     10.1919  1.61991    349.362     23.3259     169.362     
1 1 1 27 23 3  o 14 78.031  3.43671 118.7       12.8216  109.217     13.8281  71.0733    266.025     24.5145     266.025     
1 1 1 27 23 4  o 5  43.7308 5.0901  37.2054     10.2416  39.6958     11.2894  39.552     348.145     16.4821     348.145     
1 1 1 27 23 5  o 15 102.623 3.14257 199.859     16.0768  190.572     16.1601  103.235    182.309     50.9968     182.309     
1 1 1 27 23 6  o 8  18.1189 5.5357  3.76684     8.76114  -1.9824     9.95728  5.21356    59.3162     2.17002     239.316     
1 1 1 27 23 7  o 10 43.9165 5.26024 38.0571     10.2568  40.1813     12.029   44.688     11.228      28.6879     11.228      
1 1 1 27 23 8  o 8  22.7151 6.16136 6.10945     9.08245  12.2683     10.6772  7.38927    189.109     14.7411     9.10909     
1 1 1 27 23 9  o 15 18.4002 5.75587 -2.10777    10.5155  1.73127     10.501   4.71887    112.196     10.7863     292.196     
1 1 1 27 23 10 o 17 30.7516 6.44619 16.5144     10.0953  25.0243     11.3724  5.90573    210.147     32.2811     30.1466     
1 1 1 27 23 11 o 8  21.4683 6.14104 11.4041     10.5739  0.014529    10.7684  4.80261    215.163     18.0853     35.1634     
1 1 1 27 23 12 o 15 63.7886 4.71887 66.6048     12.9848  95.1182     16.8213  53.0297    274.976     11.0137     274.976     
1 1 1 27 23 13 o 7  19.7016 5.99816 -0.633747   10.2722  5.67719     11.2861  6.60751    179.734     8.56678     359.734     
1 1 1 27 23 14 o 2  28.0298 6.18672 24.8184     10.1097  6.70174     11.428   18.6431    61.3398     1.5734      61.3398     
1 1 1 27 23 15 o 16 23.1253 6.20006 0.980257    9.63658  17.2014     11.3199  11.1911    331.083     3.05469     331.083     
1 1 1 27 23 16 o 6  21.0304 6.23076 -6.0719     10.5686  13.2668     12.7071  8.6838     136.882     4.618       316.882     
1 1 1 27 23 17 o 18 26.4231 6.33317 25.2707     11.3003  -3.4        13.2062  10.8795    308.628     13.4335     128.628     
1 1 1 27 23 18 o 13 19.2932 5.98073 5.02949     10.3909  -5.10108    12.5373  3.6157     106.345     15.0887     286.345     
1 1 1 27 23 19 o 4  28.2481 7.04883 19.3966     11.5202  15.4197     13.7316  11.0709    334.68      15.9486     154.68      
1 1 1 27 23 20 o 13 19.7597 6.12296 4.72018     10.659   -3.00322    13.074   3.20899    315.518     16.8313     135.518     
1 1 1 27 23 21 o 3  19.7675 6.05768 8.10593     10.975   -8.74525    12.8189  3.6714     22.5884     15.4011     202.588     
1 1 1 27 23 22 o 1  56.9961 5.82286 79.4402     16.4659  57.4621     15.564   49.106     35.281      15.5714     35.281      
1 1 1 27 23 23 o 13 25.196  6.97656 12.1954     11.8541  12.6877     13.791   7.80536    305.203     3.31996     305.203     
1 1 1 27 23 24 o 15 19.1807 6.04011 -5.24033    10.8609  5.0686      12.7136  5.28576    200.661     3.64545     20.6609     
1 1 1 27 23 25 o 16 26.4537 7.39157 11.7304     14.9503  16.4269     14.2154  2.93527    60.7141     42.5414     60.7142     
1 1 1 27 23 26 o 19 18.0555 5.8567  -10.0543    10.9165  2.19589     13.1456  4.63319    203.61      4.08653     23.61       
1 1 1 27 23 27 o 8  22.2586 6.86047 5.65643     14.233   3.10028     14.5687  8.23567    94.0357     10.3361     274.036     
1 1 1 27 23 28 o 19 38.1448 8.58697 40.4925     19.0174  34.5902     17.9742  30.3109    157.041     9.41116     157.041     
1 1 1 27 23 29 o 16 34.9891 8.31914 41.4804     18.3994  20.3755     17.4213  21.7818    111.912     4.40428     291.912     
1 1 1 27 23 30 o 4  22.2701 7.03996 0.371318    16.2653  4.20446     15.9677  8.82373    328.979     3.11106     328.979     
1 1 1 27 23 31 o 1  25.9179 7.39926 25.4036     16.2473  -10.2825    18.0301  15.711     313.789     7.2917      313.789     
1 1 1 27 23 32 o 1  31.5725 8.29864 25.4676     16.849   25.532      18.2304  14.5778    340.197     13.8768     160.197     
1 1 1 27 23 33 o 17 20.526  6.68598 0.437509    15.1936  -5.67794    16.8342  8.99588    160.826     1.64729     340.826     
1 1 1 27 23 34 o 2  24.3814 7.50397 12.8024     17.6044  5.22402     16.8076  13.411     156.257     1.34982     336.257     
1 1 1 27 23 35 o 12 40.4072 8.54823 46.6474     18.4859  42.7637     18.893   34.0654    270.671     14.2839     270.671     
1 1 1 27 23 36 o 18 22.3976 7.07779 9.97636     16.6017  -0.671165   16.1617  10.2616    284.365     0.817391    284.365     
1 1 1 27 23 37 o 1  25.0088 7.55957 13.0734     17.0962  13.0709     16.5201  13.1516    82.6175     1.22607     262.618     
1 1 1 27 23 38 o 19 19.885  6.54151 -7.99199    16.2856  2.93361     15.6662  6.08931    179.588     5.11722     359.588     
1 1 1 27 23 39 o 8  33.3468 9.30125 22.7326     19.2686  58.0481     26.7307  20.9755    173.98      0.54929     173.98      
1 1 1 27 23 40 o 6  27.0892 8.66742 -11.0439    25.3552  44.5136     27.7832  13.2101    106.815     2.55407     106.815     
1 1 1 27 23 41 o 2  29.7881 9.02246 -1.00575    26.112   55.9714     26.9074  16.174     233.088     1.32575     53.0875     
1 1 1 27 23 42 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 23 43 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 24 0  o 17 109.278 3.55867 219.517     19.3941  219.517     19.3941  101.663    180         35.4263     180         
1 1 1 27 24 1  o 18 58.8494 4.9934  73.6427     14.3674  65.5295     14.4319  51.226     41.4207     14.9516     41.4207     
1 1 1 27 24 2  o 1  61.6002 4.80986 84.7545     14.5764  66.7074     14.4126  45.8682    107.518     0.655892    287.518     
1 1 1 27 24 3  o 18 22.6299 6.35301 11.4675     9.93689  4.28752     12.3028  4.00568    324.154     1.52608     324.154     
1 1 1 27 24 4  o 8  23.1127 6.26171 15.2086     10.1676  0.928507    11.87    6.29671    246.816     17.7222     66.8158     
1 1 1 27 24 5  o 17 31.5211 6.29412 9.20276     10.5896  35.0839     12.2512  23.755     295.487     15.1231     295.487     
1 1 1 27 24 6  f 0  37.5577 6.55366 34.9211     11.4396  27.7007     13.3403  32.3764    232.602     0           0           
1 1 1 27 24 7  o 9  58.9208 4.89103 72.3265     13.0723  66.6105     14.9866  65.2991    135.684     45.777      135.684     
1 1 1 27 24 8  o 17 34.2663 6.76414 29.0531     11.1036  23.9218     13.4102  20.4856    343.798     7.04766     163.798     
1 1 1 27 24 9  o 9  53.0614 5.39348 55.2731     13.304   60.574      14.5619  54.8386    345.079     33.7259     345.079     
1 1 1 27 24 10 o 4  29.8376 7.3271  21.4428     12.2582  19.3472     14.8246  2.14157    61.4769     38.2137     241.477     
1 1 1 27 24 11 o 13 19.2664 6.37579 -2.82889    11.0256  -9.86425    19.6034  5.49529    66.7641     3.99266     246.764     
1 1 1 27 24 12 o 15 17.0216 5.61978 -3.05613    10.4913  -11.8289    13.5903  2.4936     44.7195     3.66304     224.72      
1 1 1 27 24 13 o 3  22.7512 6.62176 -6.67863    12.0106  18.1917     14.1823  9.49963    165.055     0.942816    165.055     
1 1 1 27 24 14 o 8  39.2642 6.79538 47.9487     13.2423  22.6337     14.8609  30.1757    202.781     5.70387     202.781     
1 1 1 27 24 15 o 12 34.375  7.33637 21.8647     13.8865  34.2016     14.0753  20.7941    166.235     5.75142     346.235     
1 1 1 27 24 16 o 16 29.9957 7.22997 14.5687     12.4258  27.3049     14.0789  21.3289    283.248     8.2969      283.248     
1 1 1 27 24 17 o 14 46.153  6.56446 39.8783     13.9615  54.794      15.3937  39.0658    179.355     12.3324     179.355     
1 1 1 27 24 18 o 6  49.5207 6.12126 46.7737     13.9733  58.8713     15.3001  52.3421    292.785     36.9452     292.785     
1 1 1 27 24 19 f 0  23.9306 7.01967 6.17953     13.9128  12.1119     13.8921  17.0387    90.1868     0           0           
1 1 1 27 24 20 o 4  22.5161 6.92557 4.43664     16.0591  5.62875     13.1993  6.76084    160.018     14.9853     340.018     
1 1 1 27 24 21 o 15 37.2859 7.93562 33.9134     17.253   34.5865     14.9722  21.6248    241.763     9.46635     61.7632     
1 1 1 27 24 22 o 3  53.6484 6.72221 69.3364     17.8577  58.2308     16.9498  38.2762    232.048     2.21314     52.0484     
1 1 1 27 24 23 o 2  58.074  7.24585 69.2748     20.4745  84.4985     19.9635  40.0996    104.989     5.44815     284.989     
1 1 1 27 24 24 o 15 37.5696 8.52266 26.257      19.8304  46.8881     18.4628  21.6921    69.0392     9.75236     249.039     
1 1 1 27 24 25 o 8  26.9287 7.93598 19.9619     19.2483  9.29196     16.3118  15.6893    181.445     3.00016     1.44529     
1 1 1 27 24 26 o 16 19.7277 6.53881 -1.9879     17.2912  -10.7051    15.0793  7.14587    20.2012     0.442394    20.2012     
1 1 1 27 24 27 o 2  35.8221 8.60959 41.6195     19.8309  28.2301     17.2643  15.3487    303.842     19.9544     123.842     
1 1 1 27 24 28 o 16 26.7806 7.8225  0.89884     18.676   25.2134     17.7386  4.66715    230.501     3.00769     230.501     
1 1 1 27 24 29 o 2  20.1829 6.55474 -17.767     16.8953  6.61456     15.1323  8.68177    352.975     0.693014    172.975     
1 1 1 27 24 30 o 18 28.1986 8.12178 14.3833     19.6216  23.7293     17.3195  15.8267    132.929     4.97016     312.929     
1 1 1 27 24 31 o 4  19.5432 6.58849 -25.7584    20.0844  -0.299391   17.2021  7.14463    152.383     1.95585     332.383     
1 1 1 27 24 32 o 12 24.876  7.82214 8.29984     21.0462  12.9425     18.4352  10.2012    209.16      10.7092     29.1602     
1 1 1 27 24 33 o 1  26.1614 7.68557 -14.8191    21.3808  31.7582     18.2614  11.3644    355.118     10.3263     175.118     
1 1 1 27 24 34 o 12 22.6158 7.36311 5.93091     20.3916  3.60746     18.0775  6.94733    41.2144     1.19965     41.2144     
1 1 1 27 24 35 o 18 24.7367 7.73903 -0.432343   20.9233  22.0531     18.8886  11.2432    178.907     1.76155     178.907     
1 1 1 27 24 36 o 4  26.2328 8.09018 17.0857     22.2257  19.6387     18.3137  13.2679    132.806     0.889709    312.806     
1 1 1 27 24 37 o 6  24.3916 7.6788  13.2043     19.2727  13.3425     18.5977  8.95333    346.661     0.832513    346.661     
1 1 1 27 24 38 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 24 39 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 24 40 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 25 0  o 2  66.0809 5.1713  85.3806     16.5901  85.3806     16.5901  51.0805    1.20044e-05 0.364502    1.20043e-05 
1 1 1 27 25 1  o 17 77.9835 4.57543 129.68      17.7866  111.348     17.5688  80.2863    192.344     43.2646     192.344     
1 1 1 27 25 2  f 0  90.7883 4.86218 172.487     21.8888  157.876     21.975   64.0263    292.972     0           0           
1 1 1 27 25 3  o 2  26.5621 7.14997 9.07897     13.8201  20.083      13.3123  13.8542    66.498      6.67085     246.498     
1 1 1 27 25 4  o 15 59.4049 6.14109 73.8355     16.9018  77.7281     18.5596  59.3269    157.133     31.2642     157.133     
1 1 1 27 25 5  o 8  22.7018 6.78812 9.92207     12.1534  2.60498     15.1132  11.0457    161.652     0.364211    161.652     
1 1 1 27 25 6  o 1  113.045 4.30041 264.896     22.2706  233.877     25.7235  104.315    38.5449     36.1142     38.5449     
1 1 1 27 25 7  o 9  28.9675 7.4287  19.9794     12.8606  18.7444     15.1258  11.9449    100.595     16.1603     280.595     
1 1 1 27 25 8  f 0  42.4124 7.0103  52.3713     13.7576  30.8643     16.4156  12.0139    252.251     0           0           
1 1 1 27 25 9  o 15 26.7949 7.34011 15.2244     12.9533  15.5503     15.2274  12.0148    262.814     11.8974     82.8141     
1 1 1 27 25 10 o 9  32.3707 8.74553 15.449      17.0716  40.441      22.8334  23.226     187.373     4.07312     187.373     
1 1 1 27 25 11 o 5  18.9142 6.08313 1.11403     10.9028  -7.06682    14.8946  6.6168     96.551      5.39483     276.551     
1 1 1 27 25 12 o 11 18.7742 6.0844  -2.33145    11.4863  -3.64805    14.3631  4.6798     350.77      0.311459    170.77      
1 1 1 27 25 13 f 0  25.7045 7.54075 7.69014     16.2346  15.968      15.9802  14.6092    330.644     0           0           
1 1 1 27 25 14 o 14 25.0726 7.42691 0.604686    16.2898  18.2013     16.2683  15.5553    96.6339     2.1078      96.6339     
1 1 1 27 25 15 o 8  25.9126 7.61222 18.6813     16.5268  4.54023     16.9029  12.995     329.541     8.19205     149.541     
1 1 1 27 25 16 o 17 61.2328 7.3437  78.9604     22.5944  93.471      20.3787  37.437     62.3889     16.9007     242.389     
1 1 1 27 25 17 o 7  43.8196 7.99168 59.8221     18.199   36.1599     18.1319  37.8485    325.575     13.2635     325.575     
1 1 1 27 25 18 o 3  27.2492 8.22857 16.4362     20.7867  13.0419     18.9418  16.3427    312.937     8.97914     312.937     
1 1 1 27 25 19 o 18 72.3741 7.21249 121.556     24.4883  119.347     26.2588  67.4965    237.852     27.1264     237.852     
1 1 1 27 25 20 o 8  24.1794 7.60978 11.3399     19.2806  1.60672     17.9715  13.7507    8.753       1.33389     188.753     
1 1 1 27 25 21 o 8  51.7593 8.78723 63.4877     22.3861  78.1973     22.7906  36.8486    80.1702     2.05362     260.17      
1 1 1 27 25 22 o 11 18.6573 6.33323 -13.9662    16.3322  -10.9457    17.8753  2.97014    186.851     0.28217     186.851     
1 1 1 27 25 23 o 19 44.4621 8.81897 71.8989     21.6604  39.3077     21.3826  41.6497    350.483     21.9848     350.483     
1 1 1 27 25 24 o 10 31.6038 9.13694 37.9951     23.7029  21.0498     22.8435  20.0102    17.9193     2.12213     197.919     
1 1 1 27 25 25 o 5  24.3905 7.97204 -2.16059    28.7398  9.08079     18.895   13.1614    272.733     2.53562     92.7332     
1 1 1 27 25 26 o 5  24.323  7.66913 10.0397     18.3512  8.69689     19.6124  11.5197    327.354     4.54095     327.354     
1 1 1 27 25 27 o 15 28.8385 8.28377 13.6587     19.4548  31.2877     19.1877  16.6287    112.522     3.88999     292.522     
1 1 1 27 25 28 o 4  21.9735 7.00813 -19.8807    18.1459  17.8699     17.5137  9.2975     266.377     0.260852    266.377     
1 1 1 27 25 29 o 5  20.0316 6.6896  -7.46687    17.4453  -0.196163   17.8191  6.38288    106.887     7.32923     286.887     
1 1 1 27 25 30 o 15 28.2729 8.37729 20.7237     20.4075  27.5313     19.7771  16.9839    19.1329     1.4725      19.1329     
1 1 1 27 25 31 o 3  22.6573 7.37217 8.40112     19.2839  4.25471     19.2812  7.84558    95.677      0.100703    95.6769     
1 1 1 27 25 32 o 15 18.431  6.30762 -15.5752    17.4869  -6.17658    18.2062  2.86241    37.3327     3.41454     217.333     
1 1 1 27 25 33 o 7  21.6839 7.13668 -3.70246    18.6368  10.032      19.2532  6.265      232.994     2.19202     52.9938     
1 1 1 27 25 34 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 25 35 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 25 36 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 26 0  f 0  14.4578 7.27947 -22.3968    23.0411  -22.3968    23.0411  5.48901    180         0           0           
1 1 1 27 26 1  o 8  30.5917 9.30467 9.10676     27.2656  35.2771     26.1106  14.8207    246.747     12.9676     66.747      
1 1 1 27 26 2  o 8  65.9316 8.52069 103.047     29.783   113.861     23.4317  58.939     151.802     18.926      151.802     
1 1 1 27 26 3  o 11 41.7364 8.78203 38.5142     20.186   55.7703     20.1002  34.0389    94.9152     8.33091     94.9152     
1 1 1 27 26 4  o 3  75.8638 6.49193 122.718     24.0968  131.395     24.2302  75.6831    45.6101     36.7078     45.6101     
1 1 1 27 26 5  o 10 28.9647 8.28887 17.5324     18.7306  22.5632     18.7069  21.321     227.2       6.45843     227.2       
1 1 1 27 26 6  o 14 88.0884 6.40565 162.414     28.1512  178.712     27.4306  78.0787    264.449     21.9246     264.449     
1 1 1 27 26 7  o 7  20.8895 6.81048 -5.04528    16.9465  0.394607    16.2846  10.4043    259.589     0.438253    79.5891     
1 1 1 27 26 8  o 1  34.6579 8.90694 30.3359     20.3657  37.1885     19.8825  20.7742    191.884     7.55106     11.8838     
1 1 1 27 26 9  o 8  28.5765 9.5093  4.28809     35.9073  19.2865     34.5201  16.9861    270.688     3.30335     90.6879     
1 1 1 27 26 10 o 9  27.156  7.78254 27.5392     17.454   -0.317943   18.5412  17.8437    239.709     9.67246     239.709     
1 1 1 27 26 11 o 1  31.5742 8.35148 13.1192     18.2803  38.8161     19.3108  22.2431    53.7488     1.75354     53.7488     
1 1 1 27 26 12 o 13 19.2494 6.5054  -13.6492    17.7074  -8.46833    17.6667  6.67925    354.757     0.385975    354.757     
1 1 1 27 26 13 o 4  19.3046 6.52027 -14.0777    17.5376  -7.25073    17.8765  7.95741    40.0047     1.24741     220.005     
1 1 1 27 26 14 o 5  40.3341 9.26686 37.2344     23.8824  60.1491     21.5914  33.6149    243.268     10.8812     243.268     
1 1 1 27 26 15 o 3  28.9892 8.16997 -2.21079    19.5112  38.9488     20.4093  21.6247    229.027     8.40674     229.027     
1 1 1 27 26 16 o 1  67.592  7.89844 123.873     26.515   104.206     25.0813  47.0202    225.329     7.6461      45.3293     
1 1 1 27 26 17 o 1  30.824  8.64879 26.4156     19.7953  28.3646     20.0361  19.4916    7.63898     2.67442     187.639     
1 1 1 27 26 18 o 2  19.674  6.58102 -3.21744    16.6326  -10.1027    17.9027  4.95526    205.952     14.3464     25.9517     
1 1 1 27 26 19 o 17 24.8131 7.8072  6.10482     20.391   15.0541     19.1     13.2923    190.435     5.17949     190.435     
1 1 1 27 26 20 o 8  29.2568 8.5209  22.5344     19.6596  27.3711     20.6614  20.6538    85.7162     7.7918      85.7162     
1 1 1 27 26 21 o 15 26.2932 7.99152 12.0121     19.1551  21.6314     19.1009  13.985     0.784337    5.12716     180.784     
1 1 1 27 26 22 o 2  24.7391 7.70872 19.1894     18.6785  5.27744     19.2077  13.3077    228.764     1.5239      48.7635     
1 1 1 27 26 23 o 10 30.4437 8.713   34.8441     20.5947  25.5562     21.0675  20.5342    246.754     10.0328     246.754     
1 1 1 27 26 24 o 8  21.4672 7.11591 2.15997     19.4961  0.10629     19.0599  4.39062    209.901     0.507444    209.901     
1 1 1 27 26 25 o 14 23.8494 7.64512 4.58244     19.7005  16.5441     20.0366  8.73236    79.5177     2.00002     79.5177     
1 1 1 27 26 26 o 10 23.6782 7.53163 -6.3585     19.9415  23.0508     19.4899  9.23827    31.3416     1.14335     31.3416     
1 1 1 27 26 27 o 9  34.4081 9.20735 48.1184     22.0266  39.4181     21.7186  24.818     37.4001     13.0647     37.4001     
1 1 1 27 26 28 o 8  23.4505 7.51985 16.5786     19.3955  4.63302     19.1151  9.26259    189.171     1.6689      9.17113     
1 1 1 27 26 29 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 26 30 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 26 31 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 27 0  o 9  34.0567 14.5888 45.1016     45.996   45.1016     45.996   20.3701    360         9.47404     360         
1 1 1 27 27 1  o 17 56.8192 13.8674 105.761     35.5638  105.761     35.5638  50.1851    30          12.367      30          
1 1 1 27 27 2  o 14 16.7028 8.32652 -13.87      27.6742  -13.87      27.6742  5.44982    240         6.99728     60          
1 1 1 27 27 3  f 0  46.4467 13.882  80.6135     32.6433  80.6135     32.6433  33.3102    270         0           0           
1 1 1 27 27 4  o 7  23.6397 10.8179 21.3405     30.1666  21.3405     30.1666  15.5704    120         1.35831     300         
1 1 1 27 27 5  o 3  23.0459 10.4466 19.5674     27.2781  19.5674     27.2781  14.0593    150         4.24809     330         
1 1 1 27 27 6  o 15 22.8696 11.0498 14.6966     39.6973  14.6966     39.6973  14.094     360         1.97764     360         
1 1 1 27 27 7  o 2  22.183  10.7071 12.0975     37.0673  12.0975     37.0673  0.484916   29.9994     0.190053    29.9994     
1 1 1 27 27 8  o 19 32.8784 16.1354 140.848     92.8661  140.848     92.8661  2.09321    59.9999     46.6123     240         
1 1 1 27 27 9  o 7  16.0554 7.7597  -2.49327    19.6079  -2.49327    19.6079  3.02623    90          2.89446     270         
1 1 1 27 27 10 o 17 18.5681 8.6863  6.50702     21.0914  6.50702     21.0914  6.82785    300         1.94662     120         
1 1 1 27 27 11 o 19 12.2932 6.23004 -20.5165    17.9913  -20.5165    17.9913  0.310519   330         5.44125     330         
1 1 1 27 27 12 o 17 17.6714 8.35705 3.9808      20.4378  3.9808      20.4378  5.81514    360         6.87245     180         
1 1 1 27 27 13 o 18 17.73   8.38554 4.27189     20.5862  4.27189     20.5862  0.965692   210         0.322349    30          
1 1 1 27 27 14 o 11 15.5796 7.54443 -2.54007    18.7358  -2.54007    18.7358  0.40512    240         20.4501     240         
1 1 1 27 27 15 o 8  30.6398 11.5078 40.2766     23.8361  40.2766     23.8361  26.1794    90          13.146      90          
1 1 1 27 27 16 o 18 21.2625 9.46047 16.7832     21.1863  16.7832     21.1863  9.28842    120         9.71079     300         
1 1 1 27 27 17 o 15 15.1405 7.44488 -6.36186    20.0249  -6.36186    20.0249  1.01033    330         19.4305     330         
1 1 1 27 27 18 o 7  57.3295 10.9034 91.6437     27.0679  91.6437     27.0679  54.2279    2.17564e-13 20.4529     2.17563e-13 
1 1 1 27 27 19 o 15 33.259  12.1094 49.0925     25.7929  49.0925     25.7929  29.3756    210         12.4231     210         
1 1 1 27 27 20 o 14 29.9223 11.3769 39.8299     23.5497  39.8299     23.5497  21.1135    240         1.34556     60          
1 1 1 27 27 21 o 17 35.4583 12.1909 53.0837     25.4131  53.0837     25.4131  32.1499    90          18.9121     90          
1 1 1 27 27 22 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 27 23 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 27 24 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 27 27 25 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 0  0  o 4  148.447 3.85545 392.216     28.5939  392.216     28.5939  103.104    360         8.37479     180         
1 1 1 28 0  1  o 7  48.0734 3.84503 42.5331     8.95824  42.5331     8.95824  72.7943    60          213.177     60          
1 1 1 28 0  2  o 6  22.8011 6.66566 12.9533     7.56105  12.9533     7.56105  43.0358    300         96.9991     300         
1 1 1 28 0  3  o 10 42.2892 4.2343  33.5721     8.4555   33.5721     8.4555   5.47881    180         24.6678     180         
1 1 1 28 0  4  o 2  48.1748 3.55452 42.48       8.34797  42.48       8.34797  11.3972    60          67.9512     60          
1 1 1 28 0  5  o 11 97.9298 2.69936 170.778     13.2018  170.778     13.2018  74.0682    120         15.3625     120         
1 1 1 28 0  6  o 19 60.9639 2.96992 66.823      8.97301  66.823      8.97301  2.14986    360         2.09712     180         
1 1 1 28 0  7  o 16 59.1196 3.01324 62.9247     8.8187   62.9247     8.8187   25.4472    60          132.897     60          
1 1 1 28 0  8  f 0  308.768 3.43688 1691.84     53.1514  1691.84     53.1514  192.784    300         0           0           
1 1 1 28 0  9  o 10 47.1762 3.42852 40.6986     7.89272  40.6986     7.89272  6.29181    8.7257e-06  44.1436     8.7257e-06  
1 1 1 28 0  10 o 14 58.3681 2.93068 61.3064     8.47124  61.3064     8.47124  6.52519    240         13.1392     60          
1 1 1 28 0  11 o 19 43.8792 3.59349 35.4938     7.62631  35.4938     7.62631  2.14367    300         11.6205     300         
1 1 1 28 0  12 o 16 236.721 2.96203 994.424     35.114   994.424     35.114   257.337    180         166.699     180         
1 1 1 28 0  13 o 19 91.5226 2.62148 149.216     11.9787  149.216     11.9787  48.5984    240         32.986      60          
1 1 1 28 0  14 o 6  299.799 3.38907 1595.07     50.8887  1595.07     50.8887  244.215    300         48.3573     300         
1 1 1 28 0  15 o 7  375.93  4.09602 2508.91     77.1254  2508.91     77.1254  244.066    1.45245e-06 63.2504     180         
1 1 1 28 0  16 o 15 309.131 3.60474 1696.22     55.8098  1696.22     55.8098  252.633    240         52.2471     240         
1 1 1 28 0  17 o 14 121.163 2.70143 261.03      16.3661  261.03      16.3661  55.1017    300         67.1075     120         
1 1 1 28 0  18 o 3  38.4787 4.05715 27.9548     7.31184  27.9548     7.31184  5.24773    6.87645e-06 18.5477     6.87645e-06 
1 1 1 28 0  19 o 2  140.901 2.51222 352.605     17.7136  352.605     17.7136  79.3685    240         47.1329     60          
1 1 1 28 0  20 f 0  355.652 3.77228 2245.21     67.2001  2245.21     67.2001  187.01     120         0           0           
1 1 1 28 0  21 o 2  16.2476 6.09236 6.75052     6.67163  6.75052     6.67163  31.0066    180         65.7903     180         
1 1 1 28 0  22 o 7  290.898 3.33571 1501.9      48.5995  1501.9      48.5995  208.626    240         6.37044     60.0001     
1 1 1 28 0  23 o 8  186.045 2.75837 614.47      25.692   614.47      25.692   209.754    300         149.625     300         
1 1 1 28 0  24 o 19 166.19  2.72768 490.462     22.6898  490.462     22.6898  55.352     360         130.697     180         
1 1 1 28 0  25 o 5  60.317  3.27195 65.6513     9.75292  65.6513     9.75292  3.39074    60          86.8981     60          
1 1 1 28 0  26 o 6  234.032 3.01213 972.207     35.3009  972.207     35.3009  152.114    120         34.7786     300         
1 1 1 28 0  27 o 15 151.681 2.77943 408.758     21.0953  408.758     21.0953  107.333    180         4.72278     8.68877e-06 
1 1 1 28 0  28 o 8  33.8377 5.81356 23.59       8.54234  23.59       8.54234  24.9285    60          74.742      60          
1 1 1 28 0  29 o 1  106.563 2.84292 202.228     15.133   202.228     15.133   92.5765    300         64.4779     300         
1 1 1 28 0  30 o 18 43.7978 4.18492 35.8618     8.71334  35.8618     8.71334  0.0787313  180         1.78298     6.22214e-06 
1 1 1 28 0  31 o 19 95.9449 2.77433 164.065     13.2887  164.065     13.2887  76.3793    60          17.6091     60          
1 1 1 28 0  32 o 13 206.917 2.69303 760.051     27.904   760.051     27.904   198.376    300         99.8907     300         
1 1 1 28 0  33 o 15 39.0855 5.16457 29.8135     9.08118  29.8135     9.08118  1.14455    180         30.5928     180         
1 1 1 28 0  34 o 3  42.8374 4.21465 34.423      8.54751  34.423      8.54751  4.79461    60          8.86278     240         
1 1 1 28 0  35 o 16 76.0997 2.94288 103.659     11.1459  103.659     11.1459  35.532     300         37.0103     120         
1 1 1 28 0  36 o 9  46.8514 3.96141 40.6244     8.94994  40.6244     8.94994  7.56557    180         43.0878     8.68824e-06 
1 1 1 28 0  37 o 11 12.7104 5.63006 1.56815     7.41367  1.56815     7.41367  47.7785    240         102.495     240         
1 1 1 28 0  38 o 6  26.4523 6.68922 16.4646     8.09579  16.4646     8.09579  10.5892    120         35.0577     120         
1 1 1 28 0  39 o 14 90.6278 2.75987 146.56      12.4816  146.56      12.4816  49.4564    180         29.3063     360         
1 1 1 28 0  40 o 14 234.49  2.83785 976.839     33.3263  976.839     33.3263  207.518    240         83.9307     240         
1 1 1 28 0  41 o 13 10.6304 5.00599 -2.21102    7.19975  -2.21102    7.19975  21.0747    120         44.749      120         
1 1 1 28 0  42 o 5  116.517 2.63159 241.718     15.3307  241.718     15.3307  74.9753    180         13.8302     360         
1 1 1 28 0  43 o 12 144.347 2.81372 370.856     20.319   370.856     20.319   147.498    60          92.5738     60          
1 1 1 28 0  44 o 17 45.783  4.07208 39.0438     8.94234  39.0438     8.94234  8.96511    120         1.92861     120         
1 1 1 28 0  45 o 16 94.7185 2.76653 160.188     13.0809  160.188     13.0809  66.218     2.35092e-06 0.263641    2.35092e-06 
1 1 1 28 0  46 o 11 44.595  4.17713 37.254      8.87896  37.254      8.87896  15.7437    240         24.259      60          
1 1 1 28 0  47 o 17 117.809 2.60087 247.279     15.3213  247.279     15.3213  102.326    120         41.0806     120         
1 1 1 28 0  48 o 18 14.3632 6.04492 4.05981     7.6253   4.05981     7.6253   5.57562    180         13.4203     180         
1 1 1 28 0  49 o 14 40.0458 4.86224 31.0598     8.89526  31.0598     8.89526  2.195      240         0.969455    240         
1 1 1 28 0  50 o 19 18.618  6.94052 9.12272     8.61769  9.12272     8.61769  2.80613    300         13.5732     300         
1 1 1 28 0  51 o 3  53.9747 4.13014 53.8501     10.8407  53.8501     10.8407  20.2071    360         33.7167     180         
1 1 1 28 0  52 o 13 12.7729 5.65921 1.73437     7.49571  1.73437     7.49571  0.922258   239.999     2.50578     239.999     
1 1 1 28 0  53 o 14 14.8602 6.25999 4.43487     8.19198  4.43487     8.19198  3.253      300         10.8326     300         
1 1 1 28 0  54 o 18 131.515 2.8538  309.03      18.7685  309.03      18.7685  92.5776    2.89723e-07 6.08604     2.89723e-07 
1 1 1 28 0  55 o 9  53.4731 4.00422 52.9154     10.4282  52.9154     10.4282  26.3742    60          19.8376     240         
1 1 1 28 0  56 o 3  30.575  6.71773 21.1709     9.01716  21.1709     9.01716  10.4167    300         18.8269     120         
1 1 1 28 0  57 o 13 11.3178 5.32134 -2.06519    8.08168  -2.06519    8.08168  2.68595    3.58109e-05 7.13917     3.58109e-05 
1 1 1 28 0  58 o 12 17.5647 6.73603 8.12013     8.32358  8.12013     8.32358  2.41941    240         18.4371     240         
1 1 1 28 0  59 f 0  170.05  2.81618 516.828     23.9695  516.828     23.9695  96.5399    300         0           0           
1 1 1 28 0  60 o 1  87.7969 3.79839 139.937     16.5676  139.937     16.5676  75.2931    360         33.2814     360         
1 1 1 28 0  61 o 6  81.0964 3.8418  119.779     15.4501  119.779     15.4501  79.1736    60          50.3567     60          
1 1 1 28 0  62 o 15 19.8727 7.26977 10.8725     9.32502  10.8725     9.32502  10.7374    300         47.2549     300         
1 1 1 28 0  63 o 5  13.2855 5.99816 1.23017     8.88241  1.23017     8.88241  0.915648   180         5.34872     180         
1 1 1 28 0  64 o 5  9.26045 4.61635 -9.42186    8.50517  -9.42186    8.50517  1.30532    240         3.54787     240         
1 1 1 28 0  65 o 11 15.0838 6.46646 4.51883     9.05171  4.51883     9.05171  0.344857   120         5.69991     300         
1 1 1 28 0  66 o 15 35.6214 6.5034  27.6053     10.0324  27.6053     10.0324  16.5393    360         13.4914     180         
1 1 1 28 0  67 o 3  51.335  4.61828 50.4121     11.3568  50.4121     11.3568  37.7508    60          8.57968     60          
1 1 1 28 0  68 o 11 77.429  4.02043 110.799     15.4029  110.799     15.4029  49.3538    120         1.85796     300         
1 1 1 28 0  69 o 1  9.77168 4.8808  -10.7317    9.66013  -10.7317    9.66013  9.45686    180         24.8213     180         
1 1 1 28 0  70 o 9  18.8126 7.88267 8.99315     12.8617  8.99315     12.8617  1.98065    240         5.25722     60          
1 1 1 28 0  71 o 13 14.2035 6.71788 -2.57607    13.2142  -2.57607    13.2142  9.06758    300         32.6142     300         
1 1 1 28 0  72 o 15 21.2967 8.46273 13.1088     13.6724  13.1088     13.6724  5.96993    180         11.2836     8.71284e-06 
1 1 1 28 0  73 o 4  24.123  8.9811  17.6776     14.4153  17.6776     14.4153  12.1414    240         1.17459     60          
1 1 1 28 0  74 o 15 20.986  7.91276 13.0237     11.3071  13.0237     11.3071  7.82727    300         2.98944     120         
1 1 1 28 0  75 o 18 45.6956 6.36582 43.6787     12.9674  43.6787     12.9674  35.2366    360         12.7732     360         
1 1 1 28 0  76 o 12 24.9535 8.48955 18.8548     12.2822  18.8548     12.2822  6.95311    60          16.0995     240         
1 1 1 28 0  77 o 10 14.6563 6.65036 2.64027     11.0903  2.64027     11.0903  0.426697   300         2.96575     300         
1 1 1 28 0  78 o 16 18.1416 7.67304 9.15668     12.4021  9.15668     12.4021  0.349922   1.39818e-06 2.90864     180         
1 1 1 28 0  79 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 1  0  o 11 186.694 2.76383 618.707     25.8329  618.707     25.8329  102.461    180         70.8893     360         
1 1 1 28 1  1  o 19 25.3542 5.01541 14.9494     6.79411  8.40358     6.72863  33.0789    181.396     77.0813     181.396     
1 1 1 28 1  2  o 1  447.76  4.48798 3530.44     100.703  3594.84     100.704  340.733    1.81579     24.3185     1.8158      
1 1 1 28 1  3  o 2  103.858 2.64772 188.631     13.4019  194.506     14.1138  73.208     254.05      35.0122     254.05      
1 1 1 28 1  4  o 4  57.7431 3.18983 56.2957     9.36958  62.8422     8.88552  3.73756    311.681     67.2845     311.681     
1 1 1 28 1  5  f 0  111.693 2.72275 217.389     15.2384  225.732     15.1917  114.713    46.0179     0           0           
1 1 1 28 1  6  o 16 156.817 2.86708 445.701     21.8838  427.193     23.1062  128.863    310.506     42.3018     310.506     
1 1 1 28 1  7  o 4  216.959 2.88753 836.65      29.9076  833.419     32.8098  142.798    79.1582     26.5252     259.158     
1 1 1 28 1  8  o 14 78.5434 2.64397 105.866     10.123   113.53      10.6334  20.1026    319.067     56.083      139.067     
1 1 1 28 1  9  o 10 122.769 2.51291 268.838     15.0816  266.218     15.7948  53.5102    201.415     62.0693     21.4149     
1 1 1 28 1  10 o 13 271.048 3.15935 1309.8      41.9544  1297.52     43.8442  279.713    197.437     172.653     197.437     
1 1 1 28 1  11 o 19 378.555 3.96369 2542.19     75.1917  2548.08     75.1983  304.158    69.2916     56.2841     69.2916     
1 1 1 28 1  12 o 16 152.877 2.54181 401.505     18.9993  427.72      19.9519  67.9598    322.315     79.9832     142.315     
1 1 1 28 1  13 o 17 178.884 2.61091 560.598     23.3658  574.576     23.4439  123.649    146.619     5.4108      326.619     
1 1 1 28 1  14 o 10 345.272 3.63709 2087.45     64.206   2145.96     61.5864  276.567    120.333     51.6373     120.333     
1 1 1 28 1  15 o 6  100.112 2.63654 178.869     13.4119  177.175     12.9956  39.2904    278.865     53.6088     98.8653     
1 1 1 28 1  16 o 9  134.481 2.70463 331.285     16.7446  311.017     19.469   81.6866    24.138      20.8695     204.138     
1 1 1 28 1  17 o 8  202.145 2.81437 737.584     28.4729  712.407     28.5404  97.0141    96.2037     95.4927     276.204     
1 1 1 28 1  18 o 10 104.229 2.53906 192.134     12.8942  193.701     13.5844  54.5845    103.342     26.6769     283.342     
1 1 1 28 1  19 o 16 173.389 2.67128 531.46      23.1821  535.156     23.2406  79.9234    84.8908     86.0668     264.891     
1 1 1 28 1  20 o 1  107.88  2.68776 207.872     14.2876  205.559     14.7226  69.2615    62.6675     0.189956    62.6662     
1 1 1 28 1  21 o 18 106.112 2.56883 206.095     13.2779  193.92      13.9627  71.9233    55.0533     10.5584     55.0533     
1 1 1 28 1  22 o 16 126.615 2.43402 270.938     15.0884  298.499     15.77    93.43      338.416     19.0793     338.416     
1 1 1 28 1  23 o 12 127.36  2.49818 291.962     15.5311  283.949     16.3047  81.9641    129.75      66.4475     129.75      
1 1 1 28 1  24 o 3  382.194 3.7405  2617.9      70.174   2571.98     73.0528  241.47     168.727     69.107      348.727     
1 1 1 28 1  25 o 8  212.137 2.72026 808.187     28.3159  788.843     29.4929  151.372    315.452     2.19956     315.452     
1 1 1 28 1  26 o 19 308.016 3.30492 1699.72     51.0084  1669.71     51.0177  233.618    293.821     25.8186     293.821     
1 1 1 28 1  27 o 11 121.853 2.54874 260.417     15.4955  266.943     15.5976  68.8282    76.2851     27.9286     256.285     
1 1 1 28 1  28 o 3  37.3306 4.79356 23.201      8.65112  28.0515     8.59268  13.27      299.606     52.587      299.606     
1 1 1 28 1  29 o 5  321.062 3.53384 1863.82     54.116   1800.02     59.3731  287.202    338.225     116.209     338.225     
1 1 1 28 1  30 o 3  125.485 2.67413 287.321     16.3358  272.283     17.2139  66.8488    319.628     39.2388     139.628     
1 1 1 28 1  31 o 14 74.0921 3.0424  106.371     10.7271  89.6487     11.6061  32.4799    238.917     28.2698     58.9173     
1 1 1 28 1  32 o 9  38.6864 4.64364 28.7703     8.08147  26.0552     9.19314  0.0379031  184.815     25.4636     184.815     
1 1 1 28 1  33 o 6  28.8806 5.68012 16.7631     8.64305  13.9539     8.42768  7.92762    62.3475     28.3012     62.3475     
1 1 1 28 1  34 o 7  51.4366 3.74054 45.186      9.15313  50.0364     9.86059  13.2158    16.5748     29.6075     196.575     
1 1 1 28 1  35 o 11 153.174 2.57605 409.488     18.7699  423.924     20.7582  123.891    320.041     36.1393     320.041     
1 1 1 28 1  36 o 6  49.0919 3.77527 44.8851     8.52316  41.9936     9.65436  1.0208     150.624     60.9627     150.623     
1 1 1 28 1  37 o 11 98.6412 2.69876 165.861     12.5701  180.613     14.0646  82.3513    316.125     38.009      316.125     
1 1 1 28 1  38 o 5  71.5744 3.10358 102.856     10.2076  80.7791     11.5956  29.9671    66.9191     32.4568     246.919     
1 1 1 28 1  39 o 19 116.478 2.58046 243.007     14.6124  239.731     15.4571  83.5441    161.856     9.21697     161.856     
1 1 1 28 1  40 o 12 169.243 2.55688 507.01      21.1765  511.375     22.1879  131.048    69.989      27.6738     69.989      
1 1 1 28 1  41 o 10 43.3961 4.06598 28.8419     8.25694  40.1127     8.88277  13.2856    239.93      12.8342     59.9297     
1 1 1 28 1  42 o 9  149.237 2.64266 409.294     20.1564  383.7       19.3583  107.422    36.3282     9.46576     36.3283     
1 1 1 28 1  43 o 17 102.074 2.84653 189.675     13.7764  182.106     15.2161  73.8582    215.033     11.6779     215.033     
1 1 1 28 1  44 o 8  164.739 2.65721 482.6       22.3923  483.936     21.4711  123.198    45.101      19.9011     45.101      
1 1 1 28 1  45 o 14 67.563  3.23257 84.6596     10.844   79.1606     10.9048  30.134     162.303     26.2425     342.303     
1 1 1 28 1  46 o 9  49.9943 3.91957 40.3024     9.62763  50.7203     9.54742  25.9788    209.622     6.78873     209.622     
1 1 1 28 1  47 o 2  63.9443 3.34516 73.826      10.6678  73.2476     10.6196  34.6088    310.824     12.4872     130.824     
1 1 1 28 1  48 o 19 68.0006 3.21023 79.5632     10.8509  86.6593     10.8888  49.8892    341.032     12.8423     341.032     
1 1 1 28 1  49 o 11 35.2001 5.19736 23.7408     8.55708  22.9238     9.18244  8.14944    17.0559     25.7845     197.056     
1 1 1 28 1  50 o 10 101.764 2.98506 187.943     15.2737  183.251     15.1064  71.688     150.078     5.9284      150.078     
1 1 1 28 1  51 o 9  120.89  2.84272 271.541     17.6802  252.075     16.7204  75.1975    203.354     13.7948     23.3542     
1 1 1 28 1  52 o 8  84.495  3.05369 128.627     12.8855  128.057     12.8897  50.5096    115.167     12.0354     295.167     
1 1 1 28 1  53 o 5  72.4287 3.35542 89.5614     12.0142  100.177     12.1883  57.3326    153.157     20.2385     153.157     
1 1 1 28 1  54 o 17 79.5031 3.19334 126.854     12.6353  101.93      12.5882  59.6504    211.338     14.5067     211.339     
1 1 1 28 1  55 o 7  49.2734 4.30028 37.75       10.4586  52.5963     9.91725  37.7892    309.492     16.3927     309.492     
1 1 1 28 1  56 o 14 46.3278 4.37731 38.0029     9.52669  41.7683     10.2955  25.9233    92.0991     6.07085     272.099     
1 1 1 28 1  57 o 7  59.9968 3.83595 63.8973     11.3841  67.9355     11.4256  39.9844    178.61      2.8256      178.61      
1 1 1 28 1  58 o 4  37.3028 5.78341 18.2789     11.3207  36.199      10.0157  23.1981    127.377     5.14402     127.377     
1 1 1 28 1  59 o 11 140.39  2.97233 359.984     21.8667  350.845     19.8832  103.323    131.803     19.7589     131.803     
1 1 1 28 1  60 o 6  70.6902 3.96251 96.5529     15.1276  87.3011     12.6998  55.0185    254.581     18.7336     254.581     
1 1 1 28 1  61 o 16 57.3166 4.22003 70.5532     12.4514  52.2274     11.3493  33.2389    244.458     7.3007      64.4577     
1 1 1 28 1  62 o 11 48.8938 5.05473 52.0798     11.9899  39.7106     11.8634  32.2686    88.1471     3.10081     88.1471     
1 1 1 28 1  63 o 14 42.1138 5.71465 34.4326     10.3692  35.5542     12.8151  29.0413    13.8964     7.05002     13.8964     
1 1 1 28 1  64 o 15 43.2384 5.29387 33.7528     11.4152  39.4205     10.5862  25.6414    90.5511     2.32061     270.551     
1 1 1 28 1  65 o 8  77.5127 3.59973 103.595     14.0186  118.872     13.7083  55.7537    70.7367     11.5927     70.7367     
1 1 1 28 1  66 o 16 29.8417 6.10323 13.3887     9.59329  23.1394     10.0968  15.4758    350.63      1.76603     170.63      
1 1 1 28 1  67 o 5  35.3489 6.56497 29.3769     11.9125  23.3055     11.7389  16.756     222.119     8.28529     42.1185     
1 1 1 28 1  68 o 7  78.8496 3.82565 112.262     14.9515  120.49      15.0878  62.8656    291.516     25.8533     291.516     
1 1 1 28 1  69 o 15 23.651  6.20283 17.4157     10.7757  -1.89118    11.0271  6.61299    183.125     8.44392     3.12511     
1 1 1 28 1  70 o 13 31.8059 7.00645 33.8526     13.7716  7.44686     13.8913  16.1391    222.577     1.65961     42.577      
1 1 1 28 1  71 o 11 15.9673 5.408   -7.76093    12.5515  -22.3327    12.4541  0.494652   243.692     4.90248     63.6925     
1 1 1 28 1  72 o 3  31.5857 7.70365 22.7089     14.3765  20.7706     15.2792  18.9118    63.8277     5.39125     63.8277     
1 1 1 28 1  73 o 19 24.8648 6.92581 17.6873     14.4921  3.53747     11.2871  10.8065    147.241     0.311244    327.241     
1 1 1 28 1  74 o 16 24.627  6.98901 8.67183     14.3688  11.4621     12.139   7.44489    312.094     10.7862     132.094     
1 1 1 28 1  75 o 5  33.9916 7.00973 13.6399     15.3736  37.453      12.9843  21.4137    341.379     9.34294     341.379     
1 1 1 28 1  76 o 6  41.6392 6.65243 33.2754     13.2766  45.0724     13.936   30.1646    121.84      18.9455     121.84      
1 1 1 28 1  77 o 18 31.593  6.79532 32.7447     12.3554  13.3501     13.0127  15.6724    166.778     3.60202     166.778     
1 1 1 28 1  78 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 2  0  o 10 243.041 2.67083 1047.92     32.5124  1047.92     32.5124  224.252    180         89.0674     180         
1 1 1 28 2  1  o 2  283.026 2.95793 1425.71     41.9425  1416.68     41.9652  212.467    193.528     13.0268     193.528     
1 1 1 28 2  2  o 3  231.515 2.6373  944.671     29.9794  956.723     31.2118  170.259    156.268     6.28001     156.268     
1 1 1 28 2  3  o 9  213.697 2.726   811.038     28.4496  809.064     29.917   126.197    318.663     56.2833     138.663     
1 1 1 28 2  4  o 5  46.0338 3.46872 42.873      8.07289  33.5032     7.6308   25.7177    335.028     97.1014     335.028     
1 1 1 28 2  5  o 4  216.849 2.88167 844.274     31.8545  824.266     30.7771  195.615    101.816     82.5723     101.816     
1 1 1 28 2  6  o 7  249.692 3.0473  1117.93     37.1097  1094.62     39.1022  205.139    156.899     49.9067     156.899     
1 1 1 28 2  7  o 5  101.581 2.53291 181.295     12.6802  185.189     13.0677  46.9817    2.97373     40.086      182.974     
1 1 1 28 2  8  o 13 375.481 3.77097 2503.41     70.8564  2503.8      71.0596  344.572    66.3352     141.282     66.3352     
1 1 1 28 2  9  o 6  94.5145 2.64505 157.977     11.8985  159.421     13.085   24.1922    337.963     77.5746     157.963     
1 1 1 28 2  10 o 14 186.397 2.60827 626.458     22.7685  606.158     25.8093  154.582    315.003     46.5281     315.003     
1 1 1 28 2  11 o 11 121.544 2.63214 270.482     15.2439  254.218     16.6927  57.043     329.91      52.8774     149.91      
1 1 1 28 2  12 o 4  370.755 3.79251 2434.08     68.8999  2448.43     72.0046  246.988    103.378     47.7691     283.378     
1 1 1 28 2  13 o 11 278.194 3.10381 1364.26     41.5047  1382.6      44.9898  228.158    321.747     54.2488     321.747     
1 1 1 28 2  14 o 14 117.511 2.53002 252.582     14.3265  237.836     15.376   62.5003    100.809     34.0294     280.809     
1 1 1 28 2  15 o 3  88.9888 2.67678 135.615     11.7751  145.944     12.0411  40.5439    149.151     29.8422     329.151     
1 1 1 28 2  16 o 8  209.067 2.94362 776.37      27.9698  774.788     33.4602  115.071    346.016     70.0598     166.016     
1 1 1 28 2  17 o 6  166.77  2.63529 486.623     22.5255  500.157     21.494   112.319    305.822     9.77112     125.822     
1 1 1 28 2  18 o 13 173.955 2.60787 534.681     22.743   538.913     22.7256  139.643    290.235     36.2659     290.235     
1 1 1 28 2  19 o 12 207.136 2.81279 750.99      28.6405  771.626     29.7561  118.93     175.902     58.6935     355.902     
1 1 1 28 2  20 o 6  41.0431 4.13987 34.6693     8.55735  26.6738     7.94453  5.16479    230.727     25.5944     230.727     
1 1 1 28 2  21 o 14 118.017 2.73274 259.951     15.6693  235.131     16.5252  60.8467    188.139     38.8886     8.13896     
1 1 1 28 2  22 o 8  228.36  2.88161 920.503     30.9312  930.397     34.9225  118.575    114.455     90.7299     294.455     
1 1 1 28 2  23 o 2  213.271 2.73656 819.585     27.5784  794.718     30.7752  150.082    256.799     3.51334     76.7993     
1 1 1 28 2  24 o 5  259.065 3.00454 1204.11     36.7192  1178.71     41.12    235.678    10.2952     102.21      10.2952     
1 1 1 28 2  25 o 16 366.813 3.55359 2391.64     62.8283  2389.45     67.7248  305.691    95.6725     82.6561     95.6725     
1 1 1 28 2  26 o 2  213.696 2.70453 815.762     27.8941  805.187     29.9802  175.788    49.8273     48.8127     49.8273     
1 1 1 28 2  27 o 7  169.048 2.60212 515.414     21.9024  498.985     22.1768  114.826    252.66      8.18711     72.6597     
1 1 1 28 2  28 o 19 134.568 2.75307 330.769     17.1227  312.825     19.7861  75.9912    90.7365     35.3633     270.737     
1 1 1 28 2  29 o 10 203.288 2.70222 733.157     27.5282  734.142     27.53    192.412    223.453     99.1721     223.453     
1 1 1 28 2  30 o 3  80.2499 2.82586 113.124     11.3338  116.175     11.3222  43.8025    103.614     16.1404     283.614     
1 1 1 28 2  31 o 13 167.306 2.69981 514.372     22.1447  480.004     23.0661  116.537    72.5167     2.27855     252.517     
1 1 1 28 2  32 o 16 91.202  2.72058 146.8       12.3532  149.187     12.4598  66.1281    166.38      14.1398     166.38      
1 1 1 28 2  33 o 8  124.09  2.7134  271.93      16.738   275.657     16.969   82.5179    134.385     5.90919     314.385     
1 1 1 28 2  34 o 17 49.0907 3.82388 39.8436     9.30142  47.2011     9.11774  16.2117    353.228     11.6354     173.228     
1 1 1 28 2  35 o 7  90.0101 2.86234 142.371     12.5425  146.25      13.2126  70.8821    134.361     27.1784     134.361     
1 1 1 28 2  36 o 19 123.784 2.56155 267.134     15.8111  277.87      15.9324  71.7713    306.723     27.4231     126.723     
1 1 1 28 2  37 o 9  128.644 2.73425 293.018     17.4837  295.969     17.731   114.007    218.781     53.8156     218.781     
1 1 1 28 2  38 o 8  57.3288 3.50137 63.3347     9.16776  54.8478     10.5422  11.3569    173.237     49.9956     353.237     
1 1 1 28 2  39 o 15 24.2506 5.59739 12.0392     7.23308  7.79935     8.7213   12.9714    358.975     41.299      358.975     
1 1 1 28 2  40 o 19 147.552 2.64081 396.32      18.5286  378.691     20.408   99.8671    199.246     4.69514     19.2464     
1 1 1 28 2  41 o 17 109.431 2.74701 214.286     14.5194  212.629     15.54    67.07      345.323     14.8509     165.323     
1 1 1 28 2  42 o 6  60.8717 3.54949 62.6647     9.87371  70.7795     11.5945  28.2723    312.965     19.3514     132.965     
1 1 1 28 2  43 o 7  52.7826 3.96597 46.0001     9.67069  55.1683     11.0034  18.0377    154.964     27.8338     334.964     
1 1 1 28 2  44 o 8  166.284 2.83772 501.761     23.5597  484.363     23.7259  109.675    247.6       10.2393     67.6        
1 1 1 28 2  45 o 7  83.7051 3.05396 123.707     12.3158  127.175     13.2134  40.7231    114.187     30.4219     294.187     
1 1 1 28 2  46 o 14 28.096  5.65934 17.5468     8.26696  11.7749     8.66883  0.28639    149.592     21.4113     329.591     
1 1 1 28 2  47 o 12 126.441 2.69576 280.949     16.5642  290.097     17.5581  105.002    263.772     37.6645     263.772     
1 1 1 28 2  48 o 1  44.2893 4.34878 34.615      9.03064  37.55       9.75754  18.6647    271.443     13.233      271.443     
1 1 1 28 2  49 f 0  122.799 2.71912 262.132     16.2451  277.324     17.1837  74.8846    327.782     0           0           
1 1 1 28 2  50 o 4  110.221 2.80519 203.641     15.3538  232.021     15.5463  74.3942    282.005     0.972611    102.005     
1 1 1 28 2  51 o 2  35.7391 5.00983 26.0732     8.46402  22.2344     8.82966  15.9122    131.884     9.61759     311.884     
1 1 1 28 2  52 o 4  128.429 2.94654 293.645     18.8322  298.723     19.0463  91.6272    264.391     8.98243     264.391     
1 1 1 28 2  53 o 19 79.9535 3.03064 114.615     12.0398  115.74      12.1579  66.8858    308.479     28.5227     308.479     
1 1 1 28 2  54 o 14 70.0178 3.46261 87.2234     11.9656  90.6918     12.1807  49.7739    17.0805     7.66874     17.0805     
1 1 1 28 2  55 o 6  31.6345 5.83228 17.5873     9.33366  21.2871     9.3926   7.23495    313.979     23.0194     133.979     
1 1 1 28 2  56 o 2  50.735  4.37678 48.5998     11.0394  46.9386     10.7573  33.9584    17.4488     4.05708     17.4488     
1 1 1 28 2  57 o 1  46.4407 4.63308 38.9232     10.4563  41.8848     10.4989  33.0479    315.421     9.49187     315.421     
1 1 1 28 2  58 o 4  36.7867 5.6025  30.1314     10.554   22.6504     9.53268  10.8056    151.756     23.9326     331.756     
1 1 1 28 2  59 o 11 59.4095 3.81148 63.1758     11.423   66.5861     10.9999  40.0381    264.843     3.46783     264.843     
1 1 1 28 2  60 o 13 21.3728 5.81615 10.2374     9.02715  1.07783     9.23178  5.88037    44.1882     36.3838     44.1882     
1 1 1 28 2  61 o 1  25.9924 6.38659 15.5589     10.5616  9.11181     10.0206  9.47053    72.6148     9.29998     252.615     
1 1 1 28 2  62 o 15 41.3684 5.7659  29.0359     12.3696  38.8541     10.5125  30.0512    256.073     10.4532     256.073     
1 1 1 28 2  63 o 13 19.4308 5.67675 4.37245     8.81492  2.21532     9.2039   3.83479    285.308     9.22468     105.308     
1 1 1 28 2  64 o 13 20.5527 5.87578 9.54391     9.44043  -3.28691    10.5787  5.59331    176.245     4.72827     356.245     
1 1 1 28 2  65 o 19 48.3967 5.29746 38.1491     11.1404  54.8485     13.7651  26.9736    279.379     6.88053     99.3792     
1 1 1 28 2  66 o 7  41.3574 6.03199 29.6476     11.8717  40.7018     12.3285  28.526     136.657     7.94028     136.657     
1 1 1 28 2  67 o 13 18.167  5.5574  -17.1241    9.97397  8.60306     10.8339  1.63313    42.4405     9.54107     222.441     
1 1 1 28 2  68 o 6  21.5934 6.30128 7.70974     10.5872  2.2413      11.8208  0.230618   276.999     21.7394     96.9993     
1 1 1 28 2  69 o 18 25.1969 6.9059  6.96398     13.4899  14.1287     11.9293  4.072      40.2079     0.944048    40.2079     
1 1 1 28 2  70 o 8  22.5302 6.74707 10.1228     13.249   -3.34823    14.0491  6.94121    59.848      2.87986     239.848     
1 1 1 28 2  71 o 11 42.3662 7.36466 36.1576     15.1405  43.0269     15.9514  26.2212    48.2102     1.89429     48.2102     
1 1 1 28 2  72 o 18 20.4495 6.30794 -0.908787   13.6465  3.43246     10.9408  3.43357    0.454259    0.359442    180.454     
1 1 1 28 2  73 o 15 26.7131 7.14236 12.1265     14.918   15.6965     11.7211  7.67864    58.4587     14.1925     238.459     
1 1 1 28 2  74 o 10 26.7772 6.61589 -2.12491    14.7179  24.6142     11.624   12.5984    189.686     1.89756     189.686     
1 1 1 28 2  75 o 9  40.9858 7.38764 45.9714     17.022   34.0216     13.4548  26.8829    251.26      8.21902     251.26      
1 1 1 28 2  76 o 6  44.1873 7.0421  68.1769     17.8807  27.1894     13.5665  29.5298    330.167     9.77758     330.167     
1 1 1 28 2  77 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 2  78 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 3  0  o 11 501.548 4.35769 4465.97     109.492  4465.97     109.492  428.839    2.98999e-06 115.087     2.99e-06    
1 1 1 28 3  1  o 16 143.268 2.38163 369.435     17.0968  358.639     17.0995  107.127    201.003     16.981      201.003     
1 1 1 28 3  2  o 9  313.412 3.28309 1749.12     51.554   1737.86     51.5766  228.935    204.223     0.459656    24.2218     
1 1 1 28 3  3  o 8  23.1628 5.07953 9.10791     6.81374  9.83028     6.22246  67.2592    24.2667     151.097     24.2667     
1 1 1 28 3  4  f 0  161.703 2.40987 468.783     19.1239  458.714     19.9151  166.968    307.459     0           0           
1 1 1 28 3  5  o 5  132.384 2.3501  305.165     15.5913  316.699     15.5738  67.215     272.681     50.1733     92.6814     
1 1 1 28 3  6  o 4  282.308 2.92937 1446.11     42.2163  1382.47     40.6758  245.713    37.3934     81.75       37.3934     
1 1 1 28 3  7  o 10 319.971 3.29682 1824.73     53.8282  1809.9      51.8908  242.64     170.906     17.9041     170.906     
1 1 1 28 3  8  o 9  596.47  5.22401 6339.61     162.005  6325.76     150.085  494.536    249.991     110.859     249.991     
1 1 1 28 3  9  o 17 99.2798 2.59274 169.427     12.6665  180.814     13.0886  61.8832    136.491     0.231672    316.49      
1 1 1 28 3  10 o 3  325.31  3.39451 1885.85     55.2144  1871.63     55.4627  236.371    267.399     2.26515     87.3992     
1 1 1 28 3  11 o 18 193.145 2.69267 671.671     25.8439  651.993     26.27    92.663     219.577     92.8867     39.5772     
1 1 1 28 3  12 o 18 209.391 2.76632 783.829     28.8651  771.933     29.1866  136.578    270.492     28.0482     90.4922     
1 1 1 28 3  13 o 17 158.569 2.52409 443.461     18.9818  448.554     21.0897  125.056    108.026     29.5771     108.026     
1 1 1 28 3  14 o 14 156.269 2.57542 443.555     18.7527  423.199     21.4063  83.0569    173.136     55.1313     353.136     
1 1 1 28 3  15 o 4  71.9774 3.11411 94.2536     9.851    90.3579     12.3047  29.416     152.203     3.57406     332.203     
1 1 1 28 3  16 o 9  341.514 3.46805 2099.9      56.9447  2042.39     61.5989  239.077    169.679     19.3807     349.679     
1 1 1 28 3  17 o 5  153.962 2.63649 429.119     19.3079  412.325     21.2643  100.639    217.15      14.6706     37.1503     
1 1 1 28 3  18 o 10 112.701 2.57745 235.223     14.1266  216.11      14.8865  71.1449    349.497     8.09954     169.497     
1 1 1 28 3  19 f 0  104.523 2.61631 199.318     13.1784  188.897     14.1363  69.9895    78.5854     0           0           
1 1 1 28 3  20 o 3  239.854 3.05724 1005.56     36.7786  1037.05     36.7102  179.508    64.1841     14.4259     64.1841     
1 1 1 28 3  21 o 6  191.978 2.83587 648.6       28.4399  659.639     26.0524  163.752    113.709     56.6948     113.709     
1 1 1 28 3  22 o 14 90.6687 2.77266 142.138     11.948   150.263     13.1856  50.7354    254.567     14.3849     74.5667     
1 1 1 28 3  23 f 0  134.929 2.61075 321.926     17.2942  324.701     17.9757  78.758     251.597     0           0           
1 1 1 28 3  24 o 7  250.768 3.14136 1129.55     37.675   1104.16     41.1587  210.847    229.515     62.3465     229.515     
1 1 1 28 3  25 o 19 79.5896 2.85001 111.563     11.1505  113.946     11.5103  33.6912    264.983     35.4774     84.9831     
1 1 1 28 3  26 o 11 67.8057 3.09919 88.2863     10.1669  75.9584     10.686   35.9876    321.71      10.0167     321.71      
1 1 1 28 3  27 o 14 218.669 2.92685 852.359     31.5259  846.07      32.6077  187.373    47.9032     63.3025     47.9032     
1 1 1 28 3  28 o 12 166.262 2.71929 484.539     21.5436  497.167     23.7427  121.838    285.401     8.79461     285.401     
1 1 1 28 3  29 o 16 50.8232 3.75856 49.4337     9.02991  43.5821     9.72908  16.9546    320.608     12.329      140.608     
1 1 1 28 3  30 o 12 95.6407 2.70959 167.468     11.9117  158.048     13.8667  68.4097    203.34      10.0988     203.34      
1 1 1 28 3  31 o 17 145.643 2.61584 378.116     19.194   375.868     18.96    133.004    320.869     65.3346     320.869     
1 1 1 28 3  32 o 1  84.7457 2.79823 126.591     11.196   129.216     12.4826  35.0978    203.473     43.9552     23.4726     
1 1 1 28 3  33 o 9  110.407 2.81757 207.642     15.6308  226.445     15.4667  80.3405    238.711     10.58       238.711     
1 1 1 28 3  34 o 8  125.996 2.56819 291.754     16.0697  273.001     16.306   76.217     302.597     22.5419     122.597     
1 1 1 28 3  35 o 5  95.1843 2.72948 162.916     12.9935  159.768     12.9912  42.0446    119.116     45.9703     299.116     
1 1 1 28 3  36 o 1  51.1926 3.72247 53.3302     9.32695  41.5121     9.35848  21.0029    114.523     14.0679     294.523     
1 1 1 28 3  37 o 13 74.7626 3.02429 102.655     11.231   97.0607     11.3263  43.37      99.278      10.4099     279.278     
1 1 1 28 3  38 o 19 83.2014 2.93475 126.93      11.8105  120.242     12.5458  44.0269    300.597     23.3176     120.597     
1 1 1 28 3  39 o 16 170.695 2.81927 505.207     24.8112  532.581     23.3477  142.638    116.991     47.6853     116.991     
1 1 1 28 3  40 o 5  107.893 2.92528 208.734     16.6463  206.762     14.8857  78.693     106.642     11.189      106.642     
1 1 1 28 3  41 o 5  20.5789 5.41775 0.56903     7.60647  9.8458      8.05076  9.23109    106.977     26.3801     106.977     
1 1 1 28 3  42 f 0  67.3881 3.337   75.2908     10.8101  88.045      11.5805  47.4348    22.4944     0           0           
1 1 1 28 3  43 o 10 103.634 2.90521 192.314     14.8083  191.489     15.3029  59.7766    31.7311     21.3727     211.731     
1 1 1 28 3  44 o 5  21.6432 5.50644 9.95712     7.1478   2.93733     8.78949  1.24047    179.425     5.03371     179.425     
1 1 1 28 3  45 o 6  77.6116 3.12712 97.9616     11.1911  118.619     13.0572  50.1151    34.5017     3.16938     214.502     
1 1 1 28 3  46 f 0  163.266 2.72809 458.349     21.0697  493.627     23.5714  106.717    132.601     0           0           
1 1 1 28 3  47 o 18 138.328 2.78257 316.951     17.5675  368.323     20.9942  116.271    65.7437     42.4204     65.7437     
1 1 1 28 3  48 o 5  92.767  2.99132 154.752     12.9382  154.036     14.7346  75.606     176.765     26.0548     176.765     
1 1 1 28 3  49 o 17 83.4053 3.11773 115.227     12.4877  135.411     13.4795  61.3518    33.8329     10.6559     33.8329     
1 1 1 28 3  50 o 19 42.1407 4.48813 31.8876     8.33533  34.1032     9.99757  9.75096    48.4195     34.664      228.419     
1 1 1 28 3  51 o 14 101.191 2.99819 203.691     13.4825  165.53      16.2843  61.5712    37.9534     14.1398     217.953     
1 1 1 28 3  52 o 2  62.235  3.78243 69.4827     10.8649  71.8305     12.4618  56.2267    119.489     34.5903     119.489     
1 1 1 28 3  53 o 7  59.0615 3.98205 71.8883     10.2354  56.4149     12.4354  29.2876    101.514     19.159      281.514     
1 1 1 28 3  54 o 18 70.892  3.44729 85.1306     11.935   97.6394     12.3919  63.4771    87.8603     35.3608     87.8603     
1 1 1 28 3  55 o 12 81.7773 3.16866 124.673     13.17    117.312     12.7033  47.5289    140.713     14.0672     320.713     
1 1 1 28 3  56 o 18 22.8624 5.59356 12.8011     7.80112  3.87035     8.65205  4.51243    332.174     10.8182     152.174     
1 1 1 28 3  57 o 6  40.3392 4.91616 26.861      9.16253  35.2784     9.97834  14.811     19.5002     21.272      199.5       
1 1 1 28 3  58 o 13 59.3435 3.76529 55.5156     10.5856  74.5938     11.4881  50.6264    311.661     25.8922     311.661     
1 1 1 28 3  59 o 5  77.6654 3.49123 113.698     13.3144  106.835     13.6939  51.8711    57.4015     1.29918     57.4016     
1 1 1 28 3  60 o 9  31.2761 6.00654 22.933      9.38345  15.9334     10.2253  19.6343    116.231     7.01194     116.231     
1 1 1 28 3  61 o 15 55.588  4.31201 62.4558     11.1623  53.8204     12.2529  32.0511    184.575     7.79586     4.57457     
1 1 1 28 3  62 o 17 91.8471 3.68205 180.849     16.1733  132.53      17.0652  70.5081    311.215     20.4782     311.215     
1 1 1 28 3  63 o 9  28.1333 6.4068  18.2702     10.5461  13.5888     10.0792  14.0779    286.35      2.32971     106.35      
1 1 1 28 3  64 o 19 19.2688 5.67664 8.12116     9.76869  -4.66128    9.35435  3.88       272.82      4.18467     92.8195     
1 1 1 28 3  65 o 5  22.8516 6.1221  13.1055     9.65204  2.2205      10.6618  7.44382    345.472     0.579689    165.472     
1 1 1 28 3  66 o 13 39.4984 5.95474 28.8165     11.6595  35.3372     11.206   14.824     56.4989     18.9898     236.499     
1 1 1 28 3  67 o 6  39.1839 6.33292 29.0448     11.9849  35.4925     12.3819  25.1807    135.374     5.14828     135.374     
1 1 1 28 3  68 o 1  26.3835 6.92489 8.83649     13.2935  16.7664     11.7364  9.84135    119.859     6.51385     299.859     
1 1 1 28 3  69 o 9  42.2245 6.60392 24.5288     14.7602  52.1609     13.1987  26.9663    287.531     3.63188     287.531     
1 1 1 28 3  70 o 15 17.7694 5.7289  -9.3169     13.2125  -0.76406    9.82939  2.84789    169.626     7.27353     349.626     
1 1 1 28 3  71 o 4  51.6507 6.12894 48.5765     16.142   62.0847     13.8848  25.5192    207.349     13.2359     27.349      
1 1 1 28 3  72 o 1  23.3309 6.79682 14.6229     14.549   0.803128    11.4373  6.51467    104.641     11.086      284.641     
1 1 1 28 3  73 o 12 27.1481 7.42232 16.8976     15.4937  13.8551     13.1942  12.2533    245.365     2.17275     65.3645     
1 1 1 28 3  74 o 17 24.5171 6.90775 3.23565     15.5548  15.8224     11.7469  8.33436    171.489     4.54569     351.489     
1 1 1 28 3  75 o 12 22.7199 6.83587 16.7769     15.9364  -1.77031    11.5679  5.14468    315.495     5.23177     135.495     
1 1 1 28 3  76 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 3  77 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 4  0  o 8  241.213 2.78896 1032.43     33.6932  1032.43     33.6932  221.247    180         84.9234     180         
1 1 1 28 4  1  o 12 141.004 2.45372 349.089     17.6304  356.445     17.019   87.8138    356.701     21.7936     176.701     
1 1 1 28 4  2  o 18 257.682 2.91589 1167.25     36.9263  1189.27     38.3796  232.395    62.8287     91.7194     62.8287     
1 1 1 28 4  3  o 18 45.0079 3.43853 38.9165     7.77265  33.9362     7.47977  15.6025    220.052     70.9402     220.052     
1 1 1 28 4  4  o 4  139.184 2.37952 340.043     16.8574  347.137     16.3263  94.7328    120.268     3.92925     300.268     
1 1 1 28 4  5  o 7  91.8431 2.45694 149.299     11.2732  150.357     11.3028  50.6152    229.475     27.2488     229.475     
1 1 1 28 4  6  o 14 303.835 3.09669 1631.12     47.1319  1645.78     47.1706  260.008    337.221     76.741      337.221     
1 1 1 28 4  7  o 5  284.294 3.03167 1435.16     43.9968  1433.6      42.3741  177.909    70.3079     59.9401     250.308     
1 1 1 28 4  8  o 4  373.228 3.58635 2465.96     65.7983  2481.69     68.3431  332.753    32.1182     118.855     32.1182     
1 1 1 28 4  9  o 13 70.684  2.70568 91.7407     9.68809  86.103      9.40843  28.0289    108.069     15.0795     288.069     
1 1 1 28 4  10 o 15 40.8749 3.87227 34.8473     7.64688  25.9117     7.65808  23.0089    192.387     82.3185     192.387     
1 1 1 28 4  11 o 10 284.412 3.05095 1436.09     45.0449  1435.31     41.8685  188.484    351.871     38.061      171.871     
1 1 1 28 4  12 o 9  204.634 2.59767 752.578     27.5485  733.268     25.7189  163.652    94.6169     34.1799     94.6169     
1 1 1 28 4  13 o 12 86.3969 2.69242 139.737     11.6019  125.836     11.6294  30.273     120.733     52.1364     300.733     
1 1 1 28 4  14 o 4  226.436 2.99394 926.405     35.3896  893.844     32.5417  174.553    329.21      22.72       329.21      
1 1 1 28 4  15 o 18 55.6602 3.48025 49.6185     8.86621  61.6072     10.3686  9.16438    284.997     27.8134     104.997     
1 1 1 28 4  16 o 10 264.577 3.08682 1256.07     40.7469  1229.4      41.1017  207.228    340.613     31.2391     340.613     
1 1 1 28 4  17 o 18 162.691 2.66831 489.088     20.482   450.922     22.821   101.111    345.754     28.7007     165.754     
1 1 1 28 4  18 o 16 162.311 2.70467 487.684     19.7614  448.084     23.8215  135.401    184.576     43.7706     184.576     
1 1 1 28 4  19 o 11 43.7933 4.07364 36.7384     8.11551  32.6974     9.18528  0.97046    33.2383     27.425      33.2383     
1 1 1 28 4  20 o 2  182.639 2.67308 607.096     23.2462  577.099     25.5603  140.308    287.291     20.7772     287.291     
1 1 1 28 4  21 o 16 339.737 3.57472 2109.33     62.1427  1994.31     59.5901  206.955    329.576     80.5087     149.576     
1 1 1 28 4  22 o 12 116.932 2.69438 249.376     14.9972  236.641     16.4568  88.4178    75.8379     18.2092     75.8379     
1 1 1 28 4  23 o 9  189.83  2.70685 647.304     24.5122  632.183     26.9023  137.391    339.583     3.3922      339.583     
1 1 1 28 4  24 o 19 110.518 2.64364 210.038     13.7003  224.23      15.5315  77.9258    225.007     5.0151      225.007     
1 1 1 28 4  25 o 6  89.3204 2.70959 149.767     11.7921  134.276     12.3434  51.281     172.959     17.2377     352.959     
1 1 1 28 4  26 o 9  141.993 2.62265 363.227     18.6343  353.25      18.6555  83.0046    53.6939     34.9059     233.694     
1 1 1 28 4  27 o 11 78.2704 2.92506 109.901     11.1439  108.396     11.7096  32.396     130.364     39.531      310.364     
1 1 1 28 4  28 o 1  189.477 2.86971 632.093     26.4163  643.766     28.0702  113.998    75.7438     42.8304     255.744     
1 1 1 28 4  29 f 0  89.2318 2.83532 140.984     11.8752  142.571     13.3797  91.0342    316.429     0           0           
1 1 1 28 4  30 o 6  52.0823 3.67306 46.3928     9.39813  51.2366     9.5047   1.77875    87.379      69.332      87.379      
1 1 1 28 4  31 o 16 111.314 2.6859  207.167     14.4226  234.134     15.5041  69.1978    29.3917     15.3548     209.392     
1 1 1 28 4  32 o 4  114.764 2.62713 229.99      14.5385  238.664     15.6368  98.9773    120.477     42.7103     120.477     
1 1 1 28 4  33 o 9  93.6398 2.80156 151.293     12.2097  161.195     14.009   61.0124    112.441     4.28377     292.441     
1 1 1 28 4  34 o 7  197.052 2.73701 671.393     27.0591  710         26.9791  153.034    167.482     27.1951     167.482     
1 1 1 28 4  35 o 19 177.523 2.62297 540.93      22.8948  580.307     23.7764  124.565    302.618     1.41295     122.619     
1 1 1 28 4  36 o 10 94.3999 2.90355 158.07      13.9482  159.848     13.4503  75.1091    67.6129     24.6512     67.6129     
1 1 1 28 4  37 o 8  61.1707 3.58631 65.0351     11.3227  69.5554     10.3993  29.3233    29.29       18.6233     209.29      
1 1 1 28 4  38 o 18 117.019 2.88122 232.311     17.4631  256.524     16.1527  83.4385    355.475     5.96939     355.475     
1 1 1 28 4  39 o 18 148.191 2.8352  387.815     20.4497  395.495     21.616   114.184    232.895     22.4998     232.895     
1 1 1 28 4  40 o 7  78.8529 3.26011 109.545     12.437   113.353     13.2147  61.8836    205.147     23.8766     205.147     
1 1 1 28 4  41 o 1  41.3152 4.91464 28.0555     9.94403  35.3845     9.56799  7.11646    254.754     31.9969     74.7537     
1 1 1 28 4  42 o 19 74.0595 3.19198 93.1079     11.7458  103.812     11.8105  64.5935    202.974     43.1511     202.974     
1 1 1 28 4  43 o 16 34.6    5.17864 26.8166     8.30709  18.3462     9.10353  8.80096    20.735      2.56368     200.735     
1 1 1 28 4  44 o 9  35.7912 5.11034 21.9389     8.17558  26.2881     9.54081  15.2397    125.609     0.55571     125.609     
1 1 1 28 4  45 o 4  236.637 3.11641 1007.14     37.7693  997.511     36.1336  183.064    207.24      35.737      207.24      
1 1 1 28 4  46 o 15 99.4227 2.78458 189.442     13.7577  164.907     13.8748  79.1143    292.513     22.5137     292.513     
1 1 1 28 4  47 o 13 132.717 2.63503 306.245     17.2966  323.888     17.7188  96.598     201.624     10.1757     201.624     
1 1 1 28 4  48 o 14 105.259 2.84196 204.765     13.7076  192.704     16.0382  77.5141    329.713     11.2324     329.713     
1 1 1 28 4  49 o 13 21.3569 5.70518 6.29958     7.67743  6.63212     9.02717  5.80172    17.7465     33.7132     17.7465     
1 1 1 28 4  50 o 17 47.7978 4.29244 33.2378     9.49057  52.2696     10.3224  23.9761    260.777     13.6666     80.7768     
1 1 1 28 4  51 o 10 48.7071 4.57277 46.4305     11.0968  41.8876     10.6696  18.4274    229.321     26.7442     49.3212     
1 1 1 28 4  52 o 15 83.9449 3.10003 128.204     13.2255  126.237     12.7654  49.8451    112.215     13.4618     292.215     
1 1 1 28 4  53 o 9  148.067 3.15775 410.467     21.7899  381.092     24.7736  97.3496    248.631     7.04738     68.6308     
1 1 1 28 4  54 o 14 70.1554 3.58368 95.879      11.4431  83.6611     13.3088  53.1675    278.794     13.9373     278.794     
1 1 1 28 4  55 o 7  35.6527 5.66686 21.641      8.68851  28.0672     11.0998  14.6603    283.614     14.1037     103.614     
1 1 1 28 4  56 o 7  27.5613 6.09413 11.2716     8.01732  18.2114     10.7345  8.6869     165.709     13.2899     345.709     
1 1 1 28 4  57 o 1  25.6503 6.16657 10.6931     8.15771  13.6207     10.7899  9.97256    230.971     0.509976    230.971     
1 1 1 28 4  58 o 14 125.436 2.95491 284.444     16.3104  285.101     20.5286  92.3458    71.1469     16.53       71.1469     
1 1 1 28 4  59 o 10 20.4604 5.79154 7.92912     8.1764   -0.78352    10.771   5.21111    258.705     3.76649     78.7055     
1 1 1 28 4  60 f 0  16.506  5.19912 -0.633869   7.55098  -3.79374    9.90292  6.69435    153.473     0           0           
1 1 1 28 4  61 o 7  50.2038 4.33645 46.4482     9.98074  49.0595     11.3637  37.6049    187.352     11.5552     187.352     
1 1 1 28 4  62 o 6  118.348 2.93035 264.072     16.2439  246.609     18.3     85.0486    155.298     13.5346     155.298     
1 1 1 28 4  63 o 6  37.9528 5.57324 25.8536     9.99116  32.3279     10.5323  18.3726    356.653     10.1642     176.653     
1 1 1 28 4  64 o 16 30.8148 6.45498 14.0689     12.1969  24.7595     10.165   18.6411    4.4273      6.81713     4.4273      
1 1 1 28 4  65 o 19 18.924  5.77991 3.17588     10.5987  -0.631768   9.44646  2.84055    291.097     25.2014     291.097     
1 1 1 28 4  66 o 5  53.622  5.17127 61.9862     13.1167  51.7273     13.7342  36.6704    327.494     6.52285     327.494     
1 1 1 28 4  67 o 1  54.138  5.4735  63.2699     15.061   54.1758     13.7994  33.9547    86.3176     0.228331    86.3177     
1 1 1 28 4  68 o 18 29.2336 7.05394 9.95385     13.608   24.3728     12.5708  14.9234    193.239     0.792863    13.2389     
1 1 1 28 4  69 f 0  18.2114 5.82611 -5.24142    13.3981  -0.964786   9.47679  4.55224    1.39523     0           0           
1 1 1 28 4  70 o 11 21.7265 6.62075 6.67281     14.8882  1.19903     11.0956  2.6314     255.929     0.436649    255.929     
1 1 1 28 4  71 o 10 23.0776 7.01923 10.1615     15.0947  -0.765386   14.6345  0.842636   74.6192     24.1029     254.619     
1 1 1 28 4  72 o 18 26.7233 7.75815 11.0896     18.9118  14.9342     14.8523  10.4961    288.629     6.57755     108.629     
1 1 1 28 4  73 o 19 26.5472 7.60954 21.7325     16.8858  6.2797      15.268   7.8294     49.6098     12.0071     229.61      
1 1 1 28 4  74 o 12 26.0537 7.61973 14.6114     16.6618  13.1462     15.7508  8.18494    49.689      0.194931    229.689     
1 1 1 28 4  75 o 3  25.6619 7.65366 13.5625     17.9667  12.6906     15.7354  6.35777    124.054     1.36861     304.054     
1 1 1 28 4  76 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 5  0  o 7  110.159 2.4324  215.757     13.3984  215.757     13.3984  19.2011    0.000476926 15.2021     0.000476926 
1 1 1 28 5  1  o 12 161.506 2.50097 467.971     19.8454  457.491     20.6208  134.392    75.9574     41.8019     75.9574     
1 1 1 28 5  2  o 8  113.338 2.41404 218.295     13.9373  238.039     13.4061  57.2005    174.543     41.7843     354.543     
1 1 1 28 5  3  o 10 71.4776 2.67353 87.9533     9.5277   93.8946     9.55029  29.8855    342.774     1.14817     342.774     
1 1 1 28 5  4  o 17 136.299 2.40388 330.912     16.203   328.346     16.6181  121.706    0.502038    61.0487     0.502038    
1 1 1 28 5  5  o 1  166.983 2.42517 491.692     20.2823  497.519     20.3058  85.4949    201.572     69.261      21.5724     
1 1 1 28 5  6  f 0  238.591 2.71944 1010        32.5062  1010.15     32.5252  158.831    178.557     0           0           
1 1 1 28 5  7  o 5  44.8844 3.48235 31.8178     7.67197  40.89       7.61292  15.5999    8.56234     74.6021     8.56234     
1 1 1 28 5  8  o 6  25.8309 5.0269  17.0535     7.01518  7.07003     7.02476  53.1878    201.015     126.65      201.015     
1 1 1 28 5  9  o 14 82.7196 2.54091 128.21      10.4682  115.209     10.5216  45.6599    14.5569     19.3737     14.5569     
1 1 1 28 5  10 o 14 155.465 2.45199 434.824     19.4483  422.743     18.7592  125.623    142.282     33.2471     142.282     
1 1 1 28 5  11 o 8  201.085 2.56958 736.934     25.8676  698.169     25.9054  124.912    201.788     41.0868     21.7877     
1 1 1 28 5  12 o 7  118.051 2.43451 251.378     14.3451  243.533     14.4251  89.5925    200.605     20.8778     200.605     
1 1 1 28 5  13 o 17 257.297 2.89546 1179.27     36.6047  1170.94     38.0451  181.241    2.55462     12.2878     182.555     
1 1 1 28 5  14 o 2  118.792 2.47389 244.43      15.2775  256.816     14.0837  64.5887    167.381     35.9733     347.381     
1 1 1 28 5  15 o 17 22.0955 5.15253 3.19279     6.98996  12.2509     7.01318  4.29162    238.64      10.1919     238.64      
1 1 1 28 5  16 o 7  221.663 2.83486 875.918     32.6534  868.549     30.2936  132.833    209.607     56.0768     29.607      
1 1 1 28 5  17 o 8  146.612 2.6061  374.316     19.7055  388.984     18.525   116.312    246.925     26.9399     246.925     
1 1 1 28 5  18 o 19 124.184 2.57538 273.043     16.1113  274.838     15.9077  58.8292    329.965     57.5748     149.965     
1 1 1 28 5  19 o 18 265.908 3.22859 1273.36     42.794   1239.24     43.2396  198.045    212.631     9.64361     212.631     
1 1 1 28 5  20 o 18 52.0859 3.75053 56.1496     8.70139  41.8817     10.1101  13.4528    144.898     26.14       324.898     
1 1 1 28 5  21 o 2  49.8064 4.17979 56.862      9.37145  34.1734     10.2036  13.9642    92.698      12.1482     272.698     
1 1 1 28 5  22 o 5  232.182 2.99953 989.45      33.8349  926.427     35.8434  196.645    224.154     58.1526     224.154     
1 1 1 28 5  23 o 2  76.8909 3.1688  117.272     10.6052  94.2214     13.158   28.7507    95.2981     45.6599     275.298     
1 1 1 28 5  24 o 14 184.318 2.79414 603.78      22.5807  603.165     28.6707  138.548    1.2531      13.029      1.2531      
1 1 1 28 5  25 o 9  282.707 3.13908 1437.33     42.3079  1404.6      46.4863  227.522    156.905     46.1092     156.905     
1 1 1 28 5  26 o 10 128.08  2.66226 283.926     16.8331  299.493     17.3061  111.155    178.69      45.3115     178.69      
1 1 1 28 5  27 o 5  67.1975 3.13929 80.2169     9.92295  81.0949     11.0743  44.0059    132.572     12.6104     132.572     
1 1 1 28 5  28 o 8  157.324 2.6229  442.716     20.2275  436.801     21.1147  86.8226    85.135      50.5904     265.135     
1 1 1 28 5  29 o 9  79.669  2.96314 98.6618     11.5766  128.715     11.8765  54.4187    320.74      5.63277     320.74      
1 1 1 28 5  30 o 17 109.881 2.62554 226.705     14.202   203.287     14.6131  94.7206    285.136     40.7819     285.136     
1 1 1 28 5  31 o 6  158.382 2.57279 447.775     19.9916  443.979     20.837   123.577    255.768     23.5048     255.768     
1 1 1 28 5  32 o 2  138.898 2.57631 345.648     17.1773  340.61      18.6285  105.745    300.579     16.7779     300.579     
1 1 1 28 5  33 o 18 125.616 2.80903 274.819     16.6662  287.408     18.6376  79.1288    130.854     17.6545     310.854     
1 1 1 28 5  34 o 11 22.8328 5.66115 10.547      8.14022  5.89631     8.06297  6.091      81.6236     19.9278     81.6236     
1 1 1 28 5  35 o 6  86.6221 3.03552 136.804     12.4838  131.313     13.7262  69.3381    23.662      24.9385     23.662      
1 1 1 28 5  36 o 19 21.2125 5.65003 7.16652     7.8726   4.73655     8.57047  31.7733    117.708     83.2503     117.708     
1 1 1 28 5  37 f 0  93.0771 3.00549 145.471     13.5277  164.475     14.4377  48.9017    359.999     0           0           
1 1 1 28 5  38 o 11 177.931 3.03723 551.97      26.5413  578.113     27.6271  131.518    17.8862     12.8852     17.8862     
1 1 1 28 5  39 o 19 70.5671 3.47617 79.1118     12.1249  100.57      12.1672  48.5451    30.6354     7.42622     30.6354     
1 1 1 28 5  40 o 19 18.2914 5.33138 -2.26462    8.44866  4.74977     7.81647  19.5966    223.993     51.9701     223.993     
1 1 1 28 5  41 o 12 25.9484 5.70534 14.7065     8.42113  9.72543     8.14203  1.98572    23.8227     22.8106     23.8226     
1 1 1 28 5  42 o 14 26.6502 5.71122 12.0751     8.44281  14.0943     8.1702   2.35185    114.975     5.9203      294.975     
1 1 1 28 5  43 o 11 76.5633 3.14284 96.245      12.2097  114.699     11.6723  51.105     339.083     1.96075     159.083     
1 1 1 28 5  44 o 1  71.1628 3.33935 87.4726     11.7895  95.0793     11.8806  61.4262    34.8985     28.659      34.8985     
1 1 1 28 5  45 o 1  158.835 2.80491 428.431     22.3733  475.023     22.2042  123.691    358.691     26.3186     358.691     
1 1 1 28 5  46 o 10 104.215 2.91425 170.121     14.3594  221.277     15.9929  66.9455    157.586     9.71191     337.586     
1 1 1 28 5  47 o 4  29.3869 6.03892 14.652      8.73193  18.38       10.1282  0.203924   240.181     35.8869     240.181     
1 1 1 28 5  48 f 0  85.2138 3.32679 125.129     14.1249  137.365     14.1547  67.4274    135.783     0           0           
1 1 1 28 5  49 o 4  71.9034 3.39531 102.664     12.0414  85.1034     12.1826  53.1436    18.3736     10.1311     18.3736     
1 1 1 28 5  50 o 5  27.3248 5.68394 20.2403     8.62118  7.15071     9.11541  6.94794    29.0794     15.7623     209.079     
1 1 1 28 5  51 o 9  32.6497 5.58744 12.7537     9.31516  28.8984     9.42998  8.94567    196.519     21.831      16.5187     
1 1 1 28 5  52 o 1  45.5962 4.53068 42.516      9.02499  35.3227     10.7324  27.7885    348.601     2.23239     168.601     
1 1 1 28 5  53 o 7  64.5663 3.60183 68.4352     10.684   84.1686     12.4588  34.4992    70.2339     17.0266     250.234     
1 1 1 28 5  54 o 11 28.1007 5.832   9.9131      8.68642  20.5085     9.3467   12.331     334.188     1.1386      334.188     
1 1 1 28 5  55 o 9  37.6545 5.1978  24.3016     8.87626  30.4802     10.0568  17.7455    61.9244     11.4718     241.924     
1 1 1 28 5  56 o 9  27.0278 5.948   12.8868     8.24981  15.341      9.58168  11.904     106.998     3.41999     106.998     
1 1 1 28 5  57 o 2  58.5815 3.75286 67.2322     10.2468  59.538      11.3877  39.3014    162.376     1.723       162.376     
1 1 1 28 5  58 o 9  84.5127 3.10738 123.416     12.6525  136.926     13.5837  80.9762    255.492     50.6836     255.492     
1 1 1 28 5  59 o 10 76.2556 3.63195 91.0209     12.6749  125.03      14.9232  57.065     14.4776     13.3803     14.4776     
1 1 1 28 5  60 o 8  68.3391 3.48679 84.4712     11.2949  88.0368     12.4172  39.5514    337.329     11.0185     157.329     
1 1 1 28 5  61 o 3  36.2465 5.92837 27.8789     9.29654  25.6082     11.8626  27.2572    50.0592     16.7309     50.0592     
1 1 1 28 5  62 o 17 51.5359 4.8514  44.9379     10.2682  58.7197     14.1871  31.1549    276.616     3.7425      96.6164     
1 1 1 28 5  63 o 17 25.3077 6.26172 8.08272     8.99368  16.8694     10.8424  9.78096    234.329     6.99991     54.3287     
1 1 1 28 5  64 o 13 18.2019 5.71469 0.374149    9.39545  -2.91647    11.5395  1.83419    141.004     4.15046     321.004     
1 1 1 28 5  65 o 12 27.4566 6.85102 16.3677     11.8084  14.2684     11.6922  2.0051     111.84      36.7038     111.84      
1 1 1 28 5  66 o 11 42.4221 6.62685 26.5057     11.2473  52.3509     16.507   30.8029    243.483     12.1162     243.483     
1 1 1 28 5  67 o 12 35.0524 7.28041 25.5511     12.8     28.8705     14.4628  19.9564    285.751     0.660255    105.751     
1 1 1 28 5  68 o 14 30.6381 7.44276 28.5859     15.4481  12.2919     12.8097  7.79655    101.79      21.014      281.79      
1 1 1 28 5  69 o 10 39.6109 7.44665 37.4251     16.2749  33.5728     13.8154  21.2722    270.542     5.33502     90.5422     
1 1 1 28 5  70 o 4  38.9478 7.37806 52.4239     16.3375  18.0895     15.7818  26.9592    15.7677     8.98474     15.7677     
1 1 1 28 5  71 o 2  22.4635 6.97953 -3.93314    16.8199  8.51691     14.4158  4.28604    305.881     14.5139     125.881     
1 1 1 28 5  72 o 11 22.5067 6.73124 17.7473     15.5823  -4.90844    11.3327  5.52638    88.5628     1.47347     268.563     
1 1 1 28 5  73 o 12 30.7205 7.61474 33.6085     16.7127  14.2852     12.7676  12.9877    228.73      5.45052     228.73      
1 1 1 28 5  74 o 4  36.8806 7.69983 33.1968     17.4586  35.8873     13.5783  22.0495    270.908     8.91653     270.908     
1 1 1 28 5  75 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 6  0  o 5  159.858 2.43668 453.703     19.5002  453.703     19.5002  136.267    180         34.9467     180         
1 1 1 28 6  1  o 15 101.011 2.56845 185.675     13.0646  176.927     12.8943  74.1007    313.962     18.4497     313.962     
1 1 1 28 6  2  o 1  197.435 2.5541  699.997     25.7306  683.342     24.8113  177.96     289.456     72.5085     289.456     
1 1 1 28 6  3  o 11 104.448 2.44495 188.91      12.7617  198.667     12.7929  78.234     308.016     20.5686     308.016     
1 1 1 28 6  4  f 0  134.938 2.37759 328.313     16.0764  317.968     16.0634  128.403    255.828     0           0           
1 1 1 28 6  5  o 2  163.695 2.47913 476.283     20.359   474.563     20.3156  145.785    293.328     60.6409     293.328     
1 1 1 28 6  6  f 0  206.075 2.62408 762.068     26.5318  745.179     27.641   138.775    321.268     0           0           
1 1 1 28 6  7  o 19 100.913 2.47429 176.39      12.4875  185.462     12.4945  71.8492    176.103     11.3896     176.103     
1 1 1 28 6  8  o 1  141.23  2.44361 351.153     17.6072  356.858     16.9558  98.4672    218.692     2.82542     38.6919     
1 1 1 28 6  9  o 3  102.583 2.48074 197.083     12.4337  177.061     12.9718  62.9141    62.2817     13.2472     242.282     
1 1 1 28 6  10 o 18 113.391 2.46175 234.398     14.2196  222.395     13.7264  84.499     20.9065     14.8416     20.9065     
1 1 1 28 6  11 o 17 92.2225 2.52451 152.537     11.6141  149.775     11.6752  64.236     270.274     9.87606     270.274     
1 1 1 28 6  12 o 16 92.5745 2.53822 165.689     11.7166  139.511     11.7224  60.3512    82.8066     1.13749     262.807     
1 1 1 28 6  13 o 8  216.505 2.64139 840.635     28.6406  823.461     28.6749  171.106    176.364     27.8881     176.364     
1 1 1 28 6  14 o 8  120.218 2.46544 264.028     15.1318  249.469     14.5455  50.087     107.159     70.6524     287.159     
1 1 1 28 6  15 o 4  31.4693 5.04377 22.9715     7.64219  13.8939     8.04505  5.10786    232.404     20.372      232.404     
1 1 1 28 6  16 o 3  156.242 2.42938 433.551     18.9748  432.93      19.0688  128.057    98.1062     33.5789     98.1062     
1 1 1 28 6  17 o 14 153.773 2.50845 419.583     19.6446  419.858     19.0111  151.831    69.7243     88.432      69.7243     
1 1 1 28 6  18 o 6  201.802 2.74259 734.569     28.8087  711.847     26.6503  143.156    62.3213     6.40146     242.321     
1 1 1 28 6  19 o 10 139.972 2.50677 345.51      17.5081  350.556     17.6314  96.5668    62.5787     6.29143     242.579     
1 1 1 28 6  20 o 17 214.712 2.78973 811.941     31.684   825.831     28.2193  175.639    126.24      40.5214     126.24      
1 1 1 28 6  21 o 5  187.177 2.76888 619.853     26.5123  624.894     25.4167  147.567    267.186     25.5931     267.186     
1 1 1 28 6  22 o 12 294.512 3.21916 1545.58     50.157   1539.43     44.7204  228.596    12.6234     28.4264     12.6233     
1 1 1 28 6  23 o 12 70.9335 3.11518 94.7589     10.6176  85.0024     11.3398  39.3449    308.605     12.4391     128.605     
1 1 1 28 6  24 o 15 84.5813 2.90867 125.779     11.6373  129.175     12.9276  55.9545    43.332      0.714326    223.332     
1 1 1 28 6  25 o 19 260.727 3.08285 1208.67     39.0903  1209.57     41.4373  244.105    350.315     111.769     350.315     
1 1 1 28 6  26 o 2  118.118 2.76888 255.485     14.9181  241.176     17.6125  98.1637    0.885905    32.95       0.885905    
1 1 1 28 6  27 o 15 120.983 2.67033 251.749     15.0668  269.251     17.2587  99.1638    221.627     30.2408     221.627     
1 1 1 28 6  28 o 19 169.375 2.70745 521.621     21.7909  498.654     24.0543  97.032     210.029     48.6207     30.0293     
1 1 1 28 6  29 o 16 122.35  2.72886 273.678     15.9467  259.409     17.3942  78.8932    78.8709     14.335      258.871     
1 1 1 28 6  30 o 15 37.1861 5.11614 24.8741     8.72097  26.4736     9.66115  5.50848    355.253     16.1548     175.253     
1 1 1 28 6  31 o 11 69.4443 3.47698 69.8849     11.0788  104.806     12.8816  49.0378    212.518     11.0516     212.518     
1 1 1 28 6  32 o 2  24.1483 5.82487 10.7623     8.17962  8.6296      8.79529  10.2816    147.211     35.4994     147.211     
1 1 1 28 6  33 o 15 146.954 2.9111  384.166     20.8928  385.941     21.9317  105.434    193.499     3.32544     193.499     
1 1 1 28 6  34 o 18 85.62   3.10862 124.483     13.3536  137.901     13.1973  64.4713    139.658     14.9099     139.658     
1 1 1 28 6  35 o 8  140.1   2.7617  352.804     19.145   347.25      19.5898  109.318    146.104     22.3573     146.104     
1 1 1 28 6  36 o 7  36.0105 4.90587 27.4469     8.26737  21.021      8.7391   6.31851    313.106     10.62       133.106     
1 1 1 28 6  37 f 0  76.7479 2.96197 99.8389     11.0653  111.174     11.6312  58.5549    176.257     0           0           
1 1 1 28 6  38 o 5  76.6284 3.06904 109.544     11.6535  100.986     11.799   69.0372    218.315     46.2498     218.315     
1 1 1 28 6  39 o 11 117.452 2.67242 248.985     15.2628  243.602     16.1323  96.0853    335.414     29.488      335.414     
1 1 1 28 6  40 o 7  26.1581 5.57171 14.2827     7.3982   10.6554     8.61613  1.93451    301.965     29.0243     301.965     
1 1 1 28 6  41 o 3  35.1482 5.09115 24.8642     8.14675  21.6264     9.15874  16.0726    51.2407     6.98637     231.241     
1 1 1 28 6  42 o 6  62.4502 3.64873 62.6807     10.4428  78.9743     12.2134  38.6163    224.558     6.87625     44.5582     
1 1 1 28 6  43 o 1  175.527 2.8507  547.772     23.9962  554.77      26.1216  143.695    202.774     41.2884     202.774     
1 1 1 28 6  44 o 1  97.9514 3.12492 160.677     15.0968  184.714     15.4691  61.3905    190.911     12.8145     10.9107     
1 1 1 28 6  45 o 10 60.2582 4.17521 56.7208     12.072   76.9849     12.6473  49.9575    130.406     21.6594     130.406     
1 1 1 28 6  46 o 5  119.498 2.88552 262.904     17.6071  250.042     16.9045  86.5402    341.808     7.65251     341.808     
1 1 1 28 6  47 o 13 29.3144 6.09363 12.5501     10.1068  20.0089     9.38362  11.8956    100.32      4.63134     280.32      
1 1 1 28 6  48 o 8  99.2332 2.89291 171.759     13.6326  182.718     15.0756  74.0016    260.43      12.0801     260.43      
1 1 1 28 6  49 o 19 32.8784 5.6221  16.8564     8.39438  25.4034     10.0288  11.0095    92.6045     17.8325     272.605     
1 1 1 28 6  50 o 18 35.3521 5.29098 25.6573     8.56597  22.4149     9.58542  16.7435    337.186     9.34543     157.186     
1 1 1 28 6  51 o 11 57.5786 3.69255 51.9481     9.80902  70.108      11.2509  53.6678    181.058     35.9359     181.058     
1 1 1 28 6  52 o 6  49.645  4.1943  50.7041     9.45677  40.9754     10.6626  34.0301    145.981     4.26616     145.981     
1 1 1 28 6  53 o 8  55.399  3.83306 53.055      9.82542  60.043      11.1951  49.8953    32.5287     30.2091     32.5287     
1 1 1 28 6  54 o 9  53.7974 4.03063 54.8098     10.0676  52.3961     11.2503  44.3071    322.532     19.6258     322.532     
1 1 1 28 6  55 o 17 34.6914 5.53704 24.4417     8.9861   22.805      9.81514  8.20009    0.224952    27.8685     180.225     
1 1 1 28 6  56 o 15 94.841  2.99472 172.049     13.8085  154.751     14.5049  67.3515    340.789     6.98898     340.789     
1 1 1 28 6  57 o 1  19.6554 5.6424  5.87925     8.27733  1.63593     9.31601  1.26179    36.7835     24.325      36.7835     
1 1 1 28 6  58 o 16 58.648  4.08185 56.3857     11.7088  73.0588     11.7916  25.2321    162.317     27.2445     342.317     
1 1 1 28 6  59 o 11 24.847  6.10523 13.2642     8.6197   9.58566     10.2742  11.3968    222.93      2.40067     222.93      
1 1 1 28 6  60 o 12 41.3892 5.38147 40.6245     9.87527  27.9017     11.2875  19.2584    36.7655     14.259      216.765     
1 1 1 28 6  61 o 2  26.5674 6.19166 16.3384     9.19598  11.6654     10.206   12.1756    298.311     4.62002     298.311     
1 1 1 28 6  62 o 15 21.4755 5.93881 5.02381     8.78632  8.97427     9.79953  4.98008    129.688     11.1363     309.688     
1 1 1 28 6  63 o 7  57.1893 4.78684 60.8562     13.2256  66.4534     13.675   33.3056    156.155     6.96817     336.155     
1 1 1 28 6  64 o 10 21.8008 6.22742 9.39946     10.6049  3.00282     10.7165  3.52555    235.952     14.121      55.9517     
1 1 1 28 6  65 o 2  21.2782 6.25939 10.3601     11.3996  -3.76643    11.7951  0.899742   146.581     20.6708     326.581     
1 1 1 28 6  66 o 13 22.05   6.54503 -1.42059    11.2322  10.9801     13.5673  3.50787    44.3645     16.5094     224.365     
1 1 1 28 6  67 o 7  19.8099 5.84278 -6.64846    11.2026  8.98715     9.74123  4.96209    349.77      1.25866     169.77      
1 1 1 28 6  68 o 14 31.8155 6.99311 17.8194     12.8422  26.6937     12.2937  18.1168    239.47      0.144926    239.47      
1 1 1 28 6  69 o 18 39.6987 7.30212 36.9221     16.2572  35.0908     13.1531  20.317     115.613     7.63504     295.613     
1 1 1 28 6  70 o 11 28.7159 7.11341 19.536      12.7658  17.6152     12.5242  12.1514    209.23      7.38795     29.2305     
1 1 1 28 6  71 o 16 25.6106 6.90192 18.1168     12.661   9.23312     12.3216  10.1256    132.461     0.208744    312.46      
1 1 1 28 6  72 o 13 18.9607 6.11531 -4.47098    14.8588  0.608045    11.1513  0.414399   18.1134     0.913138    198.113     
1 1 1 28 6  73 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 6  74 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 7  0  o 13 25.4078 6.53481 15.2684     7.65259  15.2684     7.65259  30.0076    8.37848e-06 78.5049     8.37848e-06 
1 1 1 28 7  1  f 0  68.1004 2.92522 84.658      10.1531  80.677      9.72046  38.1805    33.3804     0           0           
1 1 1 28 7  2  o 4  173.334 2.4717  543.565     21.9047  522.905     21.038   101.592    189.577     49.1038     9.57683     
1 1 1 28 7  3  o 9  117.205 2.41983 242.98      14.1792  244.974     14.2166  92.7374    310.345     23.7299     310.345     
1 1 1 28 7  4  o 3  201.67  2.64126 726.978     27.114   716.929     26.2722  190.105    58.7        88.4819     58.7        
1 1 1 28 7  5  o 13 153.069 2.59332 437.076     19.358   395.476     20.3126  159.892    86.6243     108.893     86.6243     
1 1 1 28 7  6  o 7  178.889 2.45808 577.271     21.9847  558.655     22.0819  124.875    144.999     10.183      324.999     
1 1 1 28 7  7  o 14 144.422 2.47903 375.854     17.5304  364.776     18.315   90.1767    104.949     27.4502     284.949     
1 1 1 28 7  8  o 17 256.926 2.82059 1178.61     36.2633  1165.72     36.3687  210.497    110.359     43.9687     110.359     
1 1 1 28 7  9  o 9  182.277 2.53672 595.234     23.5895  584.28      22.7534  118.221    223.572     29.0527     43.5722     
1 1 1 28 7  10 o 13 42.2689 3.90266 30.2458     7.93169  34.4769     8.19256  31.9007    188.226     116.886     188.226     
1 1 1 28 7  11 o 5  94.1703 2.5409  162.822     11.9485  152.557     11.979   62.5155    87.9898     3.33706     267.99      
1 1 1 28 7  12 o 1  140.255 2.53446 353.677     18.1678  345.212     17.4306  82.1457    351.374     37.8255     171.373     
1 1 1 28 7  13 o 13 161.167 2.51176 463.672     20.2232  458.552     20.3492  109.034    226.77      15.2304     46.7699     
1 1 1 28 7  14 o 19 61.0922 3.42052 80.5844     9.78072  54.2885     10.4876  33.6359    306.924     2.57569     306.924     
1 1 1 28 7  15 o 3  34.5223 4.67313 26.7294     7.66625  17.5564     7.8376   9.84066    127.052     51.3699     127.052     
1 1 1 28 7  16 o 3  245.189 2.71597 1056.91     33.324   1078.76     33.419   188.89     265.447     19.2384     265.447     
1 1 1 28 7  17 o 12 39.5578 4.16996 28.095      7.95933  28.8957     8.0693   0.545572   343.841     39.5544     343.841     
1 1 1 28 7  18 o 8  264.227 2.82977 1245.34     37.4018  1235.87     37.538   193.554    274.05      0.592483    274.05      
1 1 1 28 7  19 o 4  142.751 2.47805 372.81      17.6314  351.365     17.7917  118.951    42.5485     34.9574     42.5485     
1 1 1 28 7  20 o 17 267.385 3.0428  1283.3      40.7169  1259.45     40.8251  209.022    240.529     27.7823     240.529     
1 1 1 28 7  21 o 16 187.759 2.72018 629.571     26.833   623.442     24.3064  122.811    49.1728     26.483      229.173     
1 1 1 28 7  22 o 12 118.099 2.58894 255.872     15.7824  240.36      14.8292  95.2816    229.003     25.5811     229.003     
1 1 1 28 7  23 o 1  55.9975 3.53746 53.9293     10.2971  58.7296     9.24864  16.7552    204.549     7.67755     204.549     
1 1 1 28 7  24 o 8  77.8129 2.98423 112.295     11.1683  103.859     11.9579  49.5591    297.021     4.17444     117.021     
1 1 1 28 7  25 o 12 128.26  2.54268 307.318     16.8017  278.281     15.8559  96.7103    114.118     12.1167     114.118     
1 1 1 28 7  26 f 0  83.4096 3.07017 122.181     13.2838  126.225     12.252   69.9019    161.773     0           0           
1 1 1 28 7  27 o 9  150.579 2.99141 387.759     21.687   420.594     23.4245  105.925    41.6291     3.24941     221.629     
1 1 1 28 7  28 o 8  38.0608 5.02311 30.0242     8.90768  23.794      9.47434  6.81849    170.552     7.55399     350.552     
1 1 1 28 7  29 o 15 147.216 2.93408 384.696     20.0855  387.937     23.0704  109.685    169.404     9.87938     169.404     
1 1 1 28 7  30 o 4  103.92  3.15763 187.391     16.041   198.547     16.7739  53.7528    192         38.4322     12.0004     
1 1 1 28 7  31 o 1  70.4146 3.52593 96.7641     11.0618  81.6199     13.2715  45.2409    21.9764     1.55473     201.976     
1 1 1 28 7  32 o 13 37.0203 5.37636 31.3437     8.64743  20.1193     10.5288  2.59732    226.222     1.74923     46.2217     
1 1 1 28 7  33 o 5  170.641 2.95706 526.259     23.6763  512.975     26.7343  127.178    20.7451     11.648      20.7451     
1 1 1 28 7  34 o 11 66.3516 3.53901 82.5709     10.5187  75.9621     12.621   49.0782    308.567     17.3041     308.567     
1 1 1 28 7  35 o 1  144.649 2.86161 377.786     19.2012  369.426     22.1043  108.359    302.709     12.7697     302.709     
1 1 1 28 7  36 o 12 138.976 2.59852 345.218     17.3639  343.826     18.7689  124.257    286.936     53.9481     286.936     
1 1 1 28 7  37 o 1  84.2862 2.96751 122.613     12.1736  131.928     12.8194  69.3506    276.8       24.8741     276.8       
1 1 1 28 7  38 o 2  42.7077 4.54011 26.3047     8.21379  41.9497     10.6497  25.6998    42.0219     4.77772     42.0219     
1 1 1 28 7  39 f 0  50.255  3.95685 38.1926     8.72739  54.5962     10.8931  50.0279    104.389     0           0           
1 1 1 28 7  40 o 10 30.0927 5.655   22.9174     8.52727  10.9144     9.58996  10.6827    274.873     9.85229     94.8728     
1 1 1 28 7  41 o 7  75.2876 3.31444 93.3114     11.8258  111.405     13.0659  45.2994    203.695     13.1842     23.6951     
1 1 1 28 7  42 o 6  120.549 2.91453 264.483     17.4124  256.819     17.7408  92.6793    81.7068     16.8178     81.7068     
1 1 1 28 7  43 o 7  155.386 2.71662 428.088     20.9817  436.355     21.3276  115.486    4.41151     12.8873     4.41151     
1 1 1 28 7  44 o 17 31.5763 5.51394 13.0172     8.79585  25.5133     8.9938   15.2499    355.038     1.4134      355.038     
1 1 1 28 7  45 o 6  82.3832 3.18786 109.337     12.1519  136.506     14.0927  53.602     308.543     6.02764     128.543     
1 1 1 28 7  46 f 0  130.514 2.94945 292.446     18.791   320.865     19.7429  64.7292    202.787     0           0           
1 1 1 28 7  47 o 3  63.4126 3.56097 73.0253     10.7254  73.4617     11.6994  40.5558    353.182     4.2957      173.182     
1 1 1 28 7  48 o 8  118.383 2.86466 244.377     16.8536  260.329     17.0797  106.199    131.741     49.5904     131.741     
1 1 1 28 7  49 o 16 159.133 2.73661 424.492     21.1259  486.778     22.4997  121.231    200.26      22.201      200.26      
1 1 1 28 7  50 o 4  52.9185 4.03443 42.4295     10.2226  61.8653     10.5435  36.1756    67.2169     3.06947     67.2169     
1 1 1 28 7  51 o 11 69.7436 3.30425 88.4944     10.9286  88.4218     12.0059  42.4227    319.977     9.28412     139.977     
1 1 1 28 7  52 o 8  99.2809 2.88487 186.027     13.9607  170.181     14.6222  82.6796    186.909     30.4479     186.909     
1 1 1 28 7  53 o 14 44.0831 4.72309 38.7523     9.51638  34.9755     10.5749  36.2275    344.718     18.3909     344.718     
1 1 1 28 7  54 o 3  18.2744 5.38508 -4.92553    7.92856  7.09445     9.20272  2.97133    252.876     6.4621      72.8756     
1 1 1 28 7  55 o 1  71.2508 3.49744 112.955     11.7846  75.3405     12.4388  37.0007    165.133     21.9593     345.133     
1 1 1 28 7  56 o 19 23.0289 5.97089 6.63288     8.71516  11.4616     9.44021  7.86241    109.813     1.22775     109.813     
1 1 1 28 7  57 o 11 75.8768 3.49747 116.041     13.0777  96.9246     13.2624  57.4347    30.6681     13.6114     30.6681     
1 1 1 28 7  58 o 5  20.7635 5.86913 7.65321     9.00971  2.99857     9.69985  4.95877    181.134     0.562667    1.13429     
1 1 1 28 7  59 o 15 35.0148 5.97252 23.2881     9.64162  27.3302     11.0857  19.7751    289.051     3.25143     109.051     
1 1 1 28 7  60 o 12 16.8603 5.27924 0.588476    8.43163  -3.36535    9.36869  2.99684    273.279     22.9938     273.279     
1 1 1 28 7  61 o 16 38.2877 5.65727 20.7156     10.1022  40.264      11.0928  14.4549    20.7139     19.35       200.714     
1 1 1 28 7  62 o 16 61.2029 4.23608 61.6942     12.2207  82.0368     13.3479  49.3419    227.559     20.3771     227.559     
1 1 1 28 7  63 o 6  58.9831 4.80167 74.7777     12.788   61.1672     14.5622  43.7807    17.0502     12.3813     17.0502     
1 1 1 28 7  64 o 8  27.2177 6.68928 20.983      11.6633  8.30264     11.6337  10.2284    103.013     9.81608     283.013     
1 1 1 28 7  65 o 3  23.707  6.59788 10.8225     12.192   7.72394     10.8092  9.59522    285.299     3.62979     105.299     
1 1 1 28 7  66 o 6  24.5633 7.02268 10.1369     15.1781  9.14713     11.6331  11.2124    245.42      1.52784     245.42      
1 1 1 28 7  67 o 5  28.6249 6.88122 18.714      11.8584  16.6626     11.7509  12.9411    281.448     6.71894     101.448     
1 1 1 28 7  68 f 0  15.8976 5.238   -4.36954    10.5597  -8.03171    9.8023   9.77913    99.5959     0           0           
1 1 1 28 7  69 o 19 36.2964 7.01565 34.6016     12.8878  26.3476     13.6814  22.3826    342.849     2.95872     342.849     
1 1 1 28 7  70 o 13 21.8089 6.53954 4.8335      12.1074  7.93976     12.7125  5.55212    51.1695     4.72993     231.17      
1 1 1 28 7  71 o 6  23.2419 6.58184 -0.347415   12.1933  17.929      12.6421  5.70496    120.48      2.35198     300.48      
1 1 1 28 7  72 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 7  73 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 8  0  o 10 80.184  2.96802 115.005     11.8515  115.005     11.8515  27.9092    8.65723e-06 63.6351     180         
1 1 1 28 8  1  o 19 43.6654 3.78393 32.8326     8.10046  36.0733     8.09622  5.94612    316.824     63.4647     316.824     
1 1 1 28 8  2  o 5  77.7859 2.71733 98.5685     10.5053  117.262     10.5566  17.2753    8.04079     73.7717     188.041     
1 1 1 28 8  3  o 15 247.935 2.79021 1089.88     34.6829  1093.74     34.6538  193.933    132.773     22.3013     132.773     
1 1 1 28 8  4  o 14 106.427 2.57776 204.468     13.3591  198.239     14.074   89.0507    329.597     31.5991     329.597     
1 1 1 28 8  5  o 19 180.788 2.51896 592.62      22.784   568.048     22.8505  156.442    46.7632     49.872      46.7632     
1 1 1 28 8  6  f 0  275.072 2.94224 1359.24     40.5641  1329.56     40.5499  237.41     305.451     0           0           
1 1 1 28 8  7  o 2  83.1815 2.64933 127.017     11.0202  119.288     11.0031  52.0088    274.523     8.37222     94.5231     
1 1 1 28 8  8  o 4  129.954 2.50499 304.13      16.6629  296.034     15.9337  68.318     289.279     51.2162     109.279     
1 1 1 28 8  9  o 10 197.884 2.57619 699.94      25.5092  690.813     25.5846  142.075    28.893      5.75993     208.893     
1 1 1 28 8  10 o 5  186.602 2.60013 627.589     24.7583  609.266     23.8724  145.781    245.794     19.2793     245.794     
1 1 1 28 8  11 o 9  120.088 2.50372 250.44      14.7205  262.242     15.384   71.094     19.8099     29.8391     199.81      
1 1 1 28 8  12 o 13 174.703 2.42948 546.342     21.2289  537.563     21.31    136.93     109.428     19.8771     109.428     
1 1 1 28 8  13 o 17 154.86  2.46755 423.267     19.0997  428.496     19.1998  151.456    17.8967     82.2588     17.8967     
1 1 1 28 8  14 o 3  85.394  2.82639 132.216     12.1932  127.569     11.9308  30.4001    162.269     58.7517     342.269     
1 1 1 28 8  15 o 16 67.7069 2.9745  86.9529     9.86234  76.8428     10.1696  44.7722    326.739     7.56674     326.739     
1 1 1 28 8  16 o 5  90.6805 2.55801 143.808     11.5617  148.841     11.6393  67.8378    172.711     12.6957     172.711     
1 1 1 28 8  17 o 10 148.122 2.53229 399.603     19.102   380.083     18.4939  130.809    280.018     49.8883     280.018     
1 1 1 28 8  18 o 8  200.775 2.60505 719.368     25.6517  713.305     26.7539  165.263    135.862     38.4564     135.862     
1 1 1 28 8  19 o 6  71.1213 2.94588 93.0247     10.5319  87.5713     10.3723  50.5725    91.1598     12.3883     91.1598     
1 1 1 28 8  20 o 11 301.626 3.12002 1631.35     47.9712  1607.36     46.3477  258.591    61.4108     75.5178     61.4108     
1 1 1 28 8  21 o 1  191.603 2.73481 650.824     26.3812  654.863     26.1368  127.049    193.427     24.5228     13.4272     
1 1 1 28 8  22 o 15 28.3239 5.12022 8.49087     7.76377  21.1831     7.5423   8.55083    56.5622     38.1036     56.5622     
1 1 1 28 8  23 o 4  39.9354 5.0271  22.8398     10.1916  36.6816     8.72601  8.29105    299.359     20.7091     119.359     
1 1 1 28 8  24 o 10 95.8436 3.06317 165.391     13.469   162.508     15.7641  76.7044    70.8306     21.976      70.8306     
1 1 1 28 8  25 o 3  181.212 2.89309 604.413     27.5548  565.337     24.992   119.123    240.128     23.9529     60.1283     
1 1 1 28 8  26 o 17 84.9627 3.21476 151.177     14.6217  108.739     12.6291  62.8446    324.737     10.3576     324.737     
1 1 1 28 8  27 o 17 118.802 2.85637 258.558     17.507   244.938     16.458   99.8826    236.82      33.0231     236.82      
1 1 1 28 8  28 o 13 57.9616 3.55787 61.6044     10.1979  59.3825     10.262   36.4307    281.986     3.58295     281.986     
1 1 1 28 8  29 o 2  58.011  3.42658 64.6457     10.1179  56.5884     9.61621  27.6633    352.389     19.0906     172.389     
1 1 1 28 8  30 o 10 99.2981 2.82148 172.693     13.8961  179.459     14.127   85.1839    91.3809     34.8101     91.3809     
1 1 1 28 8  31 f 0  43.5396 4.27897 32.3375     8.72793  37.1644     9.44302  16.1996    81.8059     0           0           
1 1 1 28 8  32 o 2  42.8871 4.25528 30.9159     8.33541  36.6089     9.46566  16.5377    25.7945     9.91794     205.795     
1 1 1 28 8  33 o 19 71.0162 3.55106 105.032     11.236   77.5599     13.2202  51.7759    312.222     10.3089     312.222     
1 1 1 28 8  34 o 14 77.1658 3.0725  107.194     11.0125  106.323     12.5907  48.4338    111.412     8.65425     291.412     
1 1 1 28 8  35 o 15 43.1188 4.7753  38.4221     8.44315  30.5815     10.9552  14.6997    95.5823     24.8408     275.582     
1 1 1 28 8  36 o 2  33.914  6.17997 21.8104     9.5849   22.0559     11.5871  12.3567    31.0936     11.8261     211.094     
1 1 1 28 8  37 o 13 67.0726 3.85069 85.2291     11.4082  77.8565     13.9522  47.2841    161.977     2.79964     161.977     
1 1 1 28 8  38 o 1  104.241 3.11123 198.988     15.2846  191.148     17.0537  77.6703    152.159     8.7843      152.159     
1 1 1 28 8  39 o 17 44.0895 4.86523 30.0143     9.48464  43.0226     11.3157  22.6368    129.128     11.9819     309.128     
1 1 1 28 8  40 o 8  106.692 2.97567 198.865     16.1583  209.965     15.5677  68.8011    79.2651     12.3649     259.265     
1 1 1 28 8  41 o 10 28.1845 5.56868 5.9184      7.60408  24.765      9.9796   6.06883    60.0555     19.9387     240.055     
1 1 1 28 8  42 o 15 170.345 2.63062 517.692     21.2347  521.36      23.6213  148.687    289.01      57.3455     289.01      
1 1 1 28 8  43 o 1  54.7452 3.71315 48.6162     9.41069  61.2294     10.7194  39.9148    220.955     7.46415     220.955     
1 1 1 28 8  44 o 17 62.421  3.45679 68.7769     10.1185  72.9163     11.3282  36.2171    357.3       12.518      177.3       
1 1 1 28 8  45 o 16 53.7258 3.89879 44.2119     9.27325  62.6122     11.448   38.2582    131.833     5.56724     131.833     
1 1 1 28 8  46 o 5  21.0964 5.73565 7.45433     8.27958  4.40084     8.91399  1.25968    333.212     1.82573     153.212     
1 1 1 28 8  47 o 3  75.2301 3.25029 105.982     11.6064  99.3276     12.7061  51.8462    138.092     0.961355    138.092     
1 1 1 28 8  48 o 16 99.6232 3.02716 182.932     15.3239  175.682     14.8333  76.6289    303.38      16.1441     303.38      
1 1 1 28 8  49 o 19 59.0613 4.0046  68.5888     11.5668  60.2167     11.7826  44.7782    1.4383      11.1906     1.4383      
1 1 1 28 8  50 o 19 62.4116 3.92665 62.2777     11.9123  81.9233     12.2345  56.0955    215.561     30.1961     215.561     
1 1 1 28 8  51 o 15 25.5762 6.25928 12.0256     9.5335   11.7808     10.0133  2.1778     88.7506     26.4713     268.751     
1 1 1 28 8  52 o 3  88.524  3.33353 145.521     14.6389  140.437     14.8234  73.2845    5.48877     26.2414     5.48877     
1 1 1 28 8  53 f 0  107.808 3.20989 211.143     16.4299  212.529     18.1347  58.564     118.103     0           0           
1 1 1 28 8  54 o 13 19.0508 5.67347 3.61904     8.22969  0.378871    10.4011  2.27991    161.186     14.5101     341.186     
1 1 1 28 8  55 o 15 56.2405 4.31189 59.4478     10.9594  60.1039     12.8592  38.8519    345.682     3.17195     345.682     
1 1 1 28 8  56 o 16 33.7776 5.96446 23.1076     9.38512  23.553      10.7608  12.8758    313.781     17.0395     133.781     
1 1 1 28 8  57 o 6  31.3869 6.34418 25.1908     10.7367  15.8678     10.5955  9.57805    142.013     20.0594     322.013     
1 1 1 28 8  58 o 15 17.6486 5.40431 5.03987     8.69916  -9.00485    10.2419  1.25986    202.593     20.5845     202.593     
1 1 1 28 8  59 o 6  54.9366 4.62867 57.098      11.6574  59.6387     13.2868  29.2297    204.45      13.6465     24.4498     
1 1 1 28 8  60 o 7  47.2689 5.02323 35.8072     10.7143  53.2152     12.2485  33.0845    309.39      6.35039     309.39      
1 1 1 28 8  61 f 0  19.1184 5.70391 5.24504     8.72611  -0.733488   10.4006  14.968     212.284     0           0           
1 1 1 28 8  62 o 17 40.0918 5.73095 28.8512     10.7899  37.4519     11.4624  21.5872    65.5672     6.5884      245.567     
1 1 1 28 8  63 o 2  22.3204 6.21441 10.006      9.99098  5.11667     10.6718  1.57266    173.5       21.9664     353.5       
1 1 1 28 8  64 f 0  27.2223 6.84841 23.3628     13.7555  7.20746     10.38    12.881     323.816     0           0           
1 1 1 28 8  65 o 4  33.794  6.59378 18.2014     12.3084  31.3474     11.5437  14.6498    199.94      12.0221     19.9403     
1 1 1 28 8  66 o 8  20.6203 6.31814 -0.809604   13.9674  5.05584     10.5837  6.15625    17.089      6.61012     197.089     
1 1 1 28 8  67 o 4  18.5621 5.79418 -9.97559    11.0679  6.43908     11.1484  3.95612    244.526     4.08785     64.5257     
1 1 1 28 8  68 o 6  31.2956 6.92042 20.8116     12.74    24.5676     11.5699  18.413     160.742     3.85482     160.742     
1 1 1 28 8  69 o 10 20.4334 6.25688 0.765797    12.1242  6.63743     11.6978  1.47273    318.914     16.5572     138.913     
1 1 1 28 8  70 o 13 21.4387 6.52473 -6.52291    15.0654  11.9084     12.358   1.58834    281.767     1.02743     101.767     
1 1 1 28 8  71 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 9  0  o 8  116.082 2.61673 239.794     15.1874  239.794     15.1874  64.3378    180         44.6212     8.63461e-06 
1 1 1 28 9  1  o 17 130.118 2.5641  303.463     17.3714  298.491     16.0182  77.1454    320.371     34.3764     140.371     
1 1 1 28 9  2  o 2  51.7753 3.43843 51.1537     8.89097  45.1959     8.72416  22.3823    18.3006     2.51164     198.301     
1 1 1 28 9  3  o 18 163.86  2.55962 472.981     20.9974  480.925     21.0395  172.367    267.879     110.206     267.879     
1 1 1 28 9  4  o 6  140.794 2.51237 356.137     17.3245  348.308     18.0939  80.2421    151.73      44.6841     331.73      
1 1 1 28 9  5  o 5  224.781 2.67103 895.546     30.0429  899.973     30.1338  189.809    189.634     48.598      189.634     
1 1 1 28 9  6  o 17 42.8623 3.99463 26.6854     8.22747  40.6894     8.15427  9.98899    100.388     14.5975     280.388     
1 1 1 28 9  7  o 5  110.07  2.47922 223.826     13.6453  207.154     13.6548  76.5868    312.262     3.24439     132.262     
1 1 1 28 9  8  o 8  73.0045 2.88849 92.3024     10.491   97.8318     10.5549  22.5826    47.2289     55.7206     227.229     
1 1 1 28 9  9  o 1  164.521 2.53865 494.929     21.2947  466.994     20.5683  149.278    220.656     60.1967     220.656     
1 1 1 28 9  10 o 11 103.314 2.58272 181.431     13.0685  198.531     13.6325  53.6618    54.8158     40.1342     234.816     
1 1 1 28 9  11 o 15 292.726 3.21014 1509.95     46.1022  1540.08     48.0768  222.875    207.957     12.9688     207.957     
1 1 1 28 9  12 o 16 125.879 2.51369 286.144     15.4668  277.403     16.1929  118.904    33.1326     60.7036     33.1326     
1 1 1 28 9  13 o 10 106.303 2.51329 209.014     13.3453  193.17      13.3778  62.0685    111.473     27.4208     291.473     
1 1 1 28 9  14 o 5  246.985 2.91016 1100.84     36.0112  1069.44     36.0235  197.157    329.927     30.9257     329.927     
1 1 1 28 9  15 o 6  143.691 2.45268 374.974     17.629   358.877     17.6865  119.06     279.412     31.1857     279.412     
1 1 1 28 9  16 o 12 29.4064 5.48819 14.7123     8.82362  17.3587     7.67002  8.97192    168.755     41.8164     168.755     
1 1 1 28 9  17 o 19 63.4493 3.13767 75.9133     10.1198  68.2544     9.70424  22.5689    107.307     40.0479     287.307     
1 1 1 28 9  18 o 15 92.6163 2.67365 154.79      12.597   150.839     12.1699  61.2089    143.598     6.9424      323.598     
1 1 1 28 9  19 o 7  186.665 2.78028 617.665     26.9822  622.332     24.9877  148.86     144.741     25.8722     144.741     
1 1 1 28 9  20 o 10 62.7237 3.53263 77.4976     11.0775  64.1034     10.8828  13.5752    315.626     58.4461     135.626     
1 1 1 28 9  21 o 5  219.889 3.17056 877.944     36.1209  845.899     33.7497  180.447    11.9311     39.9574     11.9311     
1 1 1 28 9  22 o 15 49.5714 4.23878 49.4936     10.7933  40.0499     9.82584  24.9159    87.4403     5.16242     267.44      
1 1 1 28 9  23 o 11 166.009 3.01472 509.235     24.3534  473.821     25.6895  141.944    299.207     44.2892     299.207     
1 1 1 28 9  24 o 10 69.2812 3.2305  93.8792     11.4225  78.5012     10.8583  53.1071    4.79402     18.4195     4.79402     
1 1 1 28 9  25 o 6  27.3886 5.7057  14.9607     7.82468  12.5279     9.00788  9.3358     224.074     42.2856     224.074     
1 1 1 28 9  26 f 0  79.6107 3.04629 119.892     11.6925  107.104     12.4366  65.0895    164.14      0           0           
1 1 1 28 9  27 o 3  55.6534 3.44669 60.5003     9.22307  51.3022     9.69965  35.2901    74.4102     15.2761     74.4102     
1 1 1 28 9  28 o 12 125.907 2.50953 287.247     15.64    277.921     15.9863  105.149    154.566     32.2567     154.566     
1 1 1 28 9  29 o 6  104.87  2.68043 202.771     14.6462  189.966     13.4839  45.1464    64.3835     58.6292     244.383     
1 1 1 28 9  30 o 19 60.5033 3.25327 61.1908     9.8695   70.6557     9.64894  31.7572    313.849     16.3295     133.849     
1 1 1 28 9  31 o 13 130.008 2.606   303.897     16.8759  299.334     17.0448  87.3539    176.352     10.8611     356.352     
1 1 1 28 9  32 o 1  74.1093 3.28233 103.695     13.2946  93.8546     10.94    63.9955    223.447     29.3508     223.447     
1 1 1 28 9  33 o 2  57.2262 3.93984 59.4378     10.7702  59.5219     11.5263  34.1623    302.255     8.32826     122.255     
1 1 1 28 9  34 o 1  60.8756 3.57756 65.1255     10.5778  68.9217     11.0552  46.7612    334.379     11.715      334.379     
1 1 1 28 9  35 f 0  50.3056 4.17912 46.1003     10.3697  46.5465     10.2994  23.4247    105.68      0           0           
1 1 1 28 9  36 o 19 46.3613 4.66819 43.4912     9.64113  36.267      11.1271  34.2759    271.219     10.5269     271.219     
1 1 1 28 9  37 o 2  69.1998 3.5209  84.8936     10.4224  88.4012     13.6551  35.0518    275.099     26.369      95.0991     
1 1 1 28 9  38 o 2  38.6287 5.03404 28.5294     8.20356  27.704      10.455   25.9187    319.213     9.85119     319.213     
1 1 1 28 9  39 o 15 84.7457 3.09975 122.421     11.9325  136.518     14.2969  66.9495    240.852     15.9651     240.852     
1 1 1 28 9  40 o 1  83.7764 3.1795  121.531     12.2892  131.885     14.2973  60.2828    8.38942     3.85968     8.38942     
1 1 1 28 9  41 o 1  61.4143 4.04406 70.2814     10.9225  68.0376     13.4638  53.9286    50.5752     26.4796     50.5751     
1 1 1 28 9  42 o 15 99.5958 3.2629  175.958     14.7788  182.732     17.6194  86.1437    128.352     33.6387     128.352     
1 1 1 28 9  43 o 15 27.116  6.06553 15.4619     8.51417  11.8265     10.2113  2.95328    334.959     26.4572     154.959     
1 1 1 28 9  44 o 9  93.436  3.07845 139.797     13.4316  176.735     15.3298  58.3558    131.129     13.5061     311.129     
1 1 1 28 9  45 o 4  20.0944 5.78602 5.50007     7.87793  0.846415    10.8179  0.355733   182.059     17.2728     2.05901     
1 1 1 28 9  46 f 0  30.8801 6.29029 16.7371     9.50385  20.7976     11.0389  25.6999    17.4827     0           0           
1 1 1 28 9  47 o 1  49.7905 4.54157 46.3759     9.78596  46.4637     12.1681  33.6611    283.963     1.75893     283.963     
1 1 1 28 9  48 o 10 100.792 2.95402 178.313     14.2253  189.088     15.5511  65.7823    120.211     7.9943      300.211     
1 1 1 28 9  49 o 4  52.6331 4.22926 52.3401     10.1745  50.9083     11.6411  32.7275    248.706     4.97555     68.7055     
1 1 1 28 9  50 o 16 70.6772 3.66827 100.762     12.6928  83.2822     12.9756  64.6148    99.403      34.1862     99.403      
1 1 1 28 9  51 o 14 35.0511 5.89885 22.5568     10.0829  26.638      10.3653  12.8594    74.4974     19.5988     254.497     
1 1 1 28 9  52 o 7  24.7826 6.26609 13.1769     10.1113  8.94181     9.68763  11.6341    319.383     1.59662     139.383     
1 1 1 28 9  53 o 10 53.2129 4.57413 57.2865     11.4551  50.6982     12.2949  37.2576    349.972     3.83413     349.972     
1 1 1 28 9  54 o 5  19.365  5.67652 -2.9518     9.34996  7.53694     9.42902  5.12541    41.1916     3.53434     221.192     
1 1 1 28 9  55 o 13 65.0336 3.80505 70.9072     11.4609  87.765      13.1356  47.072     166.845     7.07282     166.845     
1 1 1 28 9  56 o 18 18.5414 5.49306 6.80317     8.44103  -5.6279     9.98641  1.94183    251.921     14.3997     71.9208     
1 1 1 28 9  57 o 19 87.7805 3.34949 139.038     14.5421  146.27      14.8162  57.7532    348.004     2.80501     168.004     
1 1 1 28 9  58 o 18 33.6931 6.09136 21.9359     9.44387  25.7313     11.2135  20.4042    125.358     0.843695    125.358     
1 1 1 28 9  59 o 9  20.6894 5.91574 8.86142     9.46473  1.05706     10.0625  4.73862    38.3729     3.22745     218.373     
1 1 1 28 9  60 o 17 21.8589 6.05213 5.90076     9.05229  9.31137     10.2338  5.99559    136.77      5.06957     316.77      
1 1 1 28 9  61 o 6  41.603  5.77202 42.2605     11.3494  29.3795     11.7731  22.3082    16.3137     7.89442     196.314     
1 1 1 28 9  62 o 7  49.8269 4.67065 46.3421     11.5675  50.6061     11.1226  36.4658    265.693     9.36049     265.693     
1 1 1 28 9  63 o 9  35.2977 6.53    38.6614     13.4587  16.5857     10.7221  26.9361    299.529     16.1417     299.529     
1 1 1 28 9  64 o 8  22.8938 6.64589 6.45654     12.9239  8.38591     11.5757  6.96403    158.858     10.8413     338.858     
1 1 1 28 9  65 o 4  17.7672 5.63131 4.35688     11.1149  -10.0417    10.2793  3.47453    134.447     6.16936     314.447     
1 1 1 28 9  66 o 19 44.4744 6.7403  52.7929     16.2461  36.4283     12.9944  26.7786    278.909     1.85407     98.9088     
1 1 1 28 9  67 o 17 25.1426 6.98113 24.6405     15.3979  0.0810021   11.7249  5.14451    286.857     1.68979     286.857     
1 1 1 28 9  68 o 13 18.8165 6.10328 -2.78988    15.438   -0.987961   10.6125  1.17197    120.34      2.15994     300.34      
1 1 1 28 9  69 o 14 43.1066 7.78487 36.0701     19.7191  59.7564     16.1326  28.0481    158.869     6.03946     158.869     
1 1 1 28 9  70 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 10 0  o 9  58.1984 3.2571  61.2771     9.35867  61.2771     9.35867  7.44244    4.95168e-08 71.7993     180         
1 1 1 28 10 1  o 16 243.58  2.80967 1064.01     33.6262  1046.28     34.9423  195.398    157.709     29.9453     157.709     
1 1 1 28 10 2  o 1  157.028 2.52335 424.228     20.2153  452.386     19.4512  73.5437    166.351     84.1624     346.351     
1 1 1 28 10 3  o 4  173.045 2.47104 519.346     21.3865  544.989     21.4636  120.906    20.855      12.7255     200.855     
1 1 1 28 10 4  o 10 124.331 2.46249 282.631     15.2961  267.265     15.3493  103.658    257.001     28.9768     257.001     
1 1 1 28 10 5  o 10 232.685 2.70855 970.596     31.5806  954.786     31.5855  159.064    28.3834     26.6142     208.383     
1 1 1 28 10 6  o 3  140.941 2.49277 355.944     17.5836  350.334     17.6147  97.6605    356.474     10.1389     176.474     
1 1 1 28 10 7  o 8  51.9633 3.47353 52.5652     8.89214  44.6915     8.92759  23.5878    120.689     13.511      300.689     
1 1 1 28 10 8  o 3  58.6375 3.23895 68.1082     9.3758   55.4347     9.41947  29.3199    249.277     15.8646     69.2766     
1 1 1 28 10 9  o 14 232.403 2.70884 980.545     31.5348  940.761     31.5527  231.305    64.5586     120.66      64.5586     
1 1 1 28 10 10 o 18 84.7185 2.70794 134.467     11.4057  121.511     11.5003  75.4736    171.505     40.9273     171.505     
1 1 1 28 10 11 o 17 139.598 2.49737 354.311     17.7762  339.057     17.14    113.621    22.3096     25.0581     22.3096     
1 1 1 28 10 12 o 15 121.007 2.61705 259.07      15.8488  262.227     15.854   103.081    197.234     33.3177     197.234     
1 1 1 28 10 13 o 13 47.1    3.89189 42.322      9.05537  38.0601     8.95275  19.3745    119.746     12.8729     299.746     
1 1 1 28 10 14 o 9  157.125 2.86134 446.171     21.4968  433.163     23.4635  96.2382    130.96      37.5357     310.96      
1 1 1 28 10 15 o 13 154.12  2.77771 424.952     22.3209  420.902     20.5365  119.628    80.6693     14.8228     80.6693     
1 1 1 28 10 16 o 19 124.272 2.76393 275.202     17.3062  275.145     17.0766  92.9994    192.263     6.98579     192.263     
1 1 1 28 10 17 o 1  114.984 2.81541 239.028     16.271   232.407     16.126   71.4555    266.978     22.7562     86.9778     
1 1 1 28 10 18 o 9  148.452 2.76112 400.788     20.5808  384.66      20.4622  121.835    312.197     28.5369     312.197     
1 1 1 28 10 19 o 3  36.0511 5.32534 30.4807     9.33033  18.5738     9.33824  6.12209    344.255     54.8314     344.255     
1 1 1 28 10 20 o 3  103.182 2.67388 195.108     13.6316  184.644     13.955   77.7027    201.107     9.42911     201.107     
1 1 1 28 10 21 o 4  114.992 2.67092 245.214     15.4145  226.511     15.3126  85.8657    329.569     7.55283     329.569     
1 1 1 28 10 22 o 19 31.7917 5.51377 19.8392     8.15931  18.1635     9.30573  1.49448    352.367     20.1164     172.367     
1 1 1 28 10 23 o 8  81.0832 2.81901 122.344     11.3656  112.761     11.4547  53.9105    164.042     3.97384     344.042     
1 1 1 28 10 24 o 8  22.3963 5.33634 12.7514     7.30234  2.42984     7.94779  11.9936    164.428     38.881      164.428     
1 1 1 28 10 25 o 15 133.277 2.72175 321.387     17.8482  312.607     18.4547  101.327    167.537     11.5173     167.537     
1 1 1 28 10 26 o 17 55.4529 3.56822 54.4306     9.20024  56.6526     10.3958  24.1549    249.578     24.2513     69.5784     
1 1 1 28 10 27 o 18 91.9262 2.78235 155.344     12.1306  146.831     13.3694  45.8901    300.732     38.574      120.732     
1 1 1 28 10 28 o 17 19.4585 5.34222 8.40061     7.94989  -1.57926    7.80841  2.88956    38.8289     10.0196     38.8289     
1 1 1 28 10 29 o 12 44.8101 4.67513 26.805      9.94548  48.9129     9.6095   14.7024    252.237     28.7786     72.2375     
1 1 1 28 10 30 o 17 23.2871 5.72006 3.47726     9.13491  12.8475     8.09812  2.70281    223.436     25.3005     223.436     
1 1 1 28 10 31 o 14 141.768 2.84756 350.228     19.9443  368.997     20.4763  125.078    335.649     46.4188     335.649     
1 1 1 28 10 32 o 6  73.7434 3.42074 93.9122     13.441   102.274     11.5099  74.7675    149.201     50.649      149.201     
1 1 1 28 10 33 o 1  60.4371 3.70658 64.0476     10.9512  68.538      11.2783  55.6712    257.513     32.108      257.513     
1 1 1 28 10 34 o 16 75.4649 3.53119 96.0166     14.3234  110.119     11.8688  72.011     310.793     40.7627     310.793     
1 1 1 28 10 35 o 14 60.2465 3.84823 70.2787     10.9006  62.0628     11.9401  41.7895    3.74251     1.01957     3.74252     
1 1 1 28 10 36 o 10 17.134  5.23648 0.836727    7.90492  -2.05589    8.64836  14.0385    85.8452     46.0037     85.8452     
1 1 1 28 10 37 o 10 84.6145 3.25944 118.328     13.5156  140.701     13.9776  53.4179    190.558     12.4174     10.5583     
1 1 1 28 10 38 o 10 22.9663 5.64799 12.5996     8.05457  4.27182     8.54754  1.61881    41.0552     20.1625     221.055     
1 1 1 28 10 39 o 7  103.596 2.8119  197.474     14.6212  188.528     14.5176  94.3278    158.091     43.2095     158.091     
1 1 1 28 10 40 o 7  129.341 2.82438 303.202     18.0974  298.495     18.4669  85.9501    176.948     11.5838     356.948     
1 1 1 28 10 41 o 1  73.1315 3.21944 92.718      11.3413  101.183     12.1442  53.5105    20.6369     5.75226     20.637      
1 1 1 28 10 42 o 7  29.3284 5.82275 17.2419     8.55874  16.1405     9.28418  6.37875    276.249     23.3413     96.2488     
1 1 1 28 10 43 f 0  50.6302 4.27693 54.6764     9.86153  40.9978     10.9458  38.9926    254.845     0           0           
1 1 1 28 10 44 o 1  145.555 2.88828 397.052     20.3662  367.069     21.6305  97.9243    334.551     9.2178      154.551     
1 1 1 28 10 45 o 11 18.8915 5.52089 3.85588     8.11062  1.19572     8.98612  0.566871   331.253     18.2522     331.252     
1 1 1 28 10 46 f 0  110.86  2.86468 212.666     15.2995  231.369     16.4838  57.4866    203.399     0           0           
1 1 1 28 10 47 o 13 35.1031 5.78753 27.5362     8.8418   20.8783     11.3005  16.7271    26.1301     11.3216     206.13      
1 1 1 28 10 48 o 1  27.8163 6.2767  12.5786     9.05547  17.7125     10.7236  7.61353    286.391     19.1399     106.391     
1 1 1 28 10 49 o 9  26.5931 6.27239 9.8559      8.82767  17.5028     10.9149  9.83772    26.0933     12.1016     206.093     
1 1 1 28 10 50 o 10 42.6771 5.43891 43.2379     9.6574   28.6441     12.1078  28.3961    0.78091     1.04342     0.780908    
1 1 1 28 10 51 o 8  50.6347 4.8024  50.3788     10.1536  48.0788     13.1958  30.7084    254.244     6.45974     74.2438     
1 1 1 28 10 52 o 10 27.023  6.35979 15.1405     9.05026  13.5921     11.2936  15.4509    170.909     2.34171     170.909     
1 1 1 28 10 53 o 7  24.6272 6.24663 10.6332     9.67462  12.0258     9.92577  9.17314    247.081     3.50693     247.081     
1 1 1 28 10 54 o 11 32.0109 6.24866 23.774      10.3387  19.1186     10.4659  14.379     270.481     11.2494     90.4808     
1 1 1 28 10 55 o 2  21.8377 6.0682  10.4763     9.9126   3.20998     9.91291  0.509747   148.211     24.5882     328.211     
1 1 1 28 10 56 o 8  68.4199 3.9219  98.0158     13.5573  79.1584     13.0278  60.5509    203.496     30.4811     203.496     
1 1 1 28 10 57 o 3  39.8478 5.77224 30.2841     10.8974  35.1489     11.3884  21.7345    215.761     7.12552     35.7614     
1 1 1 28 10 58 o 2  24.1789 6.31866 15.2833     9.41683  2.76803     12.724   8.91093    30.2037     5.44175     210.204     
1 1 1 28 10 59 o 11 20.4868 5.9725  4.81767     9.3657   5.04133     10.464   3.70139    218.309     12.1877     38.3088     
1 1 1 28 10 60 o 7  45.5235 5.08942 43.0921     11.735   39.5404     10.7193  28.2049    197.103     2.01511     17.1027     
1 1 1 28 10 61 o 12 28.7105 6.24549 23.3509     10.4815  11.2571     9.95653  16.0888    163.448     0.567348    343.448     
1 1 1 28 10 62 o 13 85.5161 3.71488 137.972     17.2479  137.539     14.2587  65.8233    87.483      18.2816     87.483      
1 1 1 28 10 63 o 10 28.1909 7.00312 28.2018     14.6814  6.56627     11.001   16.6733    247.422     4.49853     247.422     
1 1 1 28 10 64 o 7  46.5189 6.77107 65.9149     16.5461  32.7259     14.2797  38.3534    337.635     19.7251     337.635     
1 1 1 28 10 65 o 3  30.5363 7.3157  17.3104     16.446   25.4014     11.8171  16.4098    144.057     1.26712     324.057     
1 1 1 28 10 66 o 15 39.9433 7.54136 45.7501     16.4456  33.3173     14.44    28.5243    170.994     11.4078     170.994     
1 1 1 28 10 67 o 13 27.0326 7.54034 22.7101     15.9139  11.7257     14.4833  10.1328    343.652     6.85248     163.652     
1 1 1 28 10 68 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 10 69 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 11 0  o 13 15.3239 6.24872 5.27316     7.72634  5.27316     7.72634  43.3533    2.23913e-05 99.9803     2.23913e-05 
1 1 1 28 11 1  o 12 166.773 2.63078 490.618     21.9848  498.987     21.9887  109.343    301.552     27.5352     121.552     
1 1 1 28 11 2  o 4  37.4551 4.9144  20.4493     9.02256  32.0025     8.57195  12.1354    133.597     70.9674     133.597     
1 1 1 28 11 3  o 16 88.4187 2.79146 134.985     12.0835  143.94      12.5937  74.8834    180.026     28.1955     180.026     
1 1 1 28 11 4  o 9  113.941 2.72985 221.579     15.5426  241.241     15.5671  83.4513    352.009     2.34487     352.009     
1 1 1 28 11 5  o 11 112.627 2.79002 215.835     15.6802  236.546     15.7435  104.013    195.811     48.25       195.811     
1 1 1 28 11 6  o 2  90.0057 3.00254 151.412     13.5586  138.01      13.4342  68.9311    184.257     11.776      184.257     
1 1 1 28 11 7  o 8  138.878 2.7003  352.176     18.7998  334.959     18.7437  84.1299    260.262     35.5163     80.262      
1 1 1 28 11 8  o 3  135.074 2.69338 322.31      18.2424  327.666     18.1834  102.72     229.512     8.46268     229.511     
1 1 1 28 11 9  o 14 129.118 2.83909 291.041     19.1176  303.376     17.5019  104.617    213.587     21.8966     213.587     
1 1 1 28 11 10 o 10 21.8102 5.84529 9.09775     9.21179  2.9321      8.6152   8.42233    43.9568     26.7894     43.9568     
1 1 1 28 11 11 o 10 71.6901 3.51398 87.5947     12.7884  96.9877     12.2405  55.2717    339.526     15.8164     339.526     
1 1 1 28 11 12 o 12 127.862 3.11351 278.495     20.5575  305.618     19.1577  92.0182    36.4976     1.87885     216.498     
1 1 1 28 11 13 o 15 89.378  3.33106 144.233     15.5936  141.802     14.1144  56.0223    222.523     14.722      42.5232     
1 1 1 28 11 14 o 7  82.1143 3.20348 118.456     12.9691  122.966     13.2946  55.1354    8.91206     4.33284     188.912     
1 1 1 28 11 15 o 12 61.21   3.53576 64.3898     10.7208  70.5326     10.7651  37.0375    269.816     5.93613     89.816      
1 1 1 28 11 16 o 10 20.6637 5.39077 8.723       7.53313  2.94127     7.53576  13.4274    54.6122     39.2901     54.6122     
1 1 1 28 11 17 o 13 70.5602 3.0797  84.6525     10.8183  93.8615     10.8329  40.4423    328.905     15.9112     148.905     
1 1 1 28 11 18 o 1  44.6789 4.04815 35.2818     8.86369  37.5247     8.83887  0.703061   349.469     56.7384     169.469     
1 1 1 28 11 19 o 9  43.162  4.1625  33.8073     8.71001  34.335      8.82853  18.0721    324.219     6.28288     144.219     
1 1 1 28 11 20 f 0  141.131 2.61228 356.86      18.5875  353.555     18.3323  74.6034    58.126      0           0           
1 1 1 28 11 21 o 7  192.135 2.90577 645.583     27.9172  672.407     28.0337  147.726    148.533     14.3195     148.533     
1 1 1 28 11 22 o 11 47.7483 3.99641 43.6581     9.63085  39.4381     9.12439  25.5173    238.286     3.48211     58.2858     
1 1 1 28 11 23 o 17 70.0187 3.32541 89.3142     11.3705  86.9737     11.8184  33.351     352.527     30.775      172.527     
1 1 1 28 11 24 o 2  23.5301 5.88101 13.132      9.62933  4.58286     8.04617  2.93799    79.8218     18.2859     79.8218     
1 1 1 28 11 25 o 15 84.2884 3.37889 134.049     14.8607  121.525     13.5758  40.5818    21.8253     39.0661     201.825     
1 1 1 28 11 26 o 16 147.665 3.02127 389.089     23.2156  391.567     21.4081  134.121    22.6295     54.5521     22.6295     
1 1 1 28 11 27 o 5  68.0908 3.7009  76.1528     12.5276  91.8835     12.4308  42.8531    100.938     9.64983     280.938     
1 1 1 28 11 28 o 11 41.1972 5.04155 42.0724     10.0706  22.7107     9.66437  12.4576    329.09      30.4271     149.089     
1 1 1 28 11 29 o 10 76.0174 3.02119 105.33      11.5673  102.302     11.3591  63.3435    113.231     19.8958     113.231     
1 1 1 28 11 30 o 4  103.489 2.85812 185.332     14.6014  198.755     14.9848  94.465     134.711     41.2452     134.711     
1 1 1 28 11 31 o 10 50.4323 3.89201 38.943      9.65908  54.6539     9.35902  19.4595    73.9765     30.8751     253.976     
1 1 1 28 11 32 o 13 57.1172 3.53076 58.6952     10.2888  59.7554     9.70372  45.9164    312.011     14.6032     312.011     
1 1 1 28 11 33 o 8  27.2601 5.03964 25.301      8.56257  2.04038     7.62734  6.97243    132.315     16.7765     312.315     
1 1 1 28 11 34 o 17 111.736 2.63996 231.736     14.9614  216.031     14.5599  99.2695    163.563     39.2429     163.563     
1 1 1 28 11 35 o 9  51.6404 3.58201 50.2751     9.16724  47.0664     9.12654  47.1023    270.136     30.0696     270.136     
1 1 1 28 11 36 o 12 100.296 2.66588 186.761     13.597   174.583     13.1538  80.0538    55.1305     17.7166     55.1305     
1 1 1 28 11 37 o 7  58.1572 3.47654 60.3455     10.199   62.8828     9.86062  57.4872    89.3352     45.0024     89.3352     
1 1 1 28 11 38 o 8  43.4693 4.60808 26.3403     9.25995  45.7952     9.75359  29.6087    228.218     2.77136     228.218     
1 1 1 28 11 39 o 18 72.0288 3.23688 93.4684     11.3496  94.7172     11.8938  62.205     348.798     24.9322     348.798     
1 1 1 28 11 40 o 10 29.3268 5.66331 21.7284     8.6033   11.4108     9.09255  14.3215    14.9265     3.19236     14.9265     
1 1 1 28 11 41 o 2  49.7832 4.02399 47.2421     9.34129  44.473      10.297   40.6512    85.4369     16.0864     85.4369     
1 1 1 28 11 42 o 19 33.6747 5.47967 24.2719     8.55496  19.8649     9.60464  18.2596    335.729     4.71743     155.729     
1 1 1 28 11 43 f 0  19.7388 5.59486 1.83815     8.01165  6.47984     8.93072  16.7512    112.07      0           0           
1 1 1 28 11 44 o 5  45.51   4.66009 40.44       9.75523  37.8315     10.7924  34.4736    124.967     9.54592     124.967     
1 1 1 28 11 45 o 17 20.7637 5.71401 7.89867     8.16262  2.90335     9.25955  4.09665    20.3999     12.3231     200.4       
1 1 1 28 11 46 o 9  52.6506 4.70468 35.7624     11.2301  72.1191     11.9203  31.811     76.6641     8.03552     256.664     
1 1 1 28 11 47 o 18 35.6565 5.58205 20.8683     9.22101  29.8669     10.2739  18.5893    87.143      9.13021     267.143     
1 1 1 28 11 48 o 5  21.0971 5.65059 12.1974     8.51898  -3.90654    10.0143  0.753574   117.221     23.4742     297.221     
1 1 1 28 11 49 o 15 37.624  5.5823  27.9361     9.91829  28.6296     10.4596  16.3248    36.8714     17.0412     216.871     
1 1 1 28 11 50 o 5  28.8037 6.14649 17.7634     9.20799  15.9993     10.0822  1.63814    74.4884     40.9369     74.4883     
1 1 1 28 11 51 o 5  36.7071 5.70317 27.3136     9.7797   27.3835     10.6279  18.8183    90.9662     10.0585     270.966     
1 1 1 28 11 52 o 19 21.0374 5.7356  11.753      8.79582  -1.66376    9.83438  7.08532    139.088     1.33069     319.088     
1 1 1 28 11 53 o 2  17.7985 5.47569 4.78616     8.48717  -10.1837    11.3812  0.0786799  332.818     18.1336     152.818     
1 1 1 28 11 54 o 19 21.0088 6.05029 7.23349     8.86491  3.04472     11.539   1.69354    98.0352     20.2926     278.035     
1 1 1 28 11 55 o 1  61.4077 4.37549 71.525      12.4574  73.4931     14.0589  40.6653    22.294      0.827061    202.294     
1 1 1 28 11 56 o 6  23.5862 6.56762 8.49059     10.2814  10.1439     12.5156  5.30958    163.589     15.3455     343.589     
1 1 1 28 11 57 o 1  58.069  5.09009 76.7212     13.3579  57.3911     14.8786  48.7401    218.198     22.1001     218.198     
1 1 1 28 11 58 o 11 41.2006 5.90983 42.7553     11.461   28.3066     12.0683  13.4769    347.625     26.6873     167.625     
1 1 1 28 11 59 o 4  71.1307 3.64971 91.8153     12.8176  98.327      13.0189  51.1145    41.4874     7.34952     41.4874     
1 1 1 28 11 60 o 6  17.763  5.53991 5.53558     10.7892  -8.05443    8.96485  3.11288    235.816     1.90435     55.8156     
1 1 1 28 11 61 o 16 39.5171 7.16834 31.5556     16.1628  38.9631     12.8596  26.4724    23.0331     3.88828     23.0331     
1 1 1 28 11 62 o 7  28.1846 7.1022  12.565      15.1204  20.7353     11.4219  14.4906    315.151     3.0855      135.151     
1 1 1 28 11 63 o 16 52.1963 6.39246 60.04       16.8256  58.9207     15.373   39.2212    209.935     11.9364     209.935     
1 1 1 28 11 64 o 13 29.5669 7.02404 3.52754     15.4831  32.846      13.5541  13.2153    336.196     7.40726     156.196     
1 1 1 28 11 65 f 0  20.5081 6.52804 9.61718     15.9343  -6.19292    12.1099  8.36668    13.3953     0           0           
1 1 1 28 11 66 o 9  20.9093 6.43889 -8.32245    14.9471  11.3279     12.4499  3.66816    176.434     7.64757     356.434     
1 1 1 28 11 67 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 12 0  o 17 90.8836 2.93166 147.716     13.2889  147.716     13.2889  52.0696    3.22263e-06 32.2267     180         
1 1 1 28 12 1  f 0  66.5058 3.26225 84.364      10.782   74.4861     10.7931  36.4305    277.598     0           0           
1 1 1 28 12 2  o 2  78.6161 3.14102 106.064     11.972   115.321     12.6804  55.1666    71.3618     0.863395    71.3619     
1 1 1 28 12 3  o 16 47.5512 4.34041 34.5556     10.2089  48.5565     9.56839  24.7042    123.395     0.518957    303.395     
1 1 1 28 12 4  o 9  73.3357 3.16369 102.846     11.7462  90.0612     11.3789  42.8281    214.362     16.615      34.3623     
1 1 1 28 12 5  o 17 46.6306 4.55634 42.5045     9.59216  37.2303     10.9277  7.96223    268.367     44.7928     88.367      
1 1 1 28 12 6  o 18 137.058 2.72644 347.415     19.0119  322.753     18.4026  94.6848    28.0986     11.9245     208.099     
1 1 1 28 12 7  o 5  125.1   2.70526 298.924     17.6209  259.971     16.2648  61.2482    75.3983     61.3602     255.398     
1 1 1 28 12 8  o 6  38.2725 4.75215 29.5228     8.87688  24.8575     8.66961  1.99611    207.04      51.1127     207.04      
1 1 1 28 12 9  o 10 69.3779 3.38338 98.1186     11.6068  75.5201     11.6099  14.6377    115.599     69.2486     295.599     
1 1 1 28 12 10 o 1  123.37  2.68887 271.906     16.4039  271.087     16.8017  99.2769    194.248     19.4458     194.248     
1 1 1 28 12 11 f 0  126.37  2.59543 279.736     16.6468  289.794     16.1757  67.1688    128.718     0           0           
1 1 1 28 12 12 o 11 130.507 2.47542 303.179     15.9573  303.894     16.3907  92.4335    350.965     5.77662     170.965     
1 1 1 28 12 13 o 4  87.0234 2.86998 133.877     12.7305  136.949     12.2203  75.2917    26.6596     30.5517     26.6596     
1 1 1 28 12 14 o 8  94.3165 2.66589 150.126     12.2692  167.79      12.8782  62.9599    216.629     8.80902     36.6286     
1 1 1 28 12 15 o 4  94.7257 2.6363  163.465     12.3255  156.978     12.6424  51.7189    91.426      32.7474     271.426     
1 1 1 28 12 16 o 9  51.5357 3.4748  48.0023     8.86582  47.9719     8.86566  31.2168    232.796     1.78813     232.796     
1 1 1 28 12 17 o 9  54.4657 3.39239 56.5421     9.12038  50.5709     9.18036  36.0399    131.165     5.18574     131.165     
1 1 1 28 12 18 o 12 74.7219 2.95912 101.618     11.2876  98.4924     10.7854  49.623     116.756     4.98485     296.756     
1 1 1 28 12 19 o 17 24.8105 5.7562  12.4127     8.64779  9.38354     7.91637  10.1192    47.7995     44.6929     47.7995     
1 1 1 28 12 20 o 2  131.467 2.90761 307.171     19.8647  311.074     18.3597  130.415    170.078     71.0941     170.078     
1 1 1 28 12 21 o 7  63.6215 3.57877 73.1094     11.851   73.1016     10.7506  34.4403    331.689     19.9458     151.689     
1 1 1 28 12 22 o 5  151.912 2.89406 409.33      21.7143  416.361     22.3101  123.755    131.281     25.2363     131.281     
1 1 1 28 12 23 o 17 79.9206 3.41726 113.795     14.5127  116.281     12.6377  56.9092    295.37      0.249165    115.37      
1 1 1 28 12 24 f 0  18.0966 5.33396 -0.429719   7.71203  3.40062     8.42724  21.2188    153.2       0           0           
1 1 1 28 12 25 o 17 147.366 2.67653 386.335     19.4452  390.307     20.053   122.441    199.231     29.5996     199.231     
1 1 1 28 12 26 o 9  150.112 2.75492 387.683     20.6851  418.994     20.7214  110.603    219.941     1.85539     219.941     
1 1 1 28 12 27 o 4  46.5195 4.04014 40.6374     9.05949  38.7865     9.36486  21.7663    236.401     20.2594     56.4014     
1 1 1 28 12 28 o 8  52.6044 3.65867 47.7582     9.09552  53.0761     9.95134  36.5023    148.928     1.09184     148.928     
1 1 1 28 12 29 o 6  71.1638 2.99152 92.186      10.5286  90.1955     10.7085  35.2588    341.439     31.1324     161.439     
1 1 1 28 12 30 o 5  33.092  5.00789 24.8407     8.09649  17.0462     8.05415  17.799     216.889     2.67962     36.8889     
1 1 1 28 12 31 o 2  54.101  3.55233 58.333      9.618    48.5124     9.37501  34.8812    202.466     4.90805     22.4659     
1 1 1 28 12 32 o 11 103.282 2.82824 193.211     14.6289  190.316     14.5926  89.3971    338.844     30.9542     338.844     
1 1 1 28 12 33 o 8  37.5321 4.84998 27.8531     8.75881  25.5286     8.80616  12.3583    263.185     25.2941     83.1848     
1 1 1 28 12 34 o 3  32.5074 5.43932 15.7482     8.57919  25.4026     9.04561  18.8223    308.457     1.96178     308.457     
1 1 1 28 12 35 o 4  73.2213 3.07674 101.31      11.424   92.7158     11.0504  58.7784    146.004     14.8149     146.004     
1 1 1 28 12 36 o 11 78.8826 2.97424 121.141     11.7991  103.979     11.5917  54.3505    268.052     2.93142     88.0515     
1 1 1 28 12 37 o 6  84.8321 2.92959 137.13      12.5408  122.949     12.2771  66.0432    317.709     12.1776     317.709     
1 1 1 28 12 38 o 9  40.1712 4.62131 32.1813     9.12258  28.8105     8.83918  30.0624    63.4135     10.0732     63.4135     
1 1 1 28 12 39 o 3  16.6541 5.04861 -2.41187    7.64014  2.29903     7.61285  2.31539    115.736     17.4569     115.736     
1 1 1 28 12 40 o 5  79.5659 3.06563 114.689     12.6435  114.767     11.6904  75.8126    288.367     41.2306     288.367     
1 1 1 28 12 41 o 14 23.1163 5.79807 13.7413     8.74106  2.94474     9.08619  7.04655    285.781     2.32007     105.781     
1 1 1 28 12 42 o 5  29.7452 5.89271 21.9819     9.16473  12.6653     9.59155  16.4252    142.575     1.58151     322.575     
1 1 1 28 12 43 o 14 102.407 3.00467 167.984     15.3359  213.679     15.2471  78.2542    258.801     12.1178     258.801     
1 1 1 28 12 44 f 0  24.2045 5.94372 11.6003     8.30433  9.54607     9.43335  20.6629    250.667     0           0           
1 1 1 28 12 45 o 7  16.4668 5.10632 2.46008     7.80634  -7.13448    9.06028  1.95533    75.6408     20.8433     75.6408     
1 1 1 28 12 46 o 11 15.685  5.0252  -1.30017    7.84653  -6.81432    9.41762  0.518445   57.9149     11.0873     237.915     
1 1 1 28 12 47 o 15 59.4039 3.92734 56.9529     10.927   75.7854     12.1351  40.5752    260.881     0.469565    80.8811     
1 1 1 28 12 48 o 12 29.3707 6.13613 19.5262     8.96256  15.5472     10.6258  18.8871    111.718     3.82048     111.718     
1 1 1 28 12 49 o 7  69.9368 3.62703 89.5524     11.7145  92.6357     13.4857  53.1239    144.071     10.1002     144.071     
1 1 1 28 12 50 o 16 110.865 3.03848 217.206     15.7498  234.089     17.9381  94.8542    12.9306     35.9422     12.9306     
1 1 1 28 12 51 o 2  23.8731 6.12716 14.0041     8.99816  5.62573     10.8194  4.12494    256.622     20.6152     76.6221     
1 1 1 28 12 52 o 7  31.8443 6.19112 21.6241     9.42304  21.1669     11.0086  15.3294    326.342     9.14374     146.342     
1 1 1 28 12 53 o 17 28.5395 6.37045 16.1565     9.49207  18.2515     10.8888  9.01392    237.116     17.0793     57.1163     
1 1 1 28 12 54 o 9  65.2868 3.92847 75.1598     11.8608  86.8043     13.6165  50.2441    236.76      12.8951     236.76      
1 1 1 28 12 55 o 14 19.1719 5.73716 5.04006     8.90462  -0.0765076  10.4356  1.98591    254.893     13.9705     74.8931     
1 1 1 28 12 56 o 7  18.372  5.5929  -9.68299    9.22932  8.32498     10.6294  2.38995    46.4724     11.6804     226.472     
1 1 1 28 12 57 o 14 57.469  4.72704 65.6818     14.3424  63.5982     12.2889  46.4378    119.993     17.1279     119.993     
1 1 1 28 12 58 o 13 39.6817 6.83323 40.9826     14.7954  28.6963     12.2232  23.5842    206.517     3.58275     26.5167     
1 1 1 28 12 59 o 3  67.7858 5.07031 81.1886     17.296   102.344     16.1233  69.278     8.97776     50.7236     8.97776     
1 1 1 28 12 60 o 16 37.6267 7.4189  29.6427     15.8406  36.4433     13.6363  24.5504    188.963     2.58834     188.963     
1 1 1 28 12 61 o 12 84.8046 4.54678 139.994     19.8519  143.744     18.4355  72.1497    252.911     31.5362     252.911     
1 1 1 28 12 62 o 16 26.1065 7.29363 17.9867     15.2087  11.4106     13.0024  12.4841    93.2889     0.265752    273.289     
1 1 1 28 12 63 o 1  32.4203 8.12567 39.3468     19.4695  18.486      13.744   19.0196    123.997     8.83475     123.997     
1 1 1 28 12 64 o 12 16.9891 5.69376 -6.9229     14.481   -7.77938    11.1618  0.484395   288.662     4.16365     108.662     
1 1 1 28 12 65 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 12 66 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 13 0  o 15 26.2258 6.91776 16.6081     8.46321  16.6081     8.46321  0.3944     8.72654e-06 4.34079     8.72654e-06 
1 1 1 28 13 1  o 13 110.826 2.7161  229.362     14.6852  209.49      15.375   95.5397    149.41      31.1726     149.41      
1 1 1 28 13 2  o 19 129.736 2.77764 310.782     17.555   290.486     18.4622  108.609    257.974     27.4837     257.974     
1 1 1 28 13 3  o 16 17.7202 5.22514 5.15115     8.10885  -5.18838    8.11122  24.4313    81.863      62.2381     81.863      
1 1 1 28 13 4  o 10 65.316  3.30852 77.0937     10.9014  76.3355     10.6136  34.119     287.288     25.8791     287.288     
1 1 1 28 13 5  o 10 82.54   3.0303  131.788     13.0582  112.661     11.9303  43.0704    67.3463     32.1245     247.346     
1 1 1 28 13 6  o 19 61.5093 3.446   62.7694     10.6448  73.7952     10.3363  38.5441    264.856     5.14122     84.8562     
1 1 1 28 13 7  o 19 68.8618 3.22235 82.1574     10.486   88.2623     11.6295  43.6225    343.072     7.9081      163.072     
1 1 1 28 13 8  o 17 76.5954 2.99954 95.4592     11.2122  115.269     11.6859  43.528     253.523     21.651      73.5226     
1 1 1 28 13 9  o 13 122.921 2.7359  279.135     16.3904  260.729     17.2193  90.9257    3.07937     1.83178     3.07938     
1 1 1 28 13 10 o 9  49.3381 3.91692 43.1449     9.13011  45.437      9.90388  21.8082    233.579     20.8333     53.5792     
1 1 1 28 13 11 o 11 98.8673 2.8515  174.448     13.7368  175.226     14.4523  76.2223    199.9       9.78589     199.9       
1 1 1 28 13 12 o 19 67.4836 3.27998 86.4739     10.9055  77.4798     11.104   47.3004    124.47      1.336       124.47      
1 1 1 28 13 13 o 6  20.3496 5.60199 2.77099     8.92059  6.45971     7.72023  17.7685    140.82      54.9359     140.82      
1 1 1 28 13 14 o 8  33.0952 5.57123 19.356      9.26339  22.2243     8.97176  0.652057   186.194     42.1012     186.194     
1 1 1 28 13 15 o 14 149.215 3.14401 411.163     23.7341  386.882     23.2303  130.681    310.394     41.7197     310.394     
1 1 1 28 13 16 o 17 126.447 3.06086 290.701     20.1007  282.262     18.6236  114.85     17.4712     44.8331     17.4712     
1 1 1 28 13 17 o 18 151.204 3.12114 439.468     23.697   381.09      23.4757  148.143    233.474     74.1632     233.474     
1 1 1 28 13 18 o 15 154.293 3.15918 413.799     24.5097  440.232     24.2673  125.235    303.302     22.8025     303.302     
1 1 1 28 13 19 o 9  153.302 3.02892 424.985     23.6902  417.356     22.802   132.59     167.247     39.1716     167.247     
1 1 1 28 13 20 o 5  81.1087 3.22359 116.055     11.5703  120.714     14.4154  59.9566    23.6274     2.73175     23.6274     
1 1 1 28 13 21 o 12 21.4161 5.51184 8.7336      7.6059   5.14765     7.86663  1.74406    55.3522     8.34156     235.352     
1 1 1 28 13 22 o 2  140.931 2.80222 361.825     20.5114  349.764     19.0239  123.942    329.405     41.0915     329.405     
1 1 1 28 13 23 o 9  73.3491 3.04529 105.514     11.4064  88.5252     10.8577  66.3282    162.319     29.0011     162.319     
1 1 1 28 13 24 o 19 93.8012 2.96924 165.32      13.905   151.084     13.9168  66.5588    320.399     3.06506     140.399     
1 1 1 28 13 25 o 3  96.5157 2.87747 169.058     13.968   165.596     13.8052  98.6381    2.10049     59.1913     2.10049     
1 1 1 28 13 26 o 16 157.567 2.64536 453.107     21.7203  436.074     20.0492  125.464    74.7099     20.0857     74.7099     
1 1 1 28 13 27 o 18 56.1851 3.5948  61.2345     9.84634  53.8847     10.1181  35.0493    14.2184     8.6712      194.218     
1 1 1 28 13 28 o 1  17.2952 5.01265 6.31967     7.37112  -6.07073    7.73097  0.277202   202.317     3.9552      202.317     
1 1 1 28 13 29 o 5  81.9286 2.87678 120.955     11.9224  120.833     11.6247  57.877     47.2708     1.8522      227.271     
1 1 1 28 13 30 o 15 49.1179 3.89684 45.3473     9.51745  43.4535     9.33575  22.6129    30.5546     23.2004     210.555     
1 1 1 28 13 31 o 1  83.5722 2.96318 130.404     12.3341  121.735     12.3931  82.0182    229.378     46.0291     229.378     
1 1 1 28 13 32 o 4  119.173 2.7423  269.098     15.6792  242.13      16.9045  89.7889    109.697     7.2379      109.697     
1 1 1 28 13 33 o 6  40.8568 4.44502 33.4019     8.76728  29.3098     8.81759  23.7841    105.991     6.86086     285.991     
1 1 1 28 13 34 o 11 44.6352 4.26733 38.8208     9.33574  35.5322     9.25259  23.0597    155.121     14.8763     335.121     
1 1 1 28 13 35 o 15 37.5401 5.02225 25.9601     9.30393  28.0219     8.88574  20.8556    55.2406     7.31651     235.241     
1 1 1 28 13 36 o 15 47.9743 4.10527 41.4559     9.24526  44.0559     10.0925  44.1434    84.3967     28.1831     84.3967     
1 1 1 28 13 37 o 16 66.6878 3.31792 85.8737     10.7578  76.3036     11.209   52.3847    242.973     11.5304     242.973     
1 1 1 28 13 38 o 13 34.96   5.2523  27.7587     8.75938  19.8668     9.10109  11.3483    319.527     23.7878     139.527     
1 1 1 28 13 39 o 3  93.8522 2.89011 171.629     13.1696  147.492     13.8267  81.672     113.448     30.3751     113.448     
1 1 1 28 13 40 o 10 88.005  2.934   141.332     12.6115  139.375     13.1834  71.4951    141.597     18.5046     141.597     
1 1 1 28 13 41 o 6  26.2236 5.71662 17.3462     8.42758  8.9139      8.61753  8.92911    99.802      14.4338     279.802     
1 1 1 28 13 42 f 0  22.7492 5.81579 10.5079     8.63726  7.24657     8.46748  10.6319    145.558     0           0           
1 1 1 28 13 43 o 1  76.9926 3.42801 113.759     12.6967  104.247     13.5421  55.5774    89.9695     2.97025     89.9695     
1 1 1 28 13 44 o 13 23.9292 6.06231 12.3962     8.83492  7.79534     9.91347  4.50607    351.968     20.6231     171.968     
1 1 1 28 13 45 o 10 21.5848 5.95891 7.24756     8.82691  6.44688     9.84119  6.4178     130.849     11.3323     310.849     
1 1 1 28 13 46 o 18 75.5689 3.50038 110.146     12.7162  101.614     13.5733  61.4767    85.3381     17.8033     85.3381     
1 1 1 28 13 47 o 1  42.5225 5.9148  34.1583     11.7639  39.8252     12.5554  17.3242    4.21722     22.985      184.217     
1 1 1 28 13 48 o 2  63.8676 3.92322 80.5361     11.5433  73.4493     13.1312  57.524     308.238     28.0732     308.238     
1 1 1 28 13 49 o 16 24.3967 6.19713 8.85921     8.84977  14.0866     10.4913  10.177     352.746     7.22725     172.746     
1 1 1 28 13 50 o 10 60.4133 4.21461 76.0123     11.2887  63.7325     13.4082  51.2674    207.958     20.988      207.958     
1 1 1 28 13 51 o 13 47.6538 4.95384 40.4366     10.587   49.7414     12.3928  24.3429    128.15      15.3377     308.15      
1 1 1 28 13 52 o 9  47.588  5.24955 45.6175     11.5336  45.3691     12.6454  37.9005    111.597     14.1687     111.597     
1 1 1 28 13 53 o 12 21.715  6.22582 6.54098     10.4261  6.83647     10.6814  6.55036    359.924     4.09236     179.924     
1 1 1 28 13 54 o 9  44.5613 5.68903 34.3546     11.8667  47.8292     12.5361  28.3663    82.4097     1.50212     262.41      
1 1 1 28 13 55 o 17 23.6508 6.39042 13.1944     11.2242  6.8636      10.013   8.9922     253.806     8.12152     73.8063     
1 1 1 28 13 56 o 13 48.1202 6.27313 45.6828     13.4004  52.2563     15.7434  34.3978    33.2148     5.62973     33.2148     
1 1 1 28 13 57 f 0  38.6987 6.39338 29.5567     12.4005  35.3731     12.0062  17.8819    218.74      0           0           
1 1 1 28 13 58 o 13 33.8289 6.75796 22.8376     12.8167  28.5913     11.4108  24.7012    285.112     9.90779     285.112     
1 1 1 28 13 59 o 4  18.8173 6.00123 4.66586     13.7667  -5.53485    9.81456  4.60969    33.3216     2.15394     213.322     
1 1 1 28 13 60 o 5  36.1845 7.07978 25.1114     15.9256  36.5295     12.017   12.4933    45.6385     9.78049     45.6385     
1 1 1 28 13 61 o 16 17.7719 5.8023  -8.42005    14.2717  -0.406809   10.3827  1.90019    155.086     3.95103     335.086     
1 1 1 28 13 62 o 5  24.8849 7.45246 12.7644     19.2116  12.0138     13.3042  9.21245    67.9401     3.26077     247.94      
1 1 1 28 13 63 o 17 24.8421 7.48344 9.39313     18.8536  14.6221     14.6234  5.69511    78.1385     0.0235639   78.1385     
1 1 1 28 13 64 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 14 0  o 10 63.9304 3.77278 74.4477     11.8866  74.4477     11.8866  43.6316    360         8.98872     180         
1 1 1 28 14 1  o 2  62.3055 3.66983 72.2677     11.7098  68.2168     11.0018  40.2865    212.477     6.82862     32.4774     
1 1 1 28 14 2  o 8  54.6924 4.27471 46.5155     11.3714  63.4223     11.4073  29.0658    86.6372     17.6855     266.637     
1 1 1 28 14 3  o 3  53.0208 4.20433 51.4256     10.3917  51.2665     11.5254  23.7293    115.072     26.3574     295.072     
1 1 1 28 14 4  o 5  15.5442 4.93035 -5.65091    8.72913  -1.63552    7.32224  19.2584    16.132      51.1985     16.132      
1 1 1 28 14 5  o 2  42.2661 4.62617 29.3879     9.71237  36.9821     9.06307  23.2664    23.1929     6.56643     203.193     
1 1 1 28 14 6  o 18 140.292 2.7689  350.833     19.1204  352.998     19.7718  109.186    97.6086     9.99204     97.6086     
1 1 1 28 14 7  o 3  25.4693 5.80317 8.90816     8.80663  14.1045     8.30035  8.04143    273.862     46.0931     273.862     
1 1 1 28 14 8  o 2  48.5046 4.22483 48.5847     10.2568  37.9706     9.7658   22.5628    112.384     21.8243     292.384     
1 1 1 28 14 9  o 12 62.6862 3.52954 74.9643     11.1901  67.2089     10.7948  32.0414    192.131     25.8913     12.1314     
1 1 1 28 14 10 o 2  49.1377 4.30208 40.9375     10.8721  47.8005     9.62521  36.9519    114.673     8.94894     114.673     
1 1 1 28 14 11 o 10 87.0136 3.35155 130.449     15.0683  142.259     13.9535  53.3071    277.82      21.1102     97.8204     
1 1 1 28 14 12 o 3  20.5545 5.6193  8.35886     8.6685   1.47105     8.13364  0.756457   16.6393     18.024      16.6393     
1 1 1 28 14 13 o 14 136.067 2.89342 338.821     20.5125  324.566     18.8964  121.966    51.2513     42.3842     51.2513     
1 1 1 28 14 14 o 3  26.9465 5.79826 16.0602     8.58908  10.8398     8.66013  5.14622    27.3051     20.9565     207.305     
1 1 1 28 14 15 o 5  18.2751 5.2037  -4.89958    7.78258  7.46602     7.99919  11.2773    281.059     42.2307     281.059     
1 1 1 28 14 16 o 9  190.507 2.729   661.282     26.5824  637.477     25.5276  150.134    165.311     16.7687     165.311     
1 1 1 28 14 17 o 6  59.3278 3.48146 68.1653     10.3378  59.5676     10.1503  47.4963    26.4466     11.6963     26.4466     
1 1 1 28 14 18 o 19 109.261 2.7353  219.238     15.3124  208.782     14.5969  97.4178    110.227     34.6467     110.227     
1 1 1 28 14 19 o 7  82.1084 3.08639 117.976     12.4797  124.886     12.8286  78.43      12.3539     39.0589     12.3539     
1 1 1 28 14 20 o 11 52.1049 3.72447 54.9398     9.53534  44.4385     9.54464  40.7956    158.155     10.046      158.155     
1 1 1 28 14 21 o 6  30.0125 5.70345 21.4466     8.88834  13.1363     8.94284  14.5754    346.596     0.624044    166.596     
1 1 1 28 14 22 o 3  85.658  3.09452 130.709     13.1511  133.877     13.3286  48.9544    116.543     27.122      296.543     
1 1 1 28 14 23 f 0  61.0304 3.59273 68.3007     10.58    67.3268     11.1819  28.7475    59.4352     0           0           
1 1 1 28 14 24 o 15 47.2801 4.55837 50.1981     9.485    33.8276     10.8012  32.885     182.43      1.33967     182.43      
1 1 1 28 14 25 o 9  33.3412 5.54191 24.264      8.58607  18.6972     9.71361  10.9159    228.459     21.883      48.4586     
1 1 1 28 14 26 o 1  72.1647 3.34114 98.9146     11.7998  90.181      12.1883  36.5734    256.098     31.1598     76.0977     
1 1 1 28 14 27 o 9  41.5193 4.87346 39.3927     9.73074  26.407      9.61983  19.0983    236.548     18.622      56.5476     
1 1 1 28 14 28 o 5  96.8855 3.15328 181.144     14.7283  158.761     15.6733  75.4929    293.13      10.537      293.13      
1 1 1 28 14 29 o 16 103.471 2.90762 190.166     14.5517  196.055     15.5379  88.6157    175.667     27.3841     175.667     
1 1 1 28 14 30 o 7  28.2568 5.77641 18.2745     8.49948  12.4703     9.03772  10.3342    290.142     13.3812     110.142     
1 1 1 28 14 31 o 10 53.8026 3.98179 48.7484     10.091   58.3993     11.0609  38.3121    149.509     1.76552     149.509     
1 1 1 28 14 32 o 17 55.5782 3.82743 58.1016     10.2725  55.6577     10.7536  22.9168    170.882     32.9882     350.882     
1 1 1 28 14 33 o 13 60.4971 3.61888 64.6478     10.5411  69.5571     11.1996  48.3363    341.443     12.1006     341.443     
1 1 1 28 14 34 o 11 43.5582 4.93133 50.3468     9.63055  23.967      10.1538  34.6455    298.749     12.3694     298.749     
1 1 1 28 14 35 o 19 73.8115 3.2213  98.6152     11.2785  99.6618     12.4116  58.2241    166.03      11.7212     166.03      
1 1 1 28 14 36 o 13 19.0315 5.44997 5.75149     7.91799  0.734776    8.50976  2.27668    288.86      12.5452     108.86      
1 1 1 28 14 37 o 9  41.3127 4.85604 31.1475     9.19352  34.225      10.2124  28.9805    176.102     2.7626      176.102     
1 1 1 28 14 38 o 17 62.4168 3.62666 70.167      10.7315  73.4098     11.75    58.5588    275.349     30.6497     275.349     
1 1 1 28 14 39 o 19 68.459  3.56523 96.2452     11.9781  76.8936     12.1546  47.8361    302.718     1.17717     122.719     
1 1 1 28 14 40 o 7  24.2611 5.92003 11.938      8.64953  9.87536     8.87329  12.2322    124.507     1.17492     124.507     
1 1 1 28 14 41 o 10 18.7897 5.45247 7.58253     8.48872  -4.13398    9.0058   0.872985   8.07914     19.5507     188.079     
1 1 1 28 14 42 o 12 35.3928 5.52917 26.12       9.36552  24.1855     9.72864  25.524     60.8108     5.53501     60.8108     
1 1 1 28 14 43 o 6  63.1225 3.67134 78.5888     11.0529  70.0441     11.858   47.8493    229.083     7.56631     229.083     
1 1 1 28 14 44 o 14 33.8861 5.69496 28.294      9.33939  18.7486     9.94346  16.2718    314.137     12.2931     134.137     
1 1 1 28 14 45 o 2  56.5267 4.34689 58.4176     11.0711  64.0329     13.1309  35.8684    308.907     6.58383     128.907     
1 1 1 28 14 46 o 12 36.4274 5.77283 25.5207     9.63096  29.3136     10.9317  18.2729    205.004     11.765      25.0042     
1 1 1 28 14 47 o 2  24.5571 6.11178 17.5398     9.574    3.01152     10.8885  2.17595    61.3288     26.6436     241.329     
1 1 1 28 14 48 o 19 30.4779 6.21299 13.0073     9.86949  26.6241     10.8228  15.6047    175.346     6.70861     355.346     
1 1 1 28 14 49 o 11 32.6241 6.31771 20.6827     10.1587  25.0864     11.1284  22.252     123.996     12.8046     123.996     
1 1 1 28 14 50 f 0  34.0281 6.55197 25.6517     11.6924  24.788      11.2516  10.3452    92.5415     0           0           
1 1 1 28 14 51 o 5  25.0813 6.52781 16.8286     10.7223  6.14986     11.8741  11.3783    69.4698     0.601418    249.47      
1 1 1 28 14 52 o 18 56.3816 4.90975 65.4084     12.6137  60.3768     14.3179  37.4587    236.721     1.29525     56.7208     
1 1 1 28 14 53 o 4  45.4813 5.582   35.1931     12.2683  49.9761     11.9926  36.0749    60.6326     12.9516     60.6326     
1 1 1 28 14 54 o 6  38.7835 6.21224 29.5448     12.0824  34.6873     11.5395  17.3368    271.669     16.5247     91.6692     
1 1 1 28 14 55 o 12 35.7421 6.40967 20.697      12.141   35.3212     11.5049  26.3327    303.609     8.55785     303.609     
1 1 1 28 14 56 o 3  22.4824 6.55771 10.6115     11.369   2.75708     13.1775  4.09934    169.776     18.4182     349.776     
1 1 1 28 14 57 o 5  18.1116 5.62508 -13.6594    11.5137  7.06264     10.1756  4.58979    101.03      5.39674     281.03      
1 1 1 28 14 58 o 14 31.2102 7.30964 28.7705     15.0008  18.8822     11.6616  17.9049    204.577     1.01374     24.5773     
1 1 1 28 14 59 o 4  37.8129 7.50364 41.9625     16.2949  30.0183     13.362   25.7158    7.27173     5.84659     7.27173     
1 1 1 28 14 60 o 9  17.0759 5.6661  -11.3858    13.9976  -2.44249    11.0342  1.05501    51.7722     5.99669     231.772     
1 1 1 28 14 61 o 7  20.6128 6.54684 -5.04656    15.4901  7.57293     13.5803  3.43099    117.033     4.10146     297.033     
1 1 1 28 14 62 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 15 0  o 15 25.1255 7.26439 15.9988     9.00586  15.9988     9.00586  7.91279    9.27956e-05 4.73811     180         
1 1 1 28 15 1  o 3  46.9163 4.36995 38.7629     10.1525  42.4793     9.85536  28.607     264.813     8.07979     84.8129     
1 1 1 28 15 2  o 16 45.2962 4.49237 34.5007     9.94154  41.6055     9.79319  38.3359    300.302     23.2419     300.302     
1 1 1 28 15 3  o 15 26.5997 5.83371 17.5371     9.03985  8.35785     8.63186  7.7815     131.592     1.98888     311.592     
1 1 1 28 15 4  o 16 97.5429 3.167   161.724     15.2549  180.869     15.605   73.1711    250.244     1.86156     250.244     
1 1 1 28 15 5  f 0  102.12  3.13811 191.337     16.8244  183.778     15.2034  76.9829    284.736     0           0           
1 1 1 28 15 6  o 10 21.9221 6.09479 6.09567     9.39656  5.21583     10.2359  5.84155    22.829      37.2502     22.829      
1 1 1 28 15 7  f 0  52.6511 4.49146 47.3811     11.5963  55.0087     11.5572  33.2921    90.3205     0           0           
1 1 1 28 15 8  o 9  86.1019 3.22429 128.96      13.5339  138.304     14.1945  69.838     276.667     13.2715     276.667     
1 1 1 28 15 9  o 2  53.4154 3.89306 56.6815     10.6132  47.7734     9.91786  38.6587    302.963     2.15954     302.963     
1 1 1 28 15 10 o 5  80.0336 3.3164  121.094     14.187   110.319     12.2964  70.6371    168.099     24.8788     168.099     
1 1 1 28 15 11 o 13 54.0473 3.67416 50.0958     9.58206  56.4391     10.0714  37.8516    38.0129     0.714205    218.013     
1 1 1 28 15 12 o 4  106.514 2.62973 211.821     13.811   194.952     14.1828  111.976    15.288      67.9176     15.288      
1 1 1 28 15 13 o 1  63.0881 3.36269 77.0762     10.4152  67.2846     10.6316  36.9615    182.321     17.5213     2.32118     
1 1 1 28 15 14 o 11 53.5151 3.65826 41.5849     9.22962  64.0717     9.88746  25.7642    252.314     25.2476     72.3135     
1 1 1 28 15 15 o 5  19.0787 5.29402 2.42281     7.39489  5.85344     7.49102  0.162683   294.198     11.7378     114.198     
1 1 1 28 15 16 o 12 18.584  5.27559 1.27981     7.51943  5.16177     7.61192  0.758609   174.676     14.598      174.676     
1 1 1 28 15 17 o 15 59.9011 3.39931 57.7318     9.88752  73.0552     10.2758  42.5402    140.512     0.572928    320.512     
1 1 1 28 15 18 o 4  103.587 2.75865 195.565     14.1951  190.101     14.3892  64.1411    335.166     24.7749     155.166     
1 1 1 28 15 19 o 17 26.3308 5.48602 16.6998     7.92022  9.46576     7.88517  7.7298     109.602     50.4208     109.602     
1 1 1 28 15 20 o 9  33.5417 5.25346 23.7082     8.75585  19.6618     8.45704  21.3474    6.7834      7.42268     6.78339     
1 1 1 28 15 21 o 7  23.9548 5.37875 16.2579     7.91634  3.57243     7.80518  4.02286    156.17      19.0429     336.17      
1 1 1 28 15 22 o 6  92.0806 2.85318 157.821     13.337   147.846     12.9308  68.7957    255.344     2.84764     255.344     
1 1 1 28 15 23 o 6  42.0677 4.48536 36.0511     9.08079  30.4364     9.17718  31.7319    198.144     8.05652     198.144     
1 1 1 28 15 24 o 12 52.8101 4.07237 65.3031     9.82127  39.3172     10.4976  49.7867    39.4149     28.8952     39.4149     
1 1 1 28 15 25 o 15 37.3483 4.83267 27.9594     8.54625  25.1835     8.85647  22.6076    35.6929     4.00376     215.693     
1 1 1 28 15 26 o 17 53.6468 3.83921 53.9116     9.99802  52.1        10.3468  33.9924    144.403     7.89502     324.403     
1 1 1 28 15 27 o 4  43.7377 4.25395 35.6086     9.03742  35.8741     9.11738  18.0718    62.5522     25.0733     242.552     
1 1 1 28 15 28 o 16 35.2918 5.40702 19.4209     9.48147  29.2451     9.16231  8.11505    162.812     32.0256     342.812     
1 1 1 28 15 29 o 4  58.2044 3.57532 67.0339     10.3527  57.3306     10.2498  39.0363    331.596     4.53969     151.596     
1 1 1 28 15 30 o 16 31.7129 5.48637 24.6793     8.77245  14.8537     8.79101  16.6735    79.424      6.5554      259.424     
1 1 1 28 15 31 o 18 58.0647 3.6148  68.5803     10.4774  55.6094     10.2658  38.924     355.118     4.40652     175.118     
1 1 1 28 15 32 f 0  33.9901 5.59615 25.3711     9.48083  20.1843     9.26895  18.9742    308.643     0           0           
1 1 1 28 15 33 o 19 82.8835 3.0812  129.301     13.2475  120.407     12.2627  54.9901    70.8831     9.57614     250.883     
1 1 1 28 15 34 o 12 59.7275 3.62475 69.2258     10.9259  62.2809     10.5558  52.4505    64.0504     21.2441     64.0504     
1 1 1 28 15 35 o 3  76.2842 3.1772  110.22      12.298   102.211     11.8857  51.6826    329.978     6.12578     149.978     
1 1 1 28 15 36 o 4  15.7081 4.98027 -1.79712    8.32331  -3.38379    7.9051   0.368335   111.801     1.04588     291.801     
1 1 1 28 15 37 o 19 34.5659 5.44342 20.1583     9.28158  27.4904     9.15477  18.8081    150.612     8.6674      330.612     
1 1 1 28 15 38 o 9  22.3521 5.81955 6.46426     8.70957  10.3342     8.59282  4.0267     253.772     19.501      73.7722     
1 1 1 28 15 39 o 16 68.3597 3.48843 84.3626     11.8427  88.6107     11.8928  50.8988    27.8935     4.85894     27.8935     
1 1 1 28 15 40 o 11 30.2667 6.03189 20.1319     9.72457  17.6118     9.37221  17.7789    284.902     2.94555     104.902     
1 1 1 28 15 41 o 6  27.4008 6.03141 15.8817     9.19722  14.7603     9.13968  17.7043    41.5466     6.48747     41.5466     
1 1 1 28 15 42 f 0  16.7546 5.12436 4.92931     8.38872  -7.66571    8.3604   3.47304    345.238     0           0           
1 1 1 28 15 43 o 1  63.6284 3.72984 74.0148     11.8283  78.1853     11.7327  53.6654    106.691     18.6919     106.691     
1 1 1 28 15 44 o 12 42.2578 4.96865 34.0797     10.2135  36.827      10.0749  34.9449    146.993     14.3053     146.993     
1 1 1 28 15 45 o 18 24.0357 6.0038  7.26343     9.46072  14.525      9.06495  5.9811     228.92      17.4884     48.9202     
1 1 1 28 15 46 o 17 22.4078 5.94756 15.8293     10.35    -0.237398   9.12779  1.78126    348.332     23.7079     168.332     
1 1 1 28 15 47 o 7  36.3638 6.72516 24.6848     11.4159  33.6975     13.4396  21.2925    215.425     4.24639     35.4247     
1 1 1 28 15 48 o 14 23.1506 6.55612 12.4409     11.0339  2.48531     13.02    2.08601    19.2381     23.4425     199.238     
1 1 1 28 15 49 o 14 96.0942 3.80502 162.033     17.2509  187.807     19.2687  89.4004    285.694     45.396      285.694     
1 1 1 28 15 50 o 18 37.8459 6.93141 24.12       12.7124  40.355      14.2068  27.8379    339.698     8.32354     339.698     
1 1 1 28 15 51 o 3  45.5902 5.84179 40.4027     13.0839  45.9812     12.5693  37.594     168.768     15.5526     168.768     
1 1 1 28 15 52 o 5  25.4092 6.20285 -2.49986    12.0168  22.6203     10.8278  4.30391    29.9462     23.6074     209.946     
1 1 1 28 15 53 o 5  17.5246 5.62855 -0.960102   11.4241  -4.32831    10.0377  3.18579    94.5874     1.73546     274.587     
1 1 1 28 15 54 o 3  30.0766 6.85439 21.9221     11.8569  19.1207     11.6693  17.3644    87.0961     1.91371     267.096     
1 1 1 28 15 55 o 5  34.2985 7.03746 29.981      13.0659  25.172      12.5949  24.5173    301.827     7.41786     301.827     
1 1 1 28 15 56 o 4  62.4877 5.87971 88.9009     18.3787  78.7575     17.5187  52.2993    19.2001     21.2635     19.2001     
1 1 1 28 15 57 o 4  29.345  7.68627 30.684      17.1336  13.8713     13.1247  16.9644    193.5       4.22917     193.5       
1 1 1 28 15 58 o 2  20.5262 6.54476 -3.14649    17.427   4.88984     11.9239  1.08819    358.505     0.42448     178.505     
1 1 1 28 15 59 o 15 24.8406 7.31878 11.3145     18.3126  14.4679     12.7853  9.02508    255.302     3.07993     75.3024     
1 1 1 28 15 60 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 15 61 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 16 0  o 10 13.0643 5.87597 1.18023     8.42806  1.18023     8.42806  6.01809    180         18.8661     180         
1 1 1 28 16 1  o 6  24.2351 5.48577 2.88814     7.92966  17.1375     8.49242  2.35357    86.3567     23.7445     266.357     
1 1 1 28 16 2  o 14 69.8551 3.33309 86.9287     11.0925  89.8564     12.0983  51.6491    278.349     1.1529      278.349     
1 1 1 28 16 3  o 4  66.0699 3.42981 83.9123     10.7875  74.6433     11.6565  54.654     317.455     13.7367     317.455     
1 1 1 28 16 4  o 17 109.242 2.94776 217.681     15.2772  211.804     16.871   90.8339    71.7159     18.9419     71.7159     
1 1 1 28 16 5  o 19 57.9803 3.78347 65.7317     10.6675  57.2823     10.9937  52.4828    166.701     23.5629     166.701     
1 1 1 28 16 6  o 18 55.4914 3.82557 65.4008     9.61896  47.9586     10.8684  38.7375    357.3       2.00722     177.3       
1 1 1 28 16 7  o 4  120.805 2.78544 273.713     16.1564  250.899     17.4171  92.861     162.218     5.22319     162.218     
1 1 1 28 16 8  o 19 98.8659 2.8139  177.665     13.3093  173.887     14.4762  72.5345    67.1858     1.90725     247.186     
1 1 1 28 16 9  o 2  51.9305 4.08872 63.3571     9.44321  37.6042     10.4429  46.3395    322.957     21.5869     322.957     
1 1 1 28 16 10 o 4  34.1158 5.4354  20.2382     8.92894  24.7413     9.23363  21.6439    75.3601     2.39257     75.3601     
1 1 1 28 16 11 o 17 41.0216 4.79641 35.6968     9.31981  27.9738     9.588    11.0487    248.379     35.9616     68.3794     
1 1 1 28 16 12 o 15 65.5428 3.5801  76.3184     11.6405  80.284      11.6907  38.7767    287.848     18.2422     107.848     
1 1 1 28 16 13 o 13 30.6926 5.90239 22.1102     9.47807  14.5602     9.3928   14.2962    316.53      9.17124     136.53      
1 1 1 28 16 14 o 2  61.7792 3.62944 58.3641     11.0254  82.0201     10.9434  32.3702    74.6442     25.3449     254.644     
1 1 1 28 16 15 o 4  35.2245 5.36764 29.7717     9.80319  18.6517     8.68771  15.2186    297.059     16.958      117.059     
1 1 1 28 16 16 f 0  27.0972 5.79845 17.9954     8.98619  9.99348     8.44386  42.3466    237.423     0           0           
1 1 1 28 16 17 o 7  30.6056 5.71194 14.2495     8.72253  22.414      9.2658   14.6571    225.748     8.59176     45.7476     
1 1 1 28 16 18 o 7  72.9706 3.28883 103.366     11.3217  90.264      12.4454  53.7279    7.23133     0.999358    7.23135     
1 1 1 28 16 19 o 8  26.8817 5.4773  3.5919      8.77385  22.4916     8.7803   11.2357    301.039     8.05593     121.039     
1 1 1 28 16 20 o 15 30.506  5.51936 19.4901     8.49675  16.8204     8.4714   16.9283    106.582     6.50475     106.582     
1 1 1 28 16 21 o 12 64.4644 3.37353 83.4001     10.8062  68.4512     10.7512  59.3025    319.61      26.8749     319.61      
1 1 1 28 16 22 o 9  43.1238 4.8506  29.7875     9.93658  41.2269     10.1671  21.9123    159.526     16.5062     339.526     
1 1 1 28 16 23 o 1  70.6649 3.42758 89.4264     11.7952  92.7647     12.3347  68.3819    213.705     35.8671     213.705     
1 1 1 28 16 24 o 9  44.9014 4.39104 29.888      9.39664  46.5962     9.3938   17.4628    318.526     28.7493     138.526     
1 1 1 28 16 25 o 7  21.3455 5.57804 4.1349      7.93963  9.79463     8.12687  5.3819     309.321     37.4199     309.321     
1 1 1 28 16 26 o 9  52.0522 4.09076 51.2351     10.4566  49.4696     10.5202  28.7047    7.5767      16.8039     187.577     
1 1 1 28 16 27 o 1  58.0845 3.87868 70.4063     10.8462  54.7259     11.234   37.0362    187.265     9.11361     7.26494     
1 1 1 28 16 28 o 8  27.472  5.8779  11.2629     9.43229  17.7381     8.53195  14.6494    328.444     1.07536     148.444     
1 1 1 28 16 29 o 1  30.4536 5.73625 20.1282     8.93429  16.6147     8.93912  13.812     239.569     11.9442     59.5691     
1 1 1 28 16 30 o 8  31.5011 5.57179 16.1267     8.91628  23.2079     8.79341  20.2694    188.995     1.19683     188.995     
1 1 1 28 16 31 o 10 31.4049 5.56522 15.4795     8.99195  23.7092     8.72496  19.6159    67.7339     0.780459    247.734     
1 1 1 28 16 32 o 18 26.2476 6.01201 14.1446     8.95255  12.5722     9.13249  10.477     229.894     12.142      49.8941     
1 1 1 28 16 33 o 5  77.0666 3.18571 113.351     12.2385  104.057     12.2423  61.8854    234.939     12.6346     234.939     
1 1 1 28 16 34 o 15 34.5649 5.4774  20.1945     9.28382  27.6426     9.28809  22.5508    52.7598     0.869636    232.76      
1 1 1 28 16 35 o 19 42.3734 4.78848 37.6582     9.77003  31.9958     9.82595  40.4299    196.129     26.4015     196.129     
1 1 1 28 16 36 o 4  14.8617 4.77816 -0.245249   7.93893  -8.68218    7.99977  1.79214    357.523     18.242      357.523     
1 1 1 28 16 37 o 13 22.436  5.7932  4.72535     8.57245  12.4325     8.83502  10.2949    243.881     3.7065      63.8813     
1 1 1 28 16 38 o 4  19.3142 5.37986 10.5311     8.47689  -4.50678    8.42566  2.51566    296.995     29.1706     296.995     
1 1 1 28 16 39 o 10 52.244  4.21746 49.3214     11.0264  55.055      10.5845  22.9332    204.514     28.0825     24.5144     
1 1 1 28 16 40 f 0  66.705  3.55932 95.8405     11.7113  71.3918     11.6822  34.4255    42.8067     0           0           
1 1 1 28 16 41 o 10 44.94   4.712   43.3271     10.2717  36.0817     10.2312  30.163     262.024     1.47525     82.0238     
1 1 1 28 16 42 o 15 45.3915 4.92801 43.5296     11.2489  38.2668     10.4591  32.6282    313.839     3.28804     313.838     
1 1 1 28 16 43 o 14 22.6385 6.16886 9.31299     9.97711  8.30364     9.80367  8.92004    174.729     0.596074    174.729     
1 1 1 28 16 44 o 4  26.9664 6.52423 13.5691     11.0696  16.7322     10.283   10.754     126.577     5.32717     126.577     
1 1 1 28 16 45 o 15 68.5979 4.12584 76.9334     14.1847  104.34      13.4254  53.4796    68.9278     11.3871     68.9277     
1 1 1 28 16 46 o 8  25.5148 6.44796 18.6121     11.2038  7.31443     10.297   10.8711    218.98      3.13606     218.98      
1 1 1 28 16 47 o 7  62.1534 4.53923 83.4775     14.0277  67.7231     13.7205  46.4292    348.599     7.00212     348.599     
1 1 1 28 16 48 o 19 84.2272 3.72664 139.161     16.5596  129.042     14.7364  77.2868    126.523     37.2974     126.523     
1 1 1 28 16 49 o 10 49.5039 5.35742 57.9964     13.1414  42.0377     12.4212  41.5082    146.751     16.5792     146.751     
1 1 1 28 16 50 o 1  33.8288 6.3363  38.3122     12.2104  12.1746     11.6381  26.4977    246.488     12.1749     246.488     
1 1 1 28 16 51 o 7  21.0787 6.12256 -1.70837    11.4111  10.9186     10.4702  7.82474    107.61      6.9065      287.61      
1 1 1 28 16 52 o 1  47.1306 5.97504 55.0725     13.4376  40.209      13.5625  39.3386    238.526     16.5351     238.526     
1 1 1 28 16 53 o 11 25.3975 6.99426 11.3827     14.3926  14.7704     11.6328  13.6676    99.2068     0.246523    99.2068     
1 1 1 28 16 54 o 8  45.3862 6.88217 47.2916     16.6901  48.2309     13.6445  29.6778    163.28      0.426562    343.28      
1 1 1 28 16 55 o 1  29.6991 6.81736 4.1473      14.9794  33.9411     12.9296  17.088     225.622     0.321593    225.622     
1 1 1 28 16 56 o 15 31.5945 8.85269 46.301      30.3586  20.8405     12.8183  18.0072    237.255     1.76579     237.255     
1 1 1 28 16 57 o 3  19.8949 6.76786 -33.7245    29.2547  -1.04205    14.4916  1.53973    284.643     1.65896     104.643     
1 1 1 28 16 58 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 16 59 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 17 0  o 19 39.2576 5.46114 30.8942     9.5595   30.8942     9.5595   29.3881    180         0.258255    360         
1 1 1 28 17 1  o 18 88.5064 3.02528 135.317     13.0076  147.959     13.7526  78.1183    165.36      25.0848     165.36      
1 1 1 28 17 2  f 0  86.4948 2.95004 138.417     12.8718  131.807     12.6263  52.7579    62.1618     0           0           
1 1 1 28 17 3  o 15 73.788  3.3022  104.623     11.7173  93.2914     12.4831  68.8549    357.45      30.0062     357.45      
1 1 1 28 17 4  o 15 27.8331 5.59883 13.4448     8.1627   16.504      8.24782  1.87473    199.201     33.2992     19.2007     
1 1 1 28 17 5  o 1  15.0496 4.86371 -6.54507    8.0755   -3.20876    8.35505  7.69282    224.347     28.9752     224.347     
1 1 1 28 17 6  o 6  30.4962 5.39731 21.4721     8.33562  14.7327     8.26711  3.98975    63.5457     50.45       63.5457     
1 1 1 28 17 7  o 2  52.4589 3.76713 45.7325     9.5627   55.6967     9.91813  27.5621    161.554     21.0041     341.554     
1 1 1 28 17 8  o 15 61.2034 3.58702 69.8451     10.3664  67.155      11.3834  46.8349    235.122     4.80953     235.122     
1 1 1 28 17 9  o 14 91.7815 2.90146 161.82      12.9705  142.593     13.5629  59.8249    5.97273     17.1592     185.973     
1 1 1 28 17 10 o 6  24.5922 5.84096 11.533      8.23165  10.4703     8.7914   8.9115     251.181     6.47739     71.1811     
1 1 1 28 17 11 o 1  53.0398 3.87966 54.5819     9.75756  49.2138     10.478   21.0755    91.3922     35.2318     271.392     
1 1 1 28 17 12 o 1  20.8767 5.40908 -2.58672    7.99564  12.8436     8.49174  3.5588     31.1909     12.4413     211.191     
1 1 1 28 17 13 o 16 46.8486 4.76748 42.7176     10.247   40.1448     11.3972  33.4765    107.809     1.19502     107.809     
1 1 1 28 17 14 o 10 21.709  5.78723 9.12284     7.92305  4.02326     9.66777  3.38194    10.5611     33.6124     10.5611     
1 1 1 28 17 15 o 8  78.31   3.20872 115.481     11.6227  107.366     13.3079  40.1115    77.1961     35.8113     257.196     
1 1 1 28 17 16 o 1  42.177  5.27082 37.1665     10.5052  31.3578     10.8952  35.6209    182.339     16.2458     182.339     
1 1 1 28 17 17 o 2  32.5363 5.80177 19.5706     9.19777  22.1931     9.72593  21.8504    137.557     6.24693     137.557     
1 1 1 28 17 18 o 17 49.4628 4.44842 47.5966     10.2046  44.1267     11.2437  33.8113    262.457     2.6291      82.4572     
1 1 1 28 17 19 o 4  87.9809 2.98266 144.281     13.2138  136.11      13.0078  74.2326    289.415     18.9328     289.415     
1 1 1 28 17 20 o 8  55.7432 3.76971 60.3637     10.6592  54.2893     10.144   53.5591    101.837     29.4209     101.837     
1 1 1 28 17 21 o 18 31.5717 5.71953 21.1864     9.29188  18.209      8.90548  19.218     96.452      0.707741    276.452     
1 1 1 28 17 22 o 10 64.6962 3.53122 68.892      11.3543  84.9998     11.2417  36.9156    71.0668     20.6163     251.067     
1 1 1 28 17 23 o 14 20.4537 5.66548 8.64972     8.24628  0.410387    9.36836  3.85866    85.5357     13.0803     265.536     
1 1 1 28 17 24 o 7  23.594  5.76424 6.72505     8.35105  12.9944     8.52969  7.65747    152.12      12.083      332.12      
1 1 1 28 17 25 o 4  45.8638 4.51517 48.7912     9.52754  31.6152     10.0671  29.3254    242.13      6.18401     62.1297     
1 1 1 28 17 26 o 8  28.5527 5.66993 9.70084     8.64556  22.4132     9.01394  18.0423    155.677     3.07589     155.677     
1 1 1 28 17 27 o 5  25.3125 6.01738 9.17297     8.61384  15.0641     9.57648  6.9836     334.898     18.5795     154.898     
1 1 1 28 17 28 o 18 16.3568 5.09136 -4.91742    8.40152  1.48538     8.08917  1.85309    297.873     21.4029     297.873     
1 1 1 28 17 29 f 0  19.0406 5.58358 5.11764     8.90852  0.563017    8.70952  10.2064    94.0546     0           0           
1 1 1 28 17 30 o 17 17.9182 5.34746 2.77367     8.09853  0.753858    8.40032  2.34548    68.0683     1.21783     248.068     
1 1 1 28 17 31 o 10 18.7358 5.46338 5.58517     8.37406  0.200285    8.47368  5.3676     91.029      3.71231     271.029     
1 1 1 28 17 32 o 1  18.7569 5.52433 1.44474     8.38967  4.34147     8.85996  5.57228    75.1869     5.42752     255.187     
1 1 1 28 17 33 o 18 28.5987 5.91597 19.6538     8.9472   13.6752     9.33838  18.1536    253.965     0.596743    253.965     
1 1 1 28 17 34 o 14 56.6019 3.83969 57.7407     10.7162  62.8505     10.7844  43.9963    230.368     7.35608     230.368     
1 1 1 28 17 35 o 13 18.5699 5.49374 -3.25824    9.38994  6.46499     8.53578  6.06642    266.719     35.8009     266.719     
1 1 1 28 17 36 o 15 38.293  5.26795 35.7112     9.68414  23.7739     9.74054  27.6629    52.0328     3.49383     52.0328     
1 1 1 28 17 37 o 15 21.676  5.73895 1.79318     8.96498  12.7124     8.82894  7.9396     85.5595     1.4544      85.5595     
1 1 1 28 17 38 o 3  43.8074 5.30728 33.2286     11.8013  44.3655     10.2471  33.7318    168.392     7.55393     168.392     
1 1 1 28 17 39 o 3  26.3507 6.53279 12.9501     11.0663  15.3954     10.3506  11.5856    40.5162     9.53359     220.516     
1 1 1 28 17 40 o 12 21.0389 5.98998 11.3427     10.5098  -0.279429   9.58782  7.24677    234.065     6.86797     54.0648     
1 1 1 28 17 41 o 5  38.64   6.02712 28.2401     11.5186  35.0113     11.2334  26.149     49.9896     1.00535     49.9895     
1 1 1 28 17 42 o 13 20.0383 5.93589 7.25635     10.3896  0.584958    9.87867  0.941811   28.188      21.1273     208.188     
1 1 1 28 17 43 o 17 21.3714 6.11192 0.94316     10.9272  10.5091     10.1087  6.35257    15.7616     8.38331     195.762     
1 1 1 28 17 44 o 1  27.8678 6.64678 19.9453     11.2748  13.421      10.956   7.92077    239.749     4.58425     239.749     
1 1 1 28 17 45 o 10 19.6213 5.82    10.7506     10.6548  -9.48697    10.594   3.30975    135.914     15.0336     315.914     
1 1 1 28 17 46 o 2  55.9548 4.64806 62.0524     13.7279  61.0571     11.7306  42.4061    110.69      7.3786      110.69      
1 1 1 28 17 47 o 18 23.9941 6.35358 17.6736     11.1014  1.79173     11.0451  10.39      185.294     7.91113     5.29355     
1 1 1 28 17 48 o 13 27.5584 6.20271 2.16393     12.7343  25.5803     10.2816  6.78513    223.637     4.64348     223.637     
1 1 1 28 17 49 o 9  26.8421 6.73607 15.0375     12.9377  16.0554     10.0519  14.3874    339.918     3.5439      159.918     
1 1 1 28 17 50 o 15 50.6072 5.54916 62.7192     15.0639  45.3521     12.2239  38.1773    330.056     7.66988     330.056     
1 1 1 28 17 51 o 16 19.424  6.10364 0.32738     12.5196  2.0884      11.3348  5.79942    201.986     6.61027     21.9859     
1 1 1 28 17 52 o 19 25.8492 7.24692 20.1433     16.1362  10.5477     11.7039  13.3558    56.5538     0.444661    56.5538     
1 1 1 28 17 53 o 6  24.3683 7.03691 7.50379     16.2158  15.2796     12.1621  9.46353    8.83812     7.11836     188.838     
1 1 1 28 17 54 o 8  24.2814 7.24047 13.2849     18.0084  11.3458     12.3839  8.71325    293.24      0.0651835   113.24      
1 1 1 28 17 55 o 19 33.2034 9.05279 62.5817     28.7649  18.2612     13.3498  18.1033    78.5668     8.77366     78.5668     
1 1 1 28 17 56 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 18 0  o 8  44.8974 4.34671 38.3383     9.26057  38.3383     9.26057  7.4174     360         53.3432     180         
1 1 1 28 18 1  o 11 28.8943 5.62739 14.325      8.5193   18.3245     8.38506  16.1612    103.525     1.1449      283.525     
1 1 1 28 18 2  o 12 130.329 2.66186 312.054     16.913   299.793     17.7858  119.179    171.621     42.2851     171.621     
1 1 1 28 18 3  o 8  22.9467 5.69801 9.52354     7.96301  8.83724     8.27372  2.80823    115.558     0.136214    295.558     
1 1 1 28 18 4  o 1  17.4624 5.21214 -0.397141   7.92341  2.70483     7.80071  4.26535    177.912     27.1258     177.912     
1 1 1 28 18 5  f 0  63.6765 3.50158 76.3949     11.0467  72.0318     11.1145  32.3565    247.737     0           0           
1 1 1 28 18 6  o 14 77.3476 3.336   104.661     12.6908  113.414     13.0439  62.9759    22.9262     11.3484     22.9262     
1 1 1 28 18 7  o 18 17.591  5.23168 4.46685     8.03026  -2.86568    8.05964  5.66666    151.925     31.0632     151.925     
1 1 1 28 18 8  o 1  38.0896 5.04589 32.1515     9.34228  23.9116     9.17066  19.2811    192.682     14.6735     12.6816     
1 1 1 28 18 9  o 15 72.872  3.3856  94.286      12.7063  99.5341     11.8318  56.2827    192.333     4.86055     192.333     
1 1 1 28 18 10 f 0  113.617 2.83905 231.864     15.4515  234.477     16.8045  58.5839    90.3101     0           0           
1 1 1 28 18 11 o 13 68.179  3.30149 77.594      10.9361  92.258      11.461   77.7729    104.019     60.5737     104.019     
1 1 1 28 18 12 o 3  51.0231 3.9693  51.6906     10.2597  45.0317     9.69634  42.3708    87.1728     12.2618     87.1728     
1 1 1 28 18 13 o 19 59.594  3.61245 62.1846     10.6057  68.4179     10.7489  51.1211    239.038     16.0779     239.038     
1 1 1 28 18 14 o 17 69.7534 3.27275 89.6347     11.4665  87.8622     11.285   56.6982    299.832     10.9552     299.832     
1 1 1 28 18 15 o 11 92.4567 3.01551 156.217     14.2238  153.911     13.6422  87.9795    306.842     39.0796     306.842     
1 1 1 28 18 16 o 1  28.6947 5.68438 20.1524     8.62975  12.1721     8.71533  6.81144    185.547     25.0057     5.54723     
1 1 1 28 18 17 o 6  60.5956 4.00876 68.1644     11.9315  68.1306     12.1315  46.6772    182.369     5.154       182.369     
1 1 1 28 18 18 o 14 62.259  3.94564 76.7288     10.8894  67.08       13.1032  58.3609    110.19      27.0022     110.19      
1 1 1 28 18 19 o 12 55.4407 4.1543  57.1939     10.5419  57.599      12.121   46.8642    77.942      14.1049     77.942      
1 1 1 28 18 20 o 10 22.9573 6.00069 4.39779     8.3332   12.9894     10.2324  5.74307    252.12      16.5759     72.1199     
1 1 1 28 18 21 o 5  60.9783 4.21462 73.9257     11.5977  65.2847     13.5266  40.2941    49.6152     8.57307     229.615     
1 1 1 28 18 22 o 5  22.5648 6.24844 4.62367     10.2406  9.60758     10.4649  6.38088    312.319     1.28199     312.319     
1 1 1 28 18 23 o 9  39.8782 5.68811 29.4671     10.3042  33.8938     11.6566  29.9236    200.533     4.78605     200.533     
1 1 1 28 18 24 o 15 68.6163 3.57805 91.2667     12.1008  82.8384     12.2957  50.7684    291.499     0.946236    291.499     
1 1 1 28 18 25 o 2  27.616  6.1849  14.9161     9.4599   15.6066     9.73309  12.8481    325.096     10.453      145.096     
1 1 1 28 18 26 o 12 27.3686 6.0324  16.1034     9.56988  13.9964     8.76409  10.7336    140.368     6.64853     140.368     
1 1 1 28 18 27 o 15 95.3253 2.97591 163.049     14.3278  169.023     14.0231  82.0685    59.8485     23.8211     59.8485     
1 1 1 28 18 28 o 4  20.1101 5.71458 8.52121     8.72863  -0.351732   9.61895  3.72649    56.9394     0.462236    56.9394     
1 1 1 28 18 29 o 5  23.1426 5.85359 1.15445     9.70195  15.603      9.133    11.2885    330.891     3.27136     330.891     
1 1 1 28 18 30 o 5  20.1603 5.44063 -5.60578    8.59893  12.9771     8.86737  6.70162    239.058     9.49089     59.0583     
1 1 1 28 18 31 o 2  22.5288 5.87529 3.24119     8.83219  13.7674     9.41219  9.12017    279.555     8.72777     99.5551     
1 1 1 28 18 32 o 13 29.7807 5.86554 26.6277     9.86319  10.2585     9.43023  20.3049    46.2135     2.99115     46.2135     
1 1 1 28 18 33 o 15 60.8515 3.76715 71.0268     11.1681  68.7193     11.5602  53.7081    40.3444     20.4939     40.3444     
1 1 1 28 18 34 o 18 36.5909 5.81887 23.4141     10.8117  32.5753     10.1197  15.8437    277.221     19.1548     97.2207     
1 1 1 28 18 35 o 2  39.41   5.83471 32.9424     10.8994  31.757      11.4045  30.9633    311.711     8.92284     311.711     
1 1 1 28 18 36 o 6  24.5943 6.37435 15.2555     10.562   7.82738     10.3484  11.8143    50.5841     4.01184     50.5841     
1 1 1 28 18 37 o 11 27.8407 6.32892 23.9355     10.79    7.96874     10.7016  13.2399    216.253     7.51669     216.253     
1 1 1 28 18 38 o 12 18.7137 5.811   5.17788     11.2704  -4.95849    10.0085  4.05481    5.9013      3.66448     185.901     
1 1 1 28 18 39 o 6  35.3599 6.82132 31.6473     13.1186  24.4286     11.7866  12.0325    236.932     23.961      56.9324     
1 1 1 28 18 40 o 16 25.5629 6.60536 14.2896     10.8165  12.2588     11.2782  0.0432397  210.07      33.1804     30.0698     
1 1 1 28 18 41 o 17 51.6832 5.21964 59.4872     12.6646  48.7414     13.3461  45.7777    217.789     21.0361     217.789     
1 1 1 28 18 42 o 7  80.0006 4.0423  118.333     16.1312  127.006     16.0444  69.7125    297.773     25.8595     297.773     
1 1 1 28 18 43 o 19 35.6551 6.7619  25.2373     12.7195  31.4483     12.1175  28.458     32.5047     20.1953     32.5047     
1 1 1 28 18 44 o 15 52.375  5.21896 49.5974     13.9893  61.4762     12.0434  45.5949    238.014     19.0518     238.014     
1 1 1 28 18 45 f 0  23.2247 5.97502 23.2338     12.1012  -8.8393     9.53833  17.2804    178.32      0           0           
1 1 1 28 18 46 o 3  25.8562 6.51812 24.39       12.7894  3.26462     10.0427  15.8373    175.741     3.13008     175.741     
1 1 1 28 18 47 o 4  57.1672 5.58348 81.7176     18.0687  56.4466     13.1794  55.8852    331.867     34.1932     331.867     
1 1 1 28 18 48 o 15 24.7903 6.88693 7.64298     16.6088  14.5555     10.1619  13.5182    11.7918     0.302089    11.7918     
1 1 1 28 18 49 o 15 28.8593 7.13625 18.608      16.0243  20.732      10.5103  15.6281    206.066     3.83828     26.0661     
1 1 1 28 18 50 o 4  22.5434 6.72427 9.76439     15.9305  7.91598     10.2208  8.47095    16.3868     0.380293    196.387     
1 1 1 28 18 51 o 1  41.3633 7.62289 52.2651     17.6238  36.7871     14.386   34.1695    254.553     18.4734     254.553     
1 1 1 28 18 52 o 16 25.1203 7.31692 15.8937     16.7623  13.6432     13.07    10.4975    201.573     2.24844     21.5728     
1 1 1 28 18 53 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 18 54 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 19 0  o 3  67.8951 3.33622 83.9557     11.2234  83.9557     11.2234  50.5303    180         2.27116     360         
1 1 1 28 19 1  o 12 74.3701 3.12782 98.7366     11.5957  102.688     11.6104  68.8447    330.792     27.5753     330.792     
1 1 1 28 19 2  o 4  59.0044 3.59755 61.3679     10.5573  66.8706     10.4893  54.5122    47.8572     23.3984     47.8572     
1 1 1 28 19 3  f 0  46.0543 4.46616 33.222      10.0389  47.4425     9.6234   28.3723    251.233     0           0           
1 1 1 28 19 4  o 18 79.1036 3.02184 118.612     11.9329  108.901     11.9192  71.1036    76.6929     24.5425     76.6929     
1 1 1 28 19 5  o 18 19.0916 5.43095 -1.00689    8.35741  7.28129     8.16514  3.31351    333.422     3.75068     153.422     
1 1 1 28 19 6  o 19 41.3384 5.06701 37.0163     9.34984  29.0767     10.6358  26.8418    229.657     4.89656     49.6572     
1 1 1 28 19 7  o 3  52.3416 3.88097 47.5257     10.0522  54.335      9.95109  49.5184    196.963     24.6046     196.963     
1 1 1 28 19 8  o 7  59.1483 3.73806 58.0613     10.5443  71.5921     11.356   58.2537    36.5493     31.254      36.5493     
1 1 1 28 19 9  o 12 18.0593 5.42417 2.9804      9.22508  -0.246073   7.87807  1.21183    253.632     15.8748     73.6324     
1 1 1 28 19 10 f 0  45.6011 4.4654  43.0676     10.0132  35.8103     9.78937  24.5266    235.475     0           0           
1 1 1 28 19 11 o 18 38.8818 5.14883 25.7227     9.58965  33.2697     9.70009  32.9823    91.6666     13.8817     91.6666     
1 1 1 28 19 12 o 13 103.756 2.97916 199.085     15.8753  192.073     15.0409  100.348    341.089     45.4334     341.089     
1 1 1 28 19 13 o 16 28.2849 5.99163 13.1979     9.05502  18.5941     9.40211  17.4874    2.1279      0.302924    2.12789     
1 1 1 28 19 14 o 12 58.44   3.93969 65.7094     11.215   61.5176     11.5525  53.3131    202.351     21.6765     202.351     
1 1 1 28 19 15 o 4  21.5602 5.84587 6.80116     8.21962  7.26417     9.48135  8.75435    200.138     3.73666     20.1378     
1 1 1 28 19 16 o 10 36.3272 5.50227 27.2408     9.91122  25.2167     9.52221  26.8506    48.7064     3.93059     48.7064     
1 1 1 28 19 17 o 10 52.173  3.97741 57.3608     10.3117  44.9712     10.0446  48.0322    53.1504     21.0935     53.1504     
1 1 1 28 19 18 f 0  28.2126 5.95053 17.9055     9.27897  14.1432     8.8744   15.9389    155.166     0           0           
1 1 1 28 19 19 o 15 90.7305 2.95734 160.459     13.4022  140.15      13.3708  85.1996    358.017     35.573      358.017     
1 1 1 28 19 20 o 4  22.4167 5.35535 16.8702     8.41956  -2.71802    8.46704  11.0526    291.614     2.63724     111.614     
1 1 1 28 19 21 o 12 131.195 2.78288 306.918     18.1369  319.251     18.4142  109.2      251.843     22.1857     251.843     
1 1 1 28 19 22 f 0  40.7635 5.41551 31.3518     10.6633  35.0041     10.6397  30.2188    44.1934     0           0           
1 1 1 28 19 23 o 14 42.2642 4.85952 32.6791     9.89949  37.2509     9.95054  33.0971    147.061     6.55386     147.061     
1 1 1 28 19 24 o 2  37.4475 5.58869 24.3302     9.95594  32.8099     10.394   17.1688    86.0906     18.9314     266.091     
1 1 1 28 19 25 o 5  20.1502 5.80023 6.774       9.05178  2.49759     9.539    8.03062    94.8079     4.43889     274.808     
1 1 1 28 19 26 o 15 38.5644 6.11811 31.7418     10.9657  30.3079     12.1053  19.659     198.251     15.3176     18.2505     
1 1 1 28 19 27 o 8  27.1868 5.66566 27.6135     9.99628  -4.92895    11.5602  10.1348    199.968     16.335      19.9678     
1 1 1 28 19 28 o 7  34.6355 6.27223 13.9409     10.3236  38.7397     12.7231  29.1502    16.382      14.5177     16.382      
1 1 1 28 19 29 o 15 35.3112 6.08762 16.7001     10.916   36.8898     11.3027  29.7814    106.424     14.3044     106.424     
1 1 1 28 19 30 o 16 46.8496 5.796   43.4528     12.7781  47.1631     13.4506  42.8209    30.2031     20.8927     30.2031     
1 1 1 28 19 31 o 12 23.9805 6.68235 13.7637     11.8926  5.0322      12.2563  12.5983    95.02       1.53495     95.02       
1 1 1 28 19 32 o 1  58.8987 4.63453 56.7404     12.5262  80.0943     14.2797  53.9572    231.62      24.0963     231.62      
1 1 1 28 19 33 o 9  43.5293 5.95673 40.1558     11.6404  39.333      13.357   32.8931    92.2427     5.57756     92.2427     
1 1 1 28 19 34 o 5  39.8195 6.27434 28.2395     11.4438  40.4325     13.0534  26.6959    153.379     1.09651     333.379     
1 1 1 28 19 35 o 11 18.2427 5.73073 3.81742     10.158   -7.96287    11.6777  0.643621   187.466     18.691      7.46627     
1 1 1 28 19 36 o 9  39.5239 6.25107 31.5305     12.3194  35.9168     11.8434  31.2511    350.561     10.521      350.561     
1 1 1 28 19 37 o 18 34.9626 6.56407 17.6553     12.9677  36.5133     11.8189  27.3409    110.811     12.2961     110.811     
1 1 1 28 19 38 o 12 32.2744 6.80986 26.1533     12.3068  20.7951     11.4482  16.478     125.034     9.62225     305.034     
1 1 1 28 19 39 o 1  58.084  4.83282 73.3544     14.1539  61.0553     13.3973  49.6381    63.2448     17.5345     63.2448     
1 1 1 28 19 40 o 6  81.9747 3.9833  143.345     16.5929  114.556     15.8396  75.7274    66.6169     34.1449     66.6169     
1 1 1 28 19 41 o 2  44.4834 6.03695 45.7888     14.2408  38.4822     11.7062  29.8405    342.105     2.08461     162.105     
1 1 1 28 19 42 o 14 27.8235 6.77438 23.1198     12.8354  11.3626     10.3412  13.5943    109.262     8.58987     289.262     
1 1 1 28 19 43 o 14 22.1253 6.57572 4.95829     15.3487  7.58053     9.8416   10.7048    34.4656     0.502547    34.4656     
1 1 1 28 19 44 o 13 62.2215 5.5516  79.6231     18.6117  81.9148     14.6436  56.3465    18.754      25.8107     18.754      
1 1 1 28 19 45 o 14 18.7325 6.12476 -4.03745    15.7128  -2.69362    11.1951  5.17487    338.505     1.17392     158.505     
1 1 1 28 19 46 o 3  28.3864 7.64301 19.7448     16.3804  19.7498     13.8794  16.4293    150.395     8.44642     150.395     
1 1 1 28 19 47 o 12 33.1912 7.93091 32.4717     17.0564  27.1086     14.291   20.6228    78.7781     0.228657    258.778     
1 1 1 28 19 48 o 4  19.3253 6.3033  3.11412     15.528   -5.09583    12.6189  4.37648    208.569     7.62227     28.569      
1 1 1 28 19 49 o 17 19.0449 6.24133 3.53079     15.7188  -5.94589    12.215   3.00397    61.0242     3.46425     241.024     
1 1 1 28 19 50 o 12 19.4863 6.32141 12.583      16.0699  -14.1122    12.0491  2.3291     66.4092     2.53319     246.409     
1 1 1 28 19 51 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 19 52 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 20 0  f 0  84.5775 3.01344 129.412     12.6982  129.412     12.6982  36.3046    180         0           0           
1 1 1 28 20 1  o 12 71.2728 3.27584 89.4509     11.6709  97.1256     11.5821  60.0865    85.0277     13.5982     85.0277     
1 1 1 28 20 2  o 10 41.6721 4.74644 37.3556     9.56275  29.818      9.50432  41.8639    51.7893     30.449      51.7893     
1 1 1 28 20 3  o 16 69.0177 3.31101 87.6038     11.3247  87.4884     11.4433  63.1576    355.145     23.5663     355.145     
1 1 1 28 20 4  f 0  43.2835 4.65049 36.585      9.89021  35.4092     9.65125  24.0509    1.23575     0           0           
1 1 1 28 20 5  o 18 21.718  5.21639 16.4226     8.25016  -5.25491    8.34282  6.5123     81.7473     14.382      261.747     
1 1 1 28 20 6  o 13 19.3598 5.50337 -2.37847    8.12619  9.11144     9.03347  6.32622    310.734     2.14032     130.734     
1 1 1 28 20 7  o 2  20.7732 5.70156 4.7681      8.7157   7.59217     8.36355  7.56739    178.489     8.55271     358.489     
1 1 1 28 20 8  o 3  28.7699 5.80267 14.3464     8.83972  19.0644     8.83319  21.0446    185.544     7.75513     185.544     
1 1 1 28 20 9  o 8  60.5177 3.63318 69.0136     10.9332  67.0508     10.8947  23.2154    292.734     44.2444     112.734     
1 1 1 28 20 10 o 3  63.2067 3.58058 75.885      11.1032  72.362      11.3748  53.1295    291.263     12.4796     291.263     
1 1 1 28 20 11 o 15 19.5381 5.51099 -1.09602    8.33049  8.90011     8.65765  5.03432    64.3435     12.7061     244.343     
1 1 1 28 20 12 o 10 38.1863 5.42579 25.4196     10.456   32.9202     9.53102  33.6539    273.244     15.2765     273.244     
1 1 1 28 20 13 o 7  97.8338 2.92968 167.073     14.1554  182.672     14.4983  89.2018    62.1565     31.4375     62.1565     
1 1 1 28 20 14 o 7  26.8928 6.11526 17.6308     9.30643  11.1483     9.76104  13.1078    109.184     9.49147     289.184     
1 1 1 28 20 15 o 16 77.5744 3.57174 102.93      14.184   121.023     13.2465  73.3449    197.533     31.2818     197.533     
1 1 1 28 20 16 f 0  16.3828 5.15017 -0.638453   8.52918  -2.41491    8.45859  4.09918    120.253     0           0           
1 1 1 28 20 17 o 18 15.3111 4.88799 1.43246     8.31349  -10.4122    8.31296  1.8044     326.302     20.7601     326.302     
1 1 1 28 20 18 o 1  65.2678 3.65446 75.5868     11.9488  83.8731     11.7163  46.3519    271.854     4.19872     91.8542     
1 1 1 28 20 19 o 2  19.7732 5.42788 -6.44745    8.7367   12.2816     8.85475  7.23229    65.6882     0.0756487   65.6883     
1 1 1 28 20 20 o 19 31.8201 5.74985 13.5594     9.32485  28.813      9.77958  20.5543    97.1281     2.32648     277.128     
1 1 1 28 20 21 o 6  32.4949 5.84468 21.5423     9.49407  22.4836     9.58524  21.4918    140.337     1.36187     320.337     
1 1 1 28 20 22 o 1  19.4034 5.73067 1.45353     8.75577  5.74763     9.87941  7.09229    284.349     4.89188     104.349     
1 1 1 28 20 23 o 6  48.0733 4.47445 40.4873     10.4067  49.6169     10.5266  45.1639    94.4693     22.2441     94.4693     
1 1 1 28 20 24 o 1  38.1931 5.44322 29.8633     10.1807  29.8736     9.93482  13.8345    260.188     27.2073     80.1884     
1 1 1 28 20 25 o 8  87.0249 3.55484 145.038     15.927   139.112     14.946   75.2963    292.224     21.8056     292.224     
1 1 1 28 20 26 o 9  41.9228 5.70594 36.1674     11.5006  36.6634     11.6049  21.5466    2.7327      16.9755     182.733     
1 1 1 28 20 27 o 1  27.7541 6.4566  13.5132     10.6359  19.2267     10.4005  12.9901    306.86      10.6014     126.86      
1 1 1 28 20 28 o 2  18.1304 5.62326 2.05904     9.81806  -1.24542    9.83732  4.49736    56.8597     3.80898     236.86      
1 1 1 28 20 29 o 13 46.7895 6.05619 58.5401     12.9091  34.7809     13.9198  29.9693    311.435     6.74343     131.435     
1 1 1 28 20 30 o 14 65.8853 4.63298 88.2618     15.2349  82.4137     14.9472  57.2349    247.941     19.1955     247.941     
1 1 1 28 20 31 o 2  42.9182 7.296   47.5532     14.8791  36.8872     16.3847  34.6363    197.799     11.0142     197.799     
1 1 1 28 20 32 o 3  38.7058 6.8801  23.939      14.4247  43.995      13.3149  32.122     80.8153     22.9759     80.8153     
1 1 1 28 20 33 o 13 30.0163 7.20303 27.4528     13.7854  13.2838     12.8515  19.234     192.303     2.549       192.303     
1 1 1 28 20 34 o 2  22.3838 6.55122 7.88496     13.0647  6.57975     10.908   6.90933    1.1063      12.4884     181.106     
1 1 1 28 20 35 o 10 36.9959 7.14459 36.9664     14.8287  26.3975     12.4953  28.2983    250.469     7.93972     250.469     
1 1 1 28 20 36 o 17 19.7732 6.2142  -4.38829    13.7186  3.57128     11.4675  4.0017     200.344     15.0404     20.3441     
1 1 1 28 20 37 o 12 42.1238 7.28659 45.8803     14.0872  35.7598     16.8439  34.5541    28.6215     11.9214     28.6215     
1 1 1 28 20 38 o 4  58.0008 5.84916 87.8317     18.1213  55.0262     14.8145  41.8564    315.883     0.884809    315.884     
1 1 1 28 20 39 f 0  21.5058 6.81467 1.51476     15.254   1.16145     15.0842  8.36479    240.919     0           0           
1 1 1 28 20 40 o 13 59.5279 6.64332 76.6471     19.2693  80.3857     19.0317  52.3868    238.014     20.9343     238.014     
1 1 1 28 20 41 o 8  28.0623 7.87726 17.8052     16.6153  18.5659     16.4407  13.4904    186.566     8.90065     6.56591     
1 1 1 28 20 42 o 11 30.3697 7.69859 36.6425     16.6779  6.62153     16.4336  21.4121    42.4626     12.1738     42.4626     
1 1 1 28 20 43 o 13 33.1688 8.25966 33.0169     17.2697  27.1585     16.9529  19.7231    275.214     3.37864     95.2145     
1 1 1 28 20 44 o 7  25.3612 7.56835 15.818      16.7146  11.7888     16.2781  12.3428    149.123     3.4215      149.123     
1 1 1 28 20 45 o 13 24.0478 7.37093 14.1383     16.2513  7.34231     16.8097  10.6518    191.881     1.29534     11.881      
1 1 1 28 20 46 o 9  26.2934 7.82545 16.0477     17.7669  18.7975     17.3712  10.6739    346.698     3.24352     346.698     
1 1 1 28 20 47 o 9  26.2915 7.43134 12.9713     17.2792  21.0855     13.6187  12.2291    286.485     0.948158    286.485     
1 1 1 28 20 48 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 20 49 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 21 0  o 7  48.3978 4.33329 44.7878     10.0518  44.7878     10.0518  43.6338    1.28411e-05 13.2643     1.28411e-05 
1 1 1 28 21 1  o 17 21.3234 5.78993 5.13919     8.64417  9.20752     8.85904  5.17844    294.94      17.1883     114.94      
1 1 1 28 21 2  o 14 22.1924 5.78395 4.54365     8.58101  12.154      8.8265   4.80014    44.7451     19.825      224.745     
1 1 1 28 21 3  o 4  22.0403 5.85905 6.02647     8.80673  10.3188     8.90865  10.907     175.651     3.41321     355.651     
1 1 1 28 21 4  o 1  32.4113 5.61976 27.6269     9.19145  15.6962     9.32376  20.2429    266.87      4.84954     86.8698     
1 1 1 28 21 5  o 18 39.6324 5.0626  33.6565     9.60559  28.8177     9.73125  31.7494    238.974     6.99284     238.974     
1 1 1 28 21 6  o 8  30.7922 5.94016 21.8062     9.40054  17.6439     9.52117  19.1692    123.969     4.03874     303.969     
1 1 1 28 21 7  o 4  28.0245 6.09817 13.5617     9.07981  19.0478     9.82949  19.5697    247.94      3.50738     247.94      
1 1 1 28 21 8  o 16 27.1408 6.12104 16.1868     9.56209  14.1555     9.22304  12.7701    109.613     11.35       289.613     
1 1 1 28 21 9  o 13 30.2454 5.87457 20.6854     9.1761   17.4083     9.22827  10.1381    107.509     22.6992     287.509     
1 1 1 28 21 10 o 6  31.5898 5.659   15.1379     9.11072  26.3333     9.2211   26.7852    73.0609     15.6798     73.0609     
1 1 1 28 21 11 f 0  51.3412 4.2282  55.4578     10.5772  45.8658     10.6567  26.8621    190.474     0           0           
1 1 1 28 21 12 o 11 23.2193 5.9663  13.7054     9.39279  5.8897      8.97001  12.5142    147.094     2.47885     327.094     
1 1 1 28 21 13 o 2  43.6029 5.35766 40.7323     10.5529  35.9923     11.8677  43.5398    145.963     26.885      145.963     
1 1 1 28 21 14 o 10 31.8288 6.101   24.2203     10.2206  18.7978     9.81157  15.2273    331.951     14.3349     151.951     
1 1 1 28 21 15 o 15 67.6285 3.59941 94.6598     11.9729  77.5036     12.1162  64.4509    12.0419     28.6462     12.0419     
1 1 1 28 21 16 o 16 34.1945 5.44418 38.2698     9.75714  11.2893     9.76098  28.6351    185.237     11.6038     185.237     
1 1 1 28 21 17 o 3  64.3172 3.67695 67.2464     11.5999  89.5784     11.6902  47.7514    9.08935     0.166002    189.089     
1 1 1 28 21 18 o 15 44.5136 4.7985  44.5588     10.3352  34.3096     10.2484  32.0594    99.6296     0.310021    279.63      
1 1 1 28 21 19 o 8  20.2481 5.73395 1.16898     9.06782  9.38665     9.11215  8.26319    36.3248     1.3939      216.325     
1 1 1 28 21 20 o 5  22.7349 6.07782 -2.18892    11.2919  15.8067     9.99767  11.8211    42.6014     0.453671    222.601     
1 1 1 28 21 21 o 2  19.2979 5.94177 5.99345     10.9164  -5.16446    11.2878  5.66704    302.048     1.05432     122.048     
1 1 1 28 21 22 o 10 18.4208 5.83568 -7.38654    10.729   3.66672     11.8231  4.57662    232.577     9.67702     52.5769     
1 1 1 28 21 23 o 19 29.6683 6.96046 10.0126     14.3978  26.638      11.975   12.4868    344.399     15.3463     164.399     
1 1 1 28 21 24 o 14 28.5345 6.88112 13.1737     12.5647  21.959      11.6716  11.5168    93.6174     15.2642     273.617     
1 1 1 28 21 25 o 16 30.5191 6.94732 23.9407     12.3475  18.0698     11.9285  19.5881    109.408     0.00730861  289.411     
1 1 1 28 21 26 o 1  19.3905 5.93845 6.16457     10.8134  -3.27296    10.9445  4.99809    240.439     9.71452     60.4389     
1 1 1 28 21 27 o 11 17.7821 5.63278 -4.51451    10.5143  1.56363     10.384   2.88836    331.79      26.9729     331.79      
1 1 1 28 21 28 o 19 23.6534 6.52278 12.9046     11.3623  7.45665     11.1212  9.33287    79.6316     8.9716      259.632     
1 1 1 28 21 29 o 9  52.9035 5.28232 52.5779     13.6699  61.8307     13.4248  39.8856    107.944     3.82258     107.944     
1 1 1 28 21 30 o 7  25.6913 6.69651 17.5017     11.6504  9.42568     11.4737  7.97676    93.3113     17.5536     273.311     
1 1 1 28 21 31 o 12 51.3092 5.7267  48.5311     13.8825  61.7335     14.4882  43.1574    334.193     13.4218     334.193     
1 1 1 28 21 32 o 11 31.8491 7.56249 31.7237     15.7696  16.5675     13.1567  23.2017    190.38      6.22205     190.38      
1 1 1 28 21 33 o 3  30.0371 7.38414 14.6741     15.7415  25.3272     12.8335  20.7668    269.944     3.58168     269.944     
1 1 1 28 21 34 o 2  78.0815 5.26935 117.55      20.4543  130.574     20.1957  66.1508    82.7638     18.4661     82.7638     
1 1 1 28 21 35 o 9  26.6363 7.63883 9.36306     17.2165  17.9992     15.2435  17.194     196.206     4.4446      196.206     
1 1 1 28 21 36 f 0  22.9535 7.32053 10.1768     20.3183  -2.7535     14.8066  17.7832    335.807     0           0           
1 1 1 28 21 37 o 3  27.0563 8.04661 20.2624     21.4592  11.4468     15.4256  15.9894    217.476     0.709654    37.4756     
1 1 1 28 21 38 o 5  31.9827 8.65297 36.7976     21.9458  20.2873     16.7512  22.8294    157.411     5.96895     157.411     
1 1 1 28 21 39 o 8  23.4706 7.36598 11.8679     21.7132  4.77874     12.4494  6.39558    314.156     2.71593     314.156     
1 1 1 28 21 40 o 3  40.3284 8.64723 52.5586     23.4933  40.5474     15.1489  35.2723    141.974     20.5785     141.974     
1 1 1 28 21 41 o 11 19.1974 6.41296 -18.3726    22.804   0.309628    11.724   0.939978   99.0121     0.20726     279.012     
1 1 1 28 21 42 o 17 38.2608 7.68531 57.882      18.0081  23.4119     14.5786  28.855     193.099     8.46701     193.099     
1 1 1 28 21 43 o 8  25.2725 7.21271 4.61293     17.1718  21.9402     13.6406  12.0477    101.029     0.763954    281.029     
1 1 1 28 21 44 o 16 36.8009 8.2773  38.8319     20.5616  41.8504     15.2344  27.7333    341.353     14.0658     341.353     
1 1 1 28 21 45 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 21 46 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 22 0  o 9  75.3699 3.35233 104.332     12.5458  104.332     12.5458  59.0913    180         2.65459     180         
1 1 1 28 22 1  o 1  77.1817 3.39938 99.7675     13.0952  123.552     12.9153  68.1744    195.287     19.9028     195.287     
1 1 1 28 22 2  o 14 20.2483 5.82165 6.9433      9.6775   3.93155     8.86033  6.74998    77.026      10.7544     257.026     
1 1 1 28 22 3  o 15 53.376  4.22488 50.2521     10.9454  60.0091     11.2039  45.7534    67.1079     12.5537     67.1079     
1 1 1 28 22 4  o 12 56.7298 4.17662 57.631      11.2356  66.5511     12.1666  43.4139    147.735     2.18407     147.736     
1 1 1 28 22 5  o 10 69.8527 3.5851  89.8055     12.7848  93.9778     12.107   68.8172    8.66101     33.1922     8.66101     
1 1 1 28 22 6  o 8  22.0405 5.92516 10.9216     9.17981  5.9067      9.10254  8.8235     256.701     9.81719     76.7014     
1 1 1 28 22 7  o 2  60.1525 3.86427 68.9741     11.4881  68.896      11.5553  60.9245    209.408     33.1218     209.408     
1 1 1 28 22 8  o 16 39.3419 5.56035 34.1629     10.799   29.9904     10.3638  29.3278    23.246      2.33096     23.246      
1 1 1 28 22 9  o 16 24.0073 5.94495 17.4404     9.55121  4.03488     9.33799  10.4571    254.799     10.2794     74.7994     
1 1 1 28 22 10 o 17 24.3584 6.12339 8.80963     9.56315  14.6204     9.49691  8.48241    181.97      15.5214     1.9698      
1 1 1 28 22 11 o 11 27.4241 6.32873 14.8445     9.76264  17.3539     10.2469  16.4507    73.5054     2.93491     253.505     
1 1 1 28 22 12 o 14 18.9486 5.82244 2.44162     9.81933  0.699105    10.8075  0.0883041  265.452     23.9274     85.4516     
1 1 1 28 22 13 o 6  16.7056 5.33569 -7.70317    10.3861  1.00374     9.13603  2.33879    338.231     1.91504     158.231     
1 1 1 28 22 14 o 18 30.3607 6.05926 28.9205     10.2314  10.2016     10.7537  22.2067    21.053      4.98335     21.053      
1 1 1 28 22 15 o 17 37.5646 6.36246 34.0932     12.0028  27.5368     11.6983  33.256     178.208     16.3486     178.208     
1 1 1 28 22 16 o 2  17.3108 5.48252 3.71158     10.3802  -9.09456    9.84445  0.772782   17.9635     18.1967     197.964     
1 1 1 28 22 17 o 16 61.4162 5.12995 88.0766     14.1747  64.2867     15.8451  30.451     156.121     30.7582     336.121     
1 1 1 28 22 18 o 10 30.1007 6.94296 11.2227     11.5191  29.8334     13.6162  21.9455    177.672     8.5845      177.672     
1 1 1 28 22 19 o 1  65.6731 4.91386 91.8294     14.4711  80.4864     16.8895  51.3555    263.028     5.39436     263.028     
1 1 1 28 22 20 o 8  34.7097 6.914   16.9362     12.2755  38.9664     13.9838  24.7025    198.253     2.72545     198.253     
1 1 1 28 22 21 o 14 27.8315 7.03683 13.4398     11.4641  21.0165     13.4567  17.2082    267.126     1.47215     267.126     
1 1 1 28 22 22 o 11 31.3629 7.14821 17.0233     12.1782  28.7777     13.7329  21.8446    259.923     4.51227     259.923     
1 1 1 28 22 23 o 15 36.6992 7.49782 39.8611     15.0509  24.5061     14.8094  22.9629    150.405     4.65071     330.405     
1 1 1 28 22 24 o 16 63.7658 5.20646 93.7627     14.8123  71.6548     16.9115  58.7912    72.1233     24.5682     72.1233     
1 1 1 28 22 25 o 3  19.8361 6.17436 4.3507      11.1982  -2.48285    13.0128  5.51268    216.369     10.933      36.3694     
1 1 1 28 22 26 o 10 35.0504 7.3051  32.9073     13.2963  24.7195     14.592   25.5356    163.891     3.95039     163.891     
1 1 1 28 22 27 o 19 23.9376 7.17717 16.4178     16.1359  -2.62457    14.7504  11.0841    318.072     4.0275      318.072     
1 1 1 28 22 28 o 9  25.9794 7.46512 -2.10005    16.8441  22.2447     16.047   12.8311    277.083     7.59836     97.0829     
1 1 1 28 22 29 o 15 31.0712 8.24487 20.2726     17.8344  26.5584     17.1795  22.4753    12.2961     5.42032     12.2961     
1 1 1 28 22 30 o 7  23.6101 7.34486 -0.0360576  17.2097  10.1877     16.8361  13.0762    324.986     0.132143    144.986     
1 1 1 28 22 31 o 15 27.5327 7.91064 21.4719     15.8238  7.52134     20.2879  13.1344    103.856     9.91976     283.856     
1 1 1 28 22 32 o 14 34.4725 8.69312 30.8904     18.8412  33.6275     19.0649  28.4531    206.365     17.1458     206.365     
1 1 1 28 22 33 o 3  25.5733 7.49732 3.02382     16.0984  20.6697     16.5007  15.134     156.343     6.42958     156.343     
1 1 1 28 22 34 o 12 20.0215 6.35439 -4.13517    15.5169  4.17836     11.6723  8.45723    276.104     2.35873     96.1041     
1 1 1 28 22 35 o 15 38.5234 7.32614 19.4221     18.9562  53.8838     14.8968  28.9235    48.4793     5.33065     48.4793     
1 1 1 28 22 36 o 3  18.4451 6.10728 -0.466064   15.8216  -7.57951    11.905   5.23175    204.621     6.76046     24.621      
1 1 1 28 22 37 o 2  27.8287 7.67553 20.9997     17.8065  19.2816     13.4148  17.2031    64.6191     2.65832     64.6191     
1 1 1 28 22 38 o 16 22.3882 6.98782 10.5328     17.2002  5.13644     13.3388  4.35382    5.62561     0.959231    5.62561     
1 1 1 28 22 39 o 10 27.0486 7.93558 24.4303     18.0799  15.1182     17.4586  13.7497    14.917      4.45219     14.917      
1 1 1 28 22 40 o 17 23.701  7.40237 11.3203     17.9166  11.0056     16.5984  9.58552    347.129     3.63459     167.129     
1 1 1 28 22 41 o 3  28.0441 8.30775 13.0172     25.962   29.9497     17.7402  14.3875    315.283     2.91395     315.283     
1 1 1 28 22 42 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 22 43 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 23 0  o 15 134.148 3.02125 327.063     20.2643  327.063     20.2643  129.327    4.88605e-06 52.5134     4.88605e-06 
1 1 1 28 23 1  o 19 55.8524 4.63982 61.7807     12.8725  61.7467     12.6039  42.5275    171.498     1.79151     171.498     
1 1 1 28 23 2  o 17 74.1717 4.11298 99.2179     15.5375  113.324     14.6277  68.0492    279.036     24.4543     279.036     
1 1 1 28 23 3  o 7  49.6602 5.11851 56.1434     12.2359  44.1519     12.2923  51.1804    47.5175     31.7428     47.5175     
1 1 1 28 23 4  o 11 20.1255 5.90725 1.35352     9.87576  7.88298     9.98371  4.48528    139.828     0.25505     139.828     
1 1 1 28 23 5  o 15 30.1149 6.37905 14.883      10.7099  25.0724     10.6157  20.7772    352.908     2.08125     352.908     
1 1 1 28 23 6  f 0  43.4891 5.67014 31.8378     11.9041  48.0355     11.687   23.57      97.9769     0           0           
1 1 1 28 23 7  o 5  53.7938 4.85059 63.6312     12.8349  52.486      12.6148  61.092     344.529     49.1335     344.529     
1 1 1 28 23 8  o 7  24.1906 6.38197 9.93536     10.498   13.2003     10.353   3.67994    116.845     1.76148     116.845     
1 1 1 28 23 9  o 4  37.2262 6.25576 21.9225     11.834   39.4297     11.718   33.6751    318.041     19.1872     318.041     
1 1 1 28 23 10 o 18 22.7526 6.58315 19.4543     14.5872  -5.97051    10.7903  10.5944    341.398     0.142269    161.398     
1 1 1 28 23 11 o 18 21.4189 6.81158 -3.97918    11.5467  8.86742     18.2204  3.81799    208.009     0.491102    208.009     
1 1 1 28 23 12 o 8  45.1629 7.32599 53.2805     15.92    41.4809     16.6915  38.7672    122.399     13.7225     122.399     
1 1 1 28 23 13 o 1  23.1052 6.79795 2.48313     11.6526  13.8442     14.5038  9.09733    300.637     9.26041     120.637     
1 1 1 28 23 14 f 0  32.8961 7.45322 26.8131     13.7373  24.7895     14.1075  7.8873     327.721     0           0           
1 1 1 28 23 15 o 3  27.1553 7.12549 20.6493     12.8074  10.4761     13.8215  14.3228    337.379     5.81178     157.379     
1 1 1 28 23 16 o 16 55.9866 5.59287 57.647      14.5617  73.3112     15.8959  57.8456    292.407     35.4241     292.407     
1 1 1 28 23 17 o 19 36.1017 7.34841 30.0823     13.5653  31.6512     14.4598  17.9964    9.18448     15.2126     189.184     
1 1 1 28 23 18 o 13 24.8551 7.00124 13.3516     12.3336  9.72988     14.1088  13.0402    31.4938     3.71084     211.494     
1 1 1 28 23 19 o 18 25.5589 6.91079 19.0416     12.1514  4.56936     14.2802  8.3984     125.808     17.3731     305.808     
1 1 1 28 23 20 o 7  26.6258 7.42891 14.3798     15.1812  15.0019     14.0836  17.0937    58.5116     4.76346     58.5116     
1 1 1 28 23 21 o 7  32.9614 7.51619 14.1168     16.2894  36.1254     14.6151  26.1255    95.804      9.64294     95.804      
1 1 1 28 23 22 o 13 30.4922 8.02146 23.5415     17.2833  21.2182     15.472   18.707     306.69      12.4593     306.69      
1 1 1 28 23 23 o 13 45.361  8.12607 52.2675     19.0606  48.9281     17.9234  26.9301    331.273     11.9632     151.273     
1 1 1 28 23 24 o 19 29.4431 7.83801 -0.974906   19.5517  33.2569     16.9628  17.5736    284.38      4.18973     104.38      
1 1 1 28 23 25 f 0  31.8924 7.96353 6.04373     19.2503  39.2907     17.2613  36.8824    42.851      0           0           
1 1 1 28 23 26 o 17 30.0524 8.10496 13.3038     18.4837  29.3366     16.9574  18.7934    303.917     2.21229     123.917     
1 1 1 28 23 27 o 5  33.4687 8.49001 24.0977     19.5     35.3306     17.6878  26.4414    227.925     9.86399     227.925     
1 1 1 28 23 28 o 19 22.0536 6.96991 14.6527     17.321   -13.2273    15.5561  11.296     355.197     0.865541    175.197     
1 1 1 28 23 29 o 2  21.05   6.86465 -5.18394    18.011   1.65279     15.9482  8.66299    236.9       7.03408     56.8998     
1 1 1 28 23 30 o 9  24.9147 7.72688 3.38815     19.5011  15.9304     18.203   12.4079    78.1594     5.66948     78.1594     
1 1 1 28 23 31 o 9  27.27   8.23654 20.8645     21.9565  15.2962     17.8509  16.4875    260.403     7.3997      260.403     
1 1 1 28 23 32 o 16 29.5114 8.4601  21.6423     22.426   26.8978     17.6491  17.691     68.0053     1.90415     248.005     
1 1 1 28 23 33 o 3  20.9403 6.79642 -31.4988    20.3911  13.4728     16.5904  7.62149    314.43      1.21515     134.43      
1 1 1 28 23 34 o 14 23.8822 7.6746  11.185      21.503   7.40278     18.5108  6.19261    7.20254     1.97177     7.20254     
1 1 1 28 23 35 o 4  29.8732 8.77516 33.7618     23.6356  25.6031     19.6078  18.3219    129.654     2.18161     129.654     
1 1 1 28 23 36 o 2  22.5655 7.37659 0.15657     21.1914  9.55196     18.5998  7.34178    350.544     0.710497    170.544     
1 1 1 28 23 37 o 18 26.9013 8.12611 19.2547     20.0057  22.9861     18.9397  13.0232    235.44      3.89441     55.4402     
1 1 1 28 23 38 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 23 39 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 24 0  o 18 17.9255 7.35496 9.10059     10.8069  9.10059     10.8069  3.36863    180         17.4486     8.65667e-06 
1 1 1 28 24 1  o 17 37.9608 6.34178 28.7945     11.8411  35.1309     11.9594  23.2222    269.986     8.30587     89.9857     
1 1 1 28 24 2  o 2  57.3631 4.954   70.8643     13.8765  62.3001     13.9378  56.0414    118.355     27.4369     118.355     
1 1 1 28 24 3  o 7  19.9803 5.98876 5.52128     10.4096  2.81756     10.4239  6.77992    213.995     8.6027      33.9952     
1 1 1 28 24 4  o 12 83.5782 4.6923  145.824     20.4372  132.266     18.556   87.2714    22.6212     48.482      22.6212     
1 1 1 28 24 5  o 7  16.5114 5.43095 -18.3935    11.2709  1.27205     11.4188  1.79617    68.7626     13.4173     248.763     
1 1 1 28 24 6  o 13 81.108  4.40536 138.734     18.3552  120.028     17.1767  84.7748    240.354     47.3746     240.354     
1 1 1 28 24 7  o 13 25.1199 7.04899 14.1129     12.2703  10.0037     14.5442  12.8661    243.396     5.50651     243.396     
1 1 1 28 24 8  o 11 46.9777 6.72128 36.7033     14.2901  63.7572     16.4123  36.9386    144.772     5.23449     144.772     
1 1 1 28 24 9  o 11 29.0068 7.59961 18.6518     13.8385  20.5489     15.5088  12.3336    130.778     15.4396     310.778     
1 1 1 28 24 10 o 6  29.6928 7.53157 28.6166     13.4294  4.91627     20.2707  7.67287    295.474     26.7878     115.474     
1 1 1 28 24 11 o 8  24.6148 7.2308  4.15578     14.2577  15.9398     15.5048  8.39313    39.4602     4.2838      39.4602     
1 1 1 28 24 12 o 3  16.824  5.63601 -6.04921    11.0268  -13.7321    14.571   1.33444    267.358     0.54622     87.358      
1 1 1 28 24 13 o 4  26.4211 7.34648 26.0777     15.8046  -4.08286    16.1578  8.25491    67.1245     19.9559     247.125     
1 1 1 28 24 14 o 12 36.9212 8.14071 44.5291     17.565   24.673      17.0114  33.6029    318.32      23.0281     318.32      
1 1 1 28 24 15 o 18 22.7094 6.93201 -8.52264    15.4485  14.6033     15.1951  12.4636    108.911     3.10324     108.911     
1 1 1 28 24 16 o 13 34.3083 8.47798 25.1862     19.7013  35.6685     17.2618  26.6195    231.98      6.83917     231.98      
1 1 1 28 24 17 o 16 24.0732 7.46849 -0.35503    17.7593  12.6049     17.4096  12.6552    158.052     4.84289     338.052     
1 1 1 28 24 18 o 15 34.9182 8.86716 37.4481     19.4547  29.2705     20.4834  26.6628    175.891     6.03116     175.891     
1 1 1 28 24 19 o 15 40.5088 9.13449 48.0309     21.383   44.0485     20.4253  34.2021    325.736     12.3502     325.736     
1 1 1 28 24 20 o 18 27.1026 7.9356  1.2545      19.2213  25.7431     18.2743  18.461     321.387     4.52829     321.387     
1 1 1 28 24 21 o 15 26.6309 7.94036 24.123      18.7904  1.80177     19.1096  17.9197    313.727     5.97739     313.727     
1 1 1 28 24 22 o 18 21.5093 7.02384 3.26651     17.8258  -6.2109     17.7881  10.6434    75.4865     0.687046    75.4865     
1 1 1 28 24 23 o 6  48.8034 8.90897 56.3068     21.9531  74.79       22.3532  31.2847    215.462     8.54604     35.4617     
1 1 1 28 24 24 o 11 45.8299 8.58764 80.896      21.819   37.289      21.4659  31.2742    203.742     3.6218      23.7416     
1 1 1 28 24 25 o 6  21.1699 6.96616 1.98738     18.6024  -5.08257    17.2182  9.3664     110.195     0.744656    110.195     
1 1 1 28 24 26 o 2  24.2552 7.63056 7.2032      19.2083  11.5939     18.2435  13.4133    119.344     0.129021    299.344     
1 1 1 28 24 27 o 18 26.0608 8.03859 10.6782     20.0861  19.7981     19.7624  12.5341    101.642     7.82282     281.642     
1 1 1 28 24 28 f 0  27.6916 7.68953 43.9442     19.8807  -17.047     18.3658  13.5354    144.515     0           0           
1 1 1 28 24 29 o 4  20.0711 6.73226 -7.56584    18.4187  -1.72989    18.0802  5.75809    234.31      1.49175     54.3102     
1 1 1 28 24 30 o 6  22.6529 7.29771 18.7365     19.2991  -10.6649    18.6667  9.51425    276.339     1.93015     96.3385     
1 1 1 28 24 31 o 8  27.747  8.13953 3.70905     20.1164  37.7923     20.1942  9.17753    285.194     4.66824     285.194     
1 1 1 28 24 32 o 19 22.2544 7.27664 4.46321     19.7999  6.55305     18.4667  5.08675    197.611     0.0498302   197.611     
1 1 1 28 24 33 o 16 20.3842 6.84509 -3.04922    18.7548  -1.52121    19.104   5.18702    175.891     7.09184     355.891     
1 1 1 28 24 34 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 24 35 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 25 0  o 10 33.0388 10.238  34.0349     17.6782  34.0349     17.6782  24.7656    180         19.3682     180         
1 1 1 28 25 1  o 3  102.534 5.31752 237.925     26.922   196.412     27.0508  97.0714    52.2228     37.2204     52.2228     
1 1 1 28 25 2  o 3  23.5217 7.10886 -4.86128    15.5668  16.712      15.7303  14.18      175.99      3.99146     175.99      
1 1 1 28 25 3  o 19 86.3065 4.93068 169.846     20.988   132.671     20.9574  85.8687    294.222     40.3219     294.222     
1 1 1 28 25 4  o 5  42.7577 9.00216 49.1717     20.8903  51.1251     20.5764  35.031     218.354     8.72655     218.354     
1 1 1 28 25 5  o 19 24.9138 7.50482 -1.62813    17.3739  19.0077     17.0632  15.6737    139.73      6.15792     139.73      
1 1 1 28 25 6  o 14 36.1667 8.90152 36.4019     20.4736  36.7933     19.1333  29.7972    170.855     10.215      170.855     
1 1 1 28 25 7  o 18 25.6823 7.90225 12.0683     18.422   10.2166     19.6582  15.4384    258.702     1.62508     78.7017     
1 1 1 28 25 8  o 19 35.1326 8.68208 40.6432     18.9329  27.1545     19.5889  21.348     8.23172     7.28049     188.232     
1 1 1 28 25 9  o 10 31.7859 9.57665 27.366      21.094   31.8148     34.7973  22.1518    35.8282     2.1302      35.8282     
1 1 1 28 25 10 o 18 29.1984 8.25493 23.6165     18.1554  18.9201     18.5221  16.5051    58.1492     6.90153     238.149     
1 1 1 28 25 11 f 0  50.4022 8.46972 53.687      21.0671  79.6908     21.6433  36.7317    261.786     0           0           
1 1 1 28 25 12 o 19 36.5701 9.24359 24.991      21.8143  55.4        23.2187  32.6046    168.599     18.9327     168.599     
1 1 1 28 25 13 o 10 38.3231 9.49661 45.1501     22.0999  45.4968     22.9731  31.605     207.793     10.552      207.793     
1 1 1 28 25 14 o 6  45.9399 9.60214 65.9073     23.1694  60.2353     24.3376  42.1342    51.4133     19.4559     51.4133     
1 1 1 28 25 15 o 12 18.5786 6.32489 -20.9017    17.6628  -6.94945    17.3828  5.82854    185.937     9.65124     5.93675     
1 1 1 28 25 16 o 4  31.4926 8.88584 25.6614     21.3733  32.7242     21.1084  22.8198    22.9083     4.2588      22.9082     
1 1 1 28 25 17 o 12 28.0551 8.29773 7.70939     20.3647  30.124      20.272   17.0605    204.582     9.9055      204.582     
1 1 1 28 25 18 o 10 28.5054 8.5048  14.019      20.2432  29.564      21.7447  12.4253    44.0548     14.1068     224.055     
1 1 1 28 25 19 o 5  38.384  9.21274 36.9314     23.5032  56.3486     21.0844  22.2217    82.5215     10.2119     262.521     
1 1 1 28 25 20 o 18 29.4364 8.32567 6.76639     19.7793  39.7285     20.4051  20.4171    217.951     4.41554     217.951     
1 1 1 28 25 21 o 9  25.9537 7.97072 15.907      19.4147  16.4233     19.122   11.3818    217.589     10.9326     37.5895     
1 1 1 28 25 22 o 19 26.4856 8.0641  12.2904     19.2872  23.9697     19.8025  13.2351    75.2706     7.09663     255.271     
1 1 1 28 25 23 o 4  20.787  6.92583 -2.20809    18.2945  -0.722657   19.048   6.30397    36.5789     11.0887     216.579     
1 1 1 28 25 24 o 19 26.884  8.31284 9.79506     19.9454  31.7302     22.8845  11.2314    38.372      5.19363     38.372      
1 1 1 28 25 25 o 7  19.9984 6.72136 -5.90934    19.0989  -1.86372    17.6664  5.4653     71.1971     2.3467      251.197     
1 1 1 28 25 26 o 8  24.7907 7.83876 19.4203     20.7621  10.5683     19.1419  11.6966    261.901     3.71013     81.9006     
1 1 1 28 25 27 o 17 28.1565 8.46656 29.4344     21.5443  23.5348     20.2223  12.9491    290.728     9.54766     110.728     
1 1 1 28 25 28 o 6  22.8173 7.8593  -2.22293    18.9409  12.8928     37.4454  6.22474    37.3391     0.405567    217.339     
1 1 1 28 25 29 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 25 30 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 25 31 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 26 0  o 4  22.3826 10.4058 16.0618     29.5382  16.0618     29.5382  14.1489    2.56277e-05 0.859926    180         
1 1 1 28 26 1  o 15 36.5496 10.5725 66.601      31.1587  42.8912     31.9062  21.3177    207.36      9.11381     27.3603     
1 1 1 28 26 2  o 16 37.5021 10.7857 78.3877     33.0018  40.5868     33.9283  23.1152    14.5135     6.79813     194.514     
1 1 1 28 26 3  o 1  29.4348 9.37298 13.6547     29.2918  38.4231     29.7274  15.1627    136.653     9.76122     316.653     
1 1 1 28 26 4  o 11 41.5087 11.1542 68.4899     30.6934  76.8333     33.3774  34.0194    273.103     10.5609     273.103     
1 1 1 28 26 5  o 3  34.1212 9.63819 72.3202     28.9765  -0.0291762  30.1903  17.3158    21.304      13.7539     201.304     
1 1 1 28 26 6  o 4  34.094  11.0123 62.7941     41.8395  58.3023     42.0626  18.105     81.7994     11.1315     261.799     
1 1 1 28 26 7  o 3  30.8637 10.2484 29.9715     38.7851  50.1985     41.6703  21.5447    346.895     9.88878     346.895     
1 1 1 28 26 8  o 3  36.1305 12.7893 278.277     95.7916  129.091     99.1124  23.8058    246.119     0.184688    66.1192     
1 1 1 28 26 9  o 1  24.309  7.77732 5.4438      20.1605  14.0262     20.569   11.8041    148.854     6.93941     328.854     
1 1 1 28 26 10 o 4  30.8763 8.94497 26.9027     22.135   35.5444     22.2148  20.4675    147.056     12.2616     147.056     
1 1 1 28 26 11 o 4  24.195  7.79971 17.2321     21.6586  1.39419     20.3865  12.3757    84.0284     3.53145     84.0284     
1 1 1 28 26 12 o 4  23.156  7.54462 14.6856     20.6124  -4.19016    20.5724  11.7542    181.149     1.03729     1.14933     
1 1 1 28 26 13 o 19 31.1753 9.1172  41.6741     23.5989  26.8531     23.395   22.6887    354.521     8.55062     354.521     
1 1 1 28 26 14 o 11 22.7593 7.40289 13.2489     19.7091  -2.0853     19.5229  6.97889    146.528     1.9891      146.528     
1 1 1 28 26 15 o 12 22.0495 7.28869 12.8171     20.3509  -10.5093    20.4865  9.59269    20.2202     1.80408     200.22      
1 1 1 28 26 16 o 13 27.3187 8.29879 0.694691    22.032   38.7481     22.0662  14.2618    332.766     6.37598     332.766     
1 1 1 28 26 17 o 11 22.4662 7.43581 2.71426     21.0425  6.63661     20.8341  7.83553    265.182     0.780275    265.182     
1 1 1 28 26 18 o 3  28.827  8.7544  19.665      23.9149  37.6223     22.7793  17.8561    223.208     2.04652     223.208     
1 1 1 28 26 19 o 7  31.5993 9.31616 33.7463     23.9618  46.8044     25.2319  21.5588    334.628     8.29006     334.628     
1 1 1 28 26 20 o 11 20.647  6.97139 -0.102242   20.3358  -4.25314    20.0528  6.38365    42.5767     6.72947     222.577     
1 1 1 28 26 21 o 19 26.9298 8.28489 4.54132     22.4533  37.555      21.9875  14.1093    262.5       3.21007     262.5       
1 1 1 28 26 22 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 26 23 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 26 24 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 26 25 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 27 0  x 12 ?       ?       ?           ?        ?           ?        15.589     180         0           0           
1 1 1 28 27 1  o 5  25.6805 9.03035 62.089      44.6648  -66.6163    45.3648  10.8836    280.275     3.06576     280.275     
1 1 1 28 27 2  o 18 30.0233 10.1775 88.1858     44.8641  16.2617     45.1696  17.845     168.326     1.29658     348.326     
1 1 1 28 27 3  o 18 23.2407 8.23238 -60.4783    43.4806  17.0753     39.3264  7.96851    32.1974     0.927791    32.1974     
1 1 1 28 27 4  o 13 27.8353 9.63651 53.2579     44.183   20.9687     47.1167  13.3906    328.422     5.04827     328.422     
1 1 1 28 27 5  o 19 23.8904 8.47362 0.09086     43.682   -15.3486    44.2927  9.90884    233.516     7.5794      53.5157     
1 1 1 28 27 6  o 15 24.4653 8.60738 43.5778     40.9117  -58.286     41.1382  9.6164     210.084     1.64332     210.084     
1 1 1 28 27 7  x 3  ?       ?       ?           ?        ?           ?        13.7868    127.554     0           0           
1 1 1 28 27 8  f 0  24.8347 8.77379 21.9689     44.2286  -12.7663    46.1038  14.2981    267.738     0           0           
1 1 1 28 27 9  o 15 24.9078 8.77786 16.6973     42.2874  -1.60417    46.0548  5.09759    114.887     1.54078     114.887     
1 1 1 28 27 10 o 9  24.2066 8.54572 -7.12798    42.0192  9.46351     42.6226  7.03031    14.9337     1.31921     14.9337     
1 1 1 28 27 11 o 3  24.4561 8.61931 13.1076     41.8584  -4.23734    42.9388  5.83329    16.2364     1.32385     16.2364     
1 1 1 28 27 12 o 2  28.1239 9.74567 40.917      45.9844  54.087      46.9998  3.62768    149.355     1.67583     149.355     
1 1 1 28 27 13 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 27 14 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 27 15 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 27 16 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 27 17 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 28 27 18 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 0  0  o 1  133.437 3.5177  316.941     23.4489  316.941     23.4489  86.3834    1.33467e-05 16.3506     180         
1 1 1 29 0  1  o 2  124.856 2.48393 276.992     15.5142  276.992     15.5142  117.698    60          55.3591     60          
1 1 1 29 0  2  o 10 83.4362 2.57971 124.114     10.7396  124.114     10.7396  14.5352    300         6.72828     300         
1 1 1 29 0  3  o 10 57.6092 2.98208 59.7822     8.50107  59.7822     8.50107  8.64677    180         30.0262     8.4888e-06  
1 1 1 29 0  4  o 3  230.413 3.12394 942.393     36.042   942.393     36.042   168.563    60          3.44835     240         
1 1 1 29 0  5  o 18 22.1468 6.60517 12.3223     7.39304  12.3223     7.39304  8.93056    120         20.1278     120         
1 1 1 29 0  6  o 3  13.9589 5.75412 4.12239     6.66385  4.12239     6.66385  30.1095    180         62.8505     180         
1 1 1 29 0  7  o 6  119.529 2.59737 253.988     15.5252  253.988     15.5252  98.7055    240         72.644      240         
1 1 1 29 0  8  o 1  213.629 2.85958 809.993     30.5894  809.993     30.5894  127.793    120         59.7632     300         
1 1 1 29 0  9  o 10 82.2093 2.78312 120.639     11.4059  120.639     11.4059  36.7952    8.2714e-07  41.6195     180         
1 1 1 29 0  10 o 7  50.7832 3.39422 46.9465     8.45018  46.9465     8.45018  1.35377    60          42.9993     60          
1 1 1 29 0  11 o 8  201.834 2.84657 723.111     28.7665  723.111     28.7665  156.885    300         16.3012     300         
1 1 1 29 0  12 o 5  55.0001 3.52132 54.9557     9.51359  54.9557     9.51359  5.62714    180         27.6313     8.96973e-06 
1 1 1 29 0  13 o 17 380.278 4.21245 2567.85     80.2335  2567.85     80.2335  306.214    60          52.7078     60          
1 1 1 29 0  14 o 17 193.577 2.80292 665.199     27.1653  665.199     27.1653  204.843    300         125.055     300         
1 1 1 29 0  15 o 15 179.288 2.7468  570.696     24.6535  570.696     24.6535  81.8994    180         99.6829     360         
1 1 1 29 0  16 o 1  74.2843 3.14491 98.8992     11.6105  98.8992     11.6105  8.99608    60          87.9326     240         
1 1 1 29 0  17 o 19 97.6482 2.66319 169.8       12.9884  169.8       12.9884  31.8903    300         79.018      120         
1 1 1 29 0  18 o 12 258.238 3.49283 1184.11     45.1646  1184.11     45.1646  287.764    360         197.06      360         
1 1 1 29 0  19 o 2  11.1539 5.06756 0.113766    6.46535  0.113766    6.46535  19.4881    60          40.127      60          
1 1 1 29 0  20 o 17 104.623 2.62397 194.792     13.7184  194.792     13.7184  30.0257    300         92.864      120         
1 1 1 29 0  21 o 16 67.0455 3.26655 80.8506     10.8537  80.8506     10.8537  20.8939    180         0.912312    3.58023e-05 
1 1 1 29 0  22 o 7  220.039 2.91038 859.452     32.0676  859.452     32.0676  127.046    60          66.9707     240         
1 1 1 29 0  23 o 13 258.757 3.13838 1188.52     40.6696  1188.52     40.6696  237.935    300         98.7832     300         
1 1 1 29 0  24 o 11 205.055 2.73456 746.365     28.0782  746.365     28.0782  165.872    360         33.3051     360         
1 1 1 29 0  25 o 6  155.161 2.57289 427.564     19.9813  427.564     19.9813  101.933    60          21.6493     240         
1 1 1 29 0  26 f 0  176.013 2.61569 550.063     23.0493  550.063     23.0493  88.1559    120         0           0           
1 1 1 29 0  27 o 4  277.001 3.24346 1362.32     44.9967  1362.32     44.9967  258.715    1.19221e-09 115.982     1.19221e-09 
1 1 1 29 0  28 o 17 230.936 2.95632 946.904     34.1888  946.904     34.1888  146.979    60          40.2216     240         
1 1 1 29 0  29 o 11 328.786 3.40395 1919.51     56.0593  1919.51     56.0593  291.901    120         108.775     120         
1 1 1 29 0  30 o 17 244.735 2.92774 1063.41     35.8847  1063.41     35.8847  253.63     180         154.246     180         
1 1 1 29 0  31 f 0  156.656 2.58541 435.96      20.2722  435.96      20.2722  90.2248    60          0           0           
1 1 1 29 0  32 o 3  150.691 2.89996 403.773     21.8632  403.773     21.8632  114.914    120         13.2084     120         
1 1 1 29 0  33 o 6  33.5319 6.10811 23.574      8.87038  23.574      8.87038  5.20694    360         35.8103     360         
1 1 1 29 0  34 f 0  118.101 2.72251 248.253     16.0745  248.253     16.0745  116.431    60          0           0           
1 1 1 29 0  35 o 19 249.988 3.03371 1110.25     37.9809  1110.25     37.9809  162.889    120         31.5899     300         
1 1 1 29 0  36 o 19 63.3371 3.49484 72.5454     10.9333  72.5454     10.9333  43.9651    180         19.7824     180         
1 1 1 29 0  37 o 18 88.0717 2.95469 138.628     12.9738  138.628     12.9738  76.9975    240         29.4971     240         
1 1 1 29 0  38 o 19 83.1274 3.0664  123.71      12.6944  123.71      12.6944  57.9538    300         1.99921     120         
1 1 1 29 0  39 o 19 266.257 3.32712 1260.96     44.3634  1260.96     44.3634  197.274    360         17.0253     360         
1 1 1 29 0  40 o 14 14.2625 6.18452 3.03252     8.48963  3.03252     8.48963  10.8963    60          24.8758     60          
1 1 1 29 0  41 o 4  17.4987 6.63755 7.86811     7.99867  7.86811     7.99867  15.6853    300         39.0055     300         
1 1 1 29 0  42 o 1  17.0716 6.58817 7.37122     8.01272  7.37122     8.01272  0.31418    360         0.780675    360         
1 1 1 29 0  43 o 6  18.5626 6.81428 9.06114     8.21274  9.06114     8.21274  11.7539    240         30.7261     240         
1 1 1 29 0  44 o 6  50.17   3.88021 46.422      9.45933  46.422      9.45933  27.724     300         8.36232     120         
1 1 1 29 0  45 o 9  10.8134 5.09193 -2.21283    7.44753  -2.21283    7.44753  26.5785    180         57.8231     180         
1 1 1 29 0  46 o 15 74.5429 3.13344 99.9148     11.6098  99.9148     11.6098  64.144     60          24.5694     60          
1 1 1 29 0  47 o 14 21.4405 7.06418 12.1418     8.44134  12.1418     8.44134  1.03362    120         8.35472     120         
1 1 1 29 0  48 o 4  102.7   2.91743 188.59      14.96    188.59      14.96    81.4981    180         20.496      180         
1 1 1 29 0  49 o 18 68.5427 3.43643 85.0276     11.6651  85.0276     11.6651  72.2       240         50.1872     240         
1 1 1 29 0  50 o 10 90.3927 3.04457 146.562     13.7202  146.562     13.7202  78.6256    300         32.5057     300         
1 1 1 29 0  51 o 15 19.4191 7.25003 10.046      9.41464  10.046      9.41464  0.315793   8.65173e-06 8.85541     8.65175e-06 
1 1 1 29 0  52 o 4  171.608 2.63173 525.082     22.6089  525.082     22.6089  140.586    240         45.6769     240         
1 1 1 29 0  53 o 11 54.204  3.80405 54.125      10.0825  54.125      10.0825  46.9245    300         19.9275     300         
1 1 1 29 0  54 o 8  23.569  7.33421 14.6097     9.07027  14.6097     9.07027  3.97986    8.65139e-06 38.1693     8.65138e-06 
1 1 1 29 0  55 o 1  43.2988 5.08542 36.4543     10.1206  36.4543     10.1206  19.9622    240         15.6294     240         
1 1 1 29 0  56 o 4  10.3985 5.03118 -5.00451    8.29262  -5.00451    8.29262  16.1268    300         39.8024     300         
1 1 1 29 0  57 o 5  111.529 2.93756 223.028     16.3668  223.028     16.3668  71.3521    360         8.05719     180         
1 1 1 29 0  58 o 2  8.36139 4.22287 -11.7027    7.9837   -11.7027    7.9837   18.8678    60          43.4115     60          
1 1 1 29 0  59 o 10 15.4846 6.51316 5.09471     8.843    5.09471     8.843    0.182416   300         2.19846     300         
1 1 1 29 0  60 o 17 24.1632 7.66183 15.7204     9.89595  15.7204     9.89595  8.67223    360         1.17193     360         
1 1 1 29 0  61 o 10 86.4939 3.23536 135.315     13.9337  135.315     13.9337  58.4251    60          1.44599     60          
1 1 1 29 0  62 o 7  43.7067 6.00021 38.7068     11.7196  38.7068     11.7196  12.9129    300         32.2917     120         
1 1 1 29 0  63 o 19 54.7483 4.98138 57.4114     13.0466  57.4114     13.0466  40.4695    180         8.39031     180         
1 1 1 29 0  64 o 2  17.5599 7.15029 7.90319     10.0949  7.90319     10.0949  2.9415     240         7.89516     60          
1 1 1 29 0  65 o 3  10.0369 4.9222  -6.59164    8.60198  -6.59164    8.60198  5.10357    120         14.8656     120         
1 1 1 29 0  66 o 11 99.492  3.12875 179.358     15.5294  179.358     15.5294  69.1005    180         7.76342     180         
1 1 1 29 0  67 o 8  11.6111 5.60028 -4.8873     10.1008  -4.8873     10.1008  0.942627   240         3.28992     240         
1 1 1 29 0  68 o 11 10.9091 5.34898 -7.42047    10.147   -7.42047    10.147   0.406689   300.001     1.21912     300.001     
1 1 1 29 0  69 o 3  9.33278 4.70856 -13.357     9.82611  -13.357     9.82611  0.879664   360         2.27746     360         
1 1 1 29 0  70 o 10 12.1383 5.99825 -11.1231    13.4475  -11.1231    13.4475  5.44602    240         19.3828     240         
1 1 1 29 0  71 o 10 18.4339 8.01631 7.37445     14.3583  7.37445     14.3583  3.92539    300         3.44981     120         
1 1 1 29 0  72 o 16 22.0181 8.82978 14.4019     15.0633  14.4019     15.0633  6.97257    180         0.799825    180         
1 1 1 29 0  73 o 7  24.548  9.25216 18.9718     15.4537  18.9718     15.4537  1.62486    60          0.714253    59.9999     
1 1 1 29 0  74 o 10 44.6061 8.69953 47.1823     16.8159  47.1823     16.8159  33.2471    120         9.87768     120         
1 1 1 29 0  75 o 6  97.4279 4.18003 177.768     20.2352  177.768     20.2352  83.3418    180         43.3542     180         
1 1 1 29 0  76 o 11 41.0402 7.86524 39.6705     13.9799  39.6705     13.9799  32.7828    240         15.6291     240         
1 1 1 29 0  77 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 0  78 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 1  0  o 18 108.872 2.53    210.802     13.7699  210.802     13.7699  22.8416    360         115.422     180         
1 1 1 29 1  1  o 3  43.8938 3.6011  32.0455     7.75899  37.3924     7.74359  11.6311    269.034     53.2454     269.034     
1 1 1 29 1  2  o 17 246.048 2.94744 1073.75     36.3594  1074.57     36.3273  181.587    190.572     6.45366     190.572     
1 1 1 29 1  3  o 1  52.9095 3.20504 49.1279     8.55214  50.9727     8.26968  21.4366    246.681     102.337     246.681     
1 1 1 29 1  4  o 5  185.141 2.76438 598.71      25.6275  617.534     25.6654  116.059    275.536     33.0247     95.5357     
1 1 1 29 1  5  f 0  107.374 2.57749 200.774     14.158   208.729     13.5161  31.0503    280.594     0           0           
1 1 1 29 1  6  o 3  82.6848 2.70733 127.897     10.89    115.345     11.4271  16.1655    85.3887     74.6213     265.389     
1 1 1 29 1  7  o 19 52.6116 3.41896 50.6983     8.98757  48.4159     8.83877  11.5886    88.9552     77.2808     88.9552     
1 1 1 29 1  8  o 18 329.036 3.59622 1944.53     59.3017  1900.34     59.2911  297.958    215.799     116.847     215.799     
1 1 1 29 1  9  o 13 99.525  2.68059 175.905     13.377   176.028     13.3135  35.4541    56.1315     62.2921     236.132     
1 1 1 29 1  10 o 3  104.604 2.66429 186.232     13.9346  202.65      13.9337  61.0465    92.5891     14.1071     272.589     
1 1 1 29 1  11 o 4  301.386 3.41024 1626.85     51.509   1598.38     51.5028  214.958    216.007     9.05646     36.0071     
1 1 1 29 1  12 o 2  70.4892 2.91361 92.3823     9.92095  84.6319     10.5213  17.1567    173.984     47.0015     353.984     
1 1 1 29 1  13 o 3  190.414 2.81369 660.675     25.4743  626.147     28.0767  110.253    278.003     52.3591     98.003      
1 1 1 29 1  14 o 16 185.707 2.66617 620.672     23.7281  602.994     25.819   77.3255    296.627     112.268     116.627     
1 1 1 29 1  15 o 15 80.2355 2.82086 113.116     11.2794  115.904     11.3337  37.6959    31.9329     17.378      211.933     
1 1 1 29 1  16 o 5  324.14  3.70148 1893.89     55.5705  1838.65     64.2289  247.872    177.969     24.6417     177.969     
1 1 1 29 1  17 o 5  142.396 2.66021 359.675     18.9165  360.283     19.0168  103.957    174.122     11.8554     174.122     
1 1 1 29 1  18 o 5  300.636 3.35281 1604.35     49.382   1605.23     51.6213  240.158    170.664     45.1572     170.664     
1 1 1 29 1  19 o 1  170.613 2.66718 504.576     22.2646  528.481     23.3481  107.376    302.892     26.8025     122.892     
1 1 1 29 1  20 o 6  86.9678 2.83411 138.626     12.4764  130.446     12.16    27.3196    313.138     59.1517     133.138     
1 1 1 29 1  21 o 17 54.8572 3.57302 48.4108     9.39085  59.7049     10.0019  8.00884    138.179     30.3818     318.179     
1 1 1 29 1  22 o 18 61.0417 3.22768 72.6455     9.63658  60.6915     9.87675  15.8726    235.906     30.7652     55.906      
1 1 1 29 1  23 o 7  87.4933 2.7586  141.938     11.9378  130.445     12.1646  28.7111    86.4008     58.3979     266.401     
1 1 1 29 1  24 o 10 140.324 2.7295  346.42      18.5987  353.097     19.746   92.0694    289.023     11.1644     109.023     
1 1 1 29 1  25 o 11 326.145 3.50236 1879.7      55.9657  1901.06     58.5076  263.756    224.35      57.2084     224.35      
1 1 1 29 1  26 o 8  33.2717 4.85054 20.7992     7.4485   20.0932     8.1822   30.5336    325.986     93.744      325.986     
1 1 1 29 1  27 o 6  224.351 2.94531 903.41      33.095   884.441     33.1311  157.824    201.501     5.21685     21.5009     
1 1 1 29 1  28 o 10 254.401 2.96236 1160.71     36.0838  1138.47     39.3453  196.745    291.327     29.0857     291.327     
1 1 1 29 1  29 o 1  46.7613 3.80485 37.8079     8.27837  41.061      9.23134  10.4669    176.16      21.131      356.16      
1 1 1 29 1  30 o 10 32.5148 4.97804 22.8742     7.69388  16.4254     8.08921  17.1362    289.59      64.4694     289.59      
1 1 1 29 1  31 o 3  117.335 2.60185 260.324     14.558   229.646     15.8469  100.357    243.396     42.8044     243.396     
1 1 1 29 1  32 o 13 123.177 2.69798 266.846     16.0731  272.783     17.1874  101.818    250.867     35.8031     250.867     
1 1 1 29 1  33 o 3  83.2733 2.74604 118.423     11.084   128.668     11.7757  57.8253    303.852     8.72261     303.852     
1 1 1 29 1  34 o 1  175.666 2.57688 548.993     22.1814  547.54      23.1764  124.826    227.672     2.43555     227.672     
1 1 1 29 1  35 o 9  33.4149 5.06295 28.0737     8.2458   14.0101     8.36599  8.61826    151.512     48.1594     151.512     
1 1 1 29 1  36 o 18 184.022 2.7383  609.826     24.6426  594.568     25.8308  149.69     72.2737     41.3539     72.2737     
1 1 1 29 1  37 o 19 171.924 2.61977 527.413     22.587   523.748     22.5559  146.07     111.505     52.3708     111.505     
1 1 1 29 1  38 o 16 87.5604 2.9107  131.039     13.0655  142.652     12.3469  52.4083    278.699     12.3152     98.6987     
1 1 1 29 1  39 o 9  99.8179 2.84712 175.752     14.2703  179.636     14.1525  70.7345    227.52      7.00917     227.52      
1 1 1 29 1  40 o 15 63.9929 3.53631 80.1614     11.1979  67.2979     11.2275  12.873     323.736     58.4329     143.736     
1 1 1 29 1  41 o 8  121.74  2.94491 268.053     18.5032  261.008     17.3715  85.0737    112.719     3.50865     112.719     
1 1 1 29 1  42 o 10 67.7288 3.67843 83.2696     12.359   81.8959     12.4189  31.1269    200.518     25.2948     20.5181     
1 1 1 29 1  43 o 8  53.5077 4.15166 59.1614     10.2166  45.3347     11.2866  25.9554    67.7263     10.9874     247.726     
1 1 1 29 1  44 o 7  79.8822 3.3002  116.201     12.5557  112.798     13.7041  40.0668    199.404     26.6003     19.4038     
1 1 1 29 1  45 o 14 82.2016 3.27249 126.682     12.7263  115.968     14.0112  59.561     297.806     10.0756     297.806     
1 1 1 29 1  46 o 14 39.2034 5.27138 28.156      9.6702   29.5186     10.2867  17.0203    290.502     11.1887     110.502     
1 1 1 29 1  47 o 6  142.927 2.81307 354.827     19.5193  375.833     20.7438  108.476    93.504      20.062      93.504      
1 1 1 29 1  48 o 18 39.1539 4.99082 25.9074     9.37474  31.6624     9.45865  18.6162    85.4364     9.83495     265.436     
1 1 1 29 1  49 o 9  19.9517 5.42425 9.15908     8.1934   -0.89604    7.89493  0.770356   40.8259     12.718      40.8259     
1 1 1 29 1  50 o 17 67.4108 3.46521 85.6542     11.5836  78.8636     11.6492  39.1855    23.2015     11.2942     203.202     
1 1 1 29 1  51 o 10 56.9481 3.95623 59.829      11.4742  58.7499     10.8099  8.24287    359.718     59.4707     179.718     
1 1 1 29 1  52 f 0  130.754 2.86176 310.072     18.7303  304.046     18.7272  73.9801    8.46364     0           0           
1 1 1 29 1  53 o 9  21.9955 5.86789 5.39281     8.86923  8.50246     8.8688   2.5471     79.7408     27.5781     79.7408     
1 1 1 29 1  54 o 9  88.7258 3.12779 140.705     13.9028  143.601     13.8223  55.6062    63.1927     7.67001     243.193     
1 1 1 29 1  55 o 18 52.8847 4.31195 57.9709     11.0918  45.9442     11.1778  38.5276    122.713     10.2818     122.713     
1 1 1 29 1  56 f 0  72.9705 3.31871 102.009     12.2957  91.3958     11.84    47.1816    273.167     0           0           
1 1 1 29 1  57 o 10 85.2118 3.21348 123.674     13.7194  139.723     13.5748  56.6775    167.153     0.284207    167.153     
1 1 1 29 1  58 o 5  117.208 2.92312 243.685     17.126   252.298     17.1562  86.4353    309.771     16.3865     309.771     
1 1 1 29 1  59 o 17 103.689 3.04842 195.882     15.7826  193.624     15.8284  71.1733    318.925     4.46217     318.926     
1 1 1 29 1  60 o 4  39.8562 5.54528 27.498      11.0542  34.7994     10.2435  13.9427    75.3658     22.6437     255.366     
1 1 1 29 1  61 o 3  35.9341 5.82228 19.7585     9.85313  32.3069     10.8536  23.4661    207.061     4.67525     207.061     
1 1 1 29 1  62 o 10 31.0618 5.92761 23.9419     9.63438  15.0368     9.56354  14.1308    105.075     8.50583     285.075     
1 1 1 29 1  63 o 14 50.4582 4.78827 51.2926     12.097   46.6934     11.5082  31.3077    199.595     1.48963     19.5952     
1 1 1 29 1  64 o 14 38.9622 5.8978  29.6131     11.4025  32.1086     10.9343  21.7413    279.615     4.08715     99.6147     
1 1 1 29 1  65 o 7  28.4198 6.63238 9.72734     9.98197  23.6107     12.5025  12.4368    235.56      6.52228     55.56       
1 1 1 29 1  66 o 16 52.8022 5.15628 60.2768     12.8487  49.4842     13.471   40.4289    7.32233     15.7526     7.32233     
1 1 1 29 1  67 o 17 42.874  6.13096 48.7797     12.3297  28.1154     13.0651  25.1042    13.77       1.5274      193.77      
1 1 1 29 1  68 o 16 52.1897 5.44722 53.3638     13.796   55.4843     13.8379  36.432     107.518     8.92963     107.518     
1 1 1 29 1  69 o 9  25.9619 7.23292 3.96169     13.992   17.8333     14.5279  8.6317     357.313     9.87353     177.313     
1 1 1 29 1  70 o 15 25.9568 7.25579 18.8795     14.7297  1.45032     14.5791  12.0538    62.7688     0.148048    242.769     
1 1 1 29 1  71 o 14 20.1745 6.44675 -7.20877    14.2932  1.29057     13.8025  5.31541    275.236     3.17167     95.2357     
1 1 1 29 1  72 o 13 20.609  6.56351 3.61991     14.8939  -7.10112    13.8754  5.28474    214.401     1.8014      34.4015     
1 1 1 29 1  73 o 6  19.3595 6.29228 -12.8968    14.5713  1.52264     14.0378  3.58858    327.503     3.14624     147.503     
1 1 1 29 1  74 o 18 16.8281 5.78466 -10.2925    18.1604  -12.8171    9.81521  0.254441   315.319     1.34009     135.319     
1 1 1 29 1  75 o 14 43.8735 7.01453 63.6817     17.4377  28.9514     13.3675  29.3005    40.9619     9.11043     40.9619     
1 1 1 29 1  76 f 0  26.7759 7.0869  6.52649     15.6756  22.4181     12.3984  7.61423    91.0221     0           0           
1 1 1 29 1  77 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 2  0  o 14 31.9271 5.21647 20.7319     7.26287  20.7319     7.26287  32.9873    4.67064e-05 88.6836     4.67064e-05 
1 1 1 29 2  1  o 3  297.56  3.18823 1558.5      47.5418  1584.63     47.5413  175.05     355.553     86.0064     175.553     
1 1 1 29 2  2  o 11 340.156 3.41431 2083.56     58.2061  2025.06     58.19    269.738    18.8487     40.969      18.8487     
1 1 1 29 2  3  o 18 66.4028 2.89456 68.5443     8.89312  89.2051     10.2848  3.25719    37.8401     88.4398     37.8401     
1 1 1 29 2  4  o 1  90.6222 2.60527 155.894     11.7396  136.273     11.827   29.1361    297.226     17.1909     297.226     
1 1 1 29 2  5  o 16 155.748 2.41778 437.014     18.4397  423.506     19.2769  125.458    172.407     34.3459     172.407     
1 1 1 29 2  6  o 2  213.371 2.8377  798.19      29.7866  817.44      30.8997  227.896    251.808     158.197     251.808     
1 1 1 29 2  7  o 2  167.481 2.61486 504.163     20.6864  491.048     23.1056  99.0982    254.423     40.7188     74.4234     
1 1 1 29 2  8  o 9  249.061 2.90407 1104.11     35.4785  1097.32     36.9946  208.482    44.0546     56.6469     44.0546     
1 1 1 29 2  9  f 0  69.4749 2.79192 86.7225     9.40919  85.1103     9.93838  55.2087    226.237     0           0           
1 1 1 29 2  10 f 0  206.014 2.80974 738.199     29.6023  768.04      28.368   150.733    72.674      0           0           
1 1 1 29 2  11 o 6  167.427 2.63268 497.735     21.5734  496.855     22.5927  134.152    21.3852     33.0396     21.3852     
1 1 1 29 2  12 o 5  53.3654 3.39743 53.9153     8.66496  48.1149     9.23926  5.44098    311.776     22.857      131.776     
1 1 1 29 2  13 o 7  315.121 3.43975 1779.75     53.0906  1746.96     55.4977  251.014    144.188     42.8195     144.188     
1 1 1 29 2  14 o 14 186.007 2.71604 624.794     24.715   603.057     25.8803  120.241    348.601     25.7438     168.601     
1 1 1 29 2  15 o 7  134.563 2.64189 334.383     17.7846  308.881     17.7907  118.907    212.834     59.8561     212.834     
1 1 1 29 2  16 o 16 217.201 2.81263 838.598     28.018   835.751     32.9991  190.622    315.318     71.0316     315.318     
1 1 1 29 2  17 o 11 88.0216 2.88882 143.322     11.1912  132.393     13.9419  46.0301    26.2544     19.0104     206.254     
1 1 1 29 2  18 o 4  153.684 2.5897  429.909     19.2238  408.618     20.5809  101.938    28.8789     12.331      208.879     
1 1 1 29 2  19 o 3  196.171 2.73332 682.589     25.8643  683.305     27.8424  149.267    58.2211     18.63       58.2211     
1 1 1 29 2  20 o 18 242.403 2.89757 1042.96     33.1121  1043.16     37.169   133.217    238.382     84.3277     58.3815     
1 1 1 29 2  21 o 13 194.364 2.77701 676.058     26.6665  665.058     27.4189  141.468    277.941     5.29217     277.941     
1 1 1 29 2  22 o 11 158.411 2.85354 458.739     22.4773  432.757     22.7834  75.2861    277.997     75.1419     97.9975     
1 1 1 29 2  23 o 9  282.596 3.39422 1429.29     46.8406  1409.05     49.248   216.304    82.8531     24.24       82.8531     
1 1 1 29 2  24 o 3  37.9063 4.65907 23.4235     7.95897  29.4149     9.11554  12.3398    218.058     60.0134     218.058     
1 1 1 29 2  25 o 18 134.673 2.78823 323.204     18.7534  321.439     18.8414  72.5743    335.662     44.7854     155.662     
1 1 1 29 2  26 o 17 132.271 2.63755 304.1       17.3317  317.705     17.5987  95.8616    245.721     7.05544     245.721     
1 1 1 29 2  27 o 19 62.8178 3.54043 71.7822     10.4219  69.4819     11.6239  5.52713    94.1392     71.0719     274.139     
1 1 1 29 2  28 o 7  99.8626 2.82772 175.235     14.3136  179.663     13.9224  76.9075    149.608     20.9552     149.608     
1 1 1 29 2  29 o 14 126.482 2.71738 295.143     16.2747  273.95      18.0054  102.317    42.8713     30.3503     42.8713     
1 1 1 29 2  30 o 7  24.8344 5.36425 4.5236      7.35704  16.8734     8.17202  22.7576    140.517     63.9887     140.517     
1 1 1 29 2  31 o 7  88.7628 2.8477  135.77      12.7497  144.965     12.4985  69.2393    272.639     24.2567     272.639     
1 1 1 29 2  32 o 11 95.1569 2.82224 162.653     12.8179  159.854     14.0007  86.2659    35.4352     61.7742     35.4352     
1 1 1 29 2  33 o 15 119.653 2.55817 252.863     14.9281  256.432     15.7107  79.7184    32.6044     6.19954     212.604     
1 1 1 29 2  34 o 8  169.742 2.63516 495.995     22.3354  528.665     22.4838  138.219    140.689     38.0315     140.689     
1 1 1 29 2  35 o 14 108.401 2.60716 209.684     13.7015  208.659     14.5678  95.2685    295.113     45.5566     295.113     
1 1 1 29 2  36 o 10 48.1122 3.74688 39.8949     8.53251  43.7923     9.24141  2.02312    23.6025     64.7066     23.6025     
1 1 1 29 2  37 o 3  75.7193 3.0418  105.298     11.3983  99.6828     11.5787  48.1529    357.258     2.37066     177.258     
1 1 1 29 2  38 o 11 43.8005 4.47601 35.1162     10.0076  35.1066     9.04345  13.9949    76.1423     1.46906     256.142     
1 1 1 29 2  39 o 8  171.257 2.80443 516.497     24.7187  528.568     23.3818  125.695    309.903     11.9017     309.903     
1 1 1 29 2  40 o 10 52.9756 3.96268 50.1916     10.4248  51.5092     10.2928  24.629     335.244     10.928      335.244     
1 1 1 29 2  41 o 5  15.7968 5.03507 -5.66383    8.65192  -2.81258    8.24235  20.7803    77.1655     49.3497     77.1655     
1 1 1 29 2  42 o 8  53.772  3.80868 51.8934     10.1089  52.8099     10.1414  20.2369    149.929     26.8062     329.929     
1 1 1 29 2  43 o 9  22.1042 5.76036 6.17347     8.00061  8.25218     8.82727  11.8276    124.24      41.2728     124.24      
1 1 1 29 2  44 o 13 145.599 2.8331  368.874     21.0617  388.776     20.199   105.752    71.0735     9.72229     71.0735     
1 1 1 29 2  45 o 9  125.703 2.71011 263.633     17.3264  301.644     16.6662  88.6358    243.914     3.53566     243.914     
1 1 1 29 2  46 o 4  109.509 2.763   213.814     14.6335  215.26      15.6304  92.218     327.773     34.6497     327.773     
1 1 1 29 2  47 o 16 79.1226 3.03386 109.753     11.1471  115.209     12.7976  36.8783    235.654     33.9659     55.6539     
1 1 1 29 2  48 o 8  35.2292 5.13115 25.073      7.99671  21.8934     9.47729  11.8698    355.984     18.7468     175.984     
1 1 1 29 2  49 o 12 81.0034 3.44147 122.305     12.8423  114.892     14.8124  41.9542    164.495     25.9021     344.495     
1 1 1 29 2  50 o 3  92.0892 3.22016 153.862     14.6451  152.024     14.9799  67.6862    145.088     10.8984     145.088     
1 1 1 29 2  51 o 17 30.7434 5.97545 23.1781     9.31825  12.894      10.2697  12.646     121.446     2.58535     121.446     
1 1 1 29 2  52 o 11 85.6255 3.6237  141.668     15.1138  124.945     15.7411  38.924     125.04      37.9415     305.04      
1 1 1 29 2  53 o 10 26.6801 5.93924 4.83457     9.71287  20.1296     9.51906  8.85004    85.9361     7.28917     265.936     
1 1 1 29 2  54 o 15 142.07  2.8777  350.192     19.8081  376.555     21.1329  102.193    237.761     11.6606     237.761     
1 1 1 29 2  55 o 15 21.8395 5.73079 11.7246     8.81083  1.18013     8.77753  3.80574    359.442     6.61342     179.442     
1 1 1 29 2  56 o 3  86.7986 3.2227  133.367     13.9834  139.83      13.9475  62.7135    134.063     9.83096     134.063     
1 1 1 29 2  57 o 4  48.6081 4.56848 37.5862     10.3931  51.6305     11.1833  29.1725    317.149     3.85996     137.149     
1 1 1 29 2  58 o 9  89.2879 3.25483 137.113     13.9049  153.129     15.1335  81.6178    100.8       45.4856     100.8       
1 1 1 29 2  59 o 1  41.1424 5.53705 36.7107     10.0784  29.563      11.7525  16.566     151.734     19.315      331.734     
1 1 1 29 2  60 o 16 41.6994 5.43435 29.2659     10.9553  39.1531     10.829   28.2244    300.214     4.8994      300.214     
1 1 1 29 2  61 o 9  70.0142 3.93271 104.352     12.7754  78.9282     14.089   49.9097    3.41521     8.34773     3.41521     
1 1 1 29 2  62 o 11 77.9258 3.53321 107.256     13.7328  117.246     13.6916  65.5431    130.307     29.6783     130.307     
1 1 1 29 2  63 o 1  41.9041 5.36557 32.2249     10.6367  37.6083     11.0623  25.7929    62.1855     0.286107    242.186     
1 1 1 29 2  64 o 9  43.4038 5.39288 37.4023     11.807   37.6366     10.7707  28.4761    20.8483     3.53118     20.8483     
1 1 1 29 2  65 f 0  34.5115 6.64919 26.3263     12.3094  24.3789     11.3139  30.6052    121.34      0           0           
1 1 1 29 2  66 f 0  46.5977 5.94717 48.7446     12.987   40.1727     13.6495  29.8498    266.565     0           0           
1 1 1 29 2  67 o 19 25.3079 6.67517 16.0402     11.6691  7.19641     11.5201  8.6708     204.02      7.11746     24.02       
1 1 1 29 2  68 o 2  16.5017 5.61617 -14.8242    15.9982  -12.1587    10.4073  0.713197   24.3764     4.74192     204.376     
1 1 1 29 2  69 o 13 19.9814 6.38052 0.431899    13.7341  -6.13754    13.5825  4.99917    139.583     5.52217     319.583     
1 1 1 29 2  70 o 7  29.1258 7.30811 30.0797     15.312   2.01106     14.4512  13.7818    248.409     4.57954     68.409      
1 1 1 29 2  71 o 2  23.592  7.01058 -5.20326    15.0104  14.7764     14.7171  5.90468    94.0503     1.68289     94.0503     
1 1 1 29 2  72 o 7  21.1347 6.69664 4.70052     15.0271  -5.10259    14.5177  5.94355    251.123     5.45481     71.1231     
1 1 1 29 2  73 o 13 38.8988 7.35279 30.7859     16.9055  40.4896     13.2244  26.1341    241.901     9.46222     241.901     
1 1 1 29 2  74 o 16 37.3113 7.4473  37.0395     15.917   30.8915     13.1609  24.0234    359.025     10.477      359.025     
1 1 1 29 2  75 o 16 20.4969 6.47988 8.64062     15.2275  -4.69565    11.9632  2.23545    105.715     7.64545     285.715     
1 1 1 29 2  76 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 3  0  o 5  166.816 2.41722 493.935     20.1884  493.935     20.1884  170.714    9.15242e-06 94.0835     9.15242e-06 
1 1 1 29 3  1  o 11 27.9789 4.81852 14.4366     6.73529  14.5343     6.65007  33.4358    20.3921     83.5569     20.3921     
1 1 1 29 3  2  o 5  81.663  2.58775 115.44      10.5284  121.686     10.5944  5.81171    167.062     122.176     167.062     
1 1 1 29 3  3  o 9  98.9818 2.49914 168.855     12.3689  179.249     12.3765  44.2812    78.8542     44.304      258.854     
1 1 1 29 3  4  o 13 133.092 2.48334 315.236     16.1945  313.621     16.8938  66.8181    185.4       53.8183     5.40048     
1 1 1 29 3  5  o 11 235.067 2.69143 981.272     32.2744  979.477     31.1273  151.458    58.4777     39.4697     238.478     
1 1 1 29 3  6  o 6  81.4941 2.70561 128.687     10.951   107.955     11.0147  37.3928    210.388     16.0563     210.388     
1 1 1 29 3  7  o 4  242.671 2.85591 1044.4      33.3079  1045.66     36.1001  169.239    17.0898     14.7885     197.09      
1 1 1 29 3  8  o 17 98.3921 2.51145 171.126     12.0598  172.797     12.6619  54.8329    166.19      36.7082     166.19      
1 1 1 29 3  9  o 18 100.9   2.52255 179.503     12.1026  182.166     13.3457  14.2847    349.918     111.528     169.918     
1 1 1 29 3  10 o 13 131.029 2.47155 295.668     15.4703  314.026     16.9587  47.4471    124.72      90.7092     304.72      
1 1 1 29 3  11 o 19 192.086 2.58295 660.548     24.3183  648.707     25.387   68.5457    73.0211     141.643     253.021     
1 1 1 29 3  12 o 19 141.449 2.48455 366.188     17.1719  344.116     17.9876  139.235    206.766     100.424     206.766     
1 1 1 29 3  13 f 0  213.702 2.72423 805.276     29.5566  815.553     28.7827  160.822    321.001     0           0           
1 1 1 29 3  14 o 10 139.32  2.55328 344.154     17.9599  345.075     17.6618  88.1495    251.83      19.2317     71.8297     
1 1 1 29 3  15 o 12 131.265 2.60304 301.461     17.6343  310.538     16.5416  83.3338    338.706     16.3598     158.706     
1 1 1 29 3  16 o 15 141.428 2.66746 357.836     17.9453  352.604     19.7732  108.6      68.7273     20.3113     68.7273     
1 1 1 29 3  17 o 16 109.919 2.65808 225.078     14.1907  204.515     14.9755  63.6919    152.784     23.089      332.784     
1 1 1 29 3  18 o 11 170.812 2.70131 503.518     21.9397  532.416     24.2991  90.6064    179.715     64.036      359.715     
1 1 1 29 3  19 o 6  73.8559 3.03569 97.4605     11.0636  96.9298     11.3089  41.5126    188.606     3.24829     8.60579     
1 1 1 29 3  20 o 5  124.948 2.511   278.187     14.7605  276.4       16.5931  89.8458    101.556     6.43839     101.556     
1 1 1 29 3  21 o 12 83.9136 2.91792 130.028     11.5112  120.755     12.8516  19.1422    129.727     76.3131     309.727     
1 1 1 29 3  22 o 7  146.311 2.84707 398.665     19.3923  362.412     22.0765  120.086    111.786     34.6187     111.786     
1 1 1 29 3  23 o 13 91.5819 2.73426 144.99      11.7362  153.458     13.2929  68.8015    269.068     17.7777     269.068     
1 1 1 29 3  24 o 16 356.929 3.58641 2297.56     60.2329  2234.97     67.7323  323.881    68.0483     129.993     68.0483     
1 1 1 29 3  25 o 17 132.389 2.62114 318.721     16.6284  304.319     18.0476  80.4045    87.8203     26.0953     267.82      
1 1 1 29 3  26 o 12 46.0725 4.05418 36.4695     8.86477  40.3733     9.45494  4.98327    225.382     40.7638     45.3816     
1 1 1 29 3  27 o 14 173.992 2.82432 568.466     23.159   508.583     25.793   124.677    240.002     1.38218     240.003     
1 1 1 29 3  28 f 0  129.735 2.61201 303.294     16.2648  295.212     17.6164  99.5044    123.417     0           0           
1 1 1 29 3  29 o 18 115.258 2.71756 238.312     14.8054  234.372     16.4829  84.8846    132.886     10.7005     132.886     
1 1 1 29 3  30 o 2  100.25  2.77534 177.625     14.0043  180.233     13.8255  71.0295    84.3541     5.85949     84.3541     
1 1 1 29 3  31 o 18 122.76  2.75208 269.736     16.1163  266.672     17.657   98.1983    136.654     26.7495     136.654     
1 1 1 29 3  32 o 5  138.1   2.72584 352.873     17.6422  326.182     19.8716  66.4355    348.269     62.2486     168.269     
1 1 1 29 3  33 o 10 72.6081 3.01854 94.06       10.5806  94.285      11.2785  27.2394    258.435     42.6912     78.4345     
1 1 1 29 3  34 o 18 155.422 2.75921 428.455     21.1519  431.465     21.809   114.365    22.0121     9.95009     22.0121     
1 1 1 29 3  35 f 0  75.063  3.23909 104.594     12.502   97.129      11.7547  16.229     181.809     0           0           
1 1 1 29 3  36 o 14 122.236 2.85253 258.851     17.2882  274.092     17.6087  96.8537    255.228     25.0252     255.228     
1 1 1 29 3  37 o 16 55.0159 3.83228 54.5165     10.2424  54.8521     10.6125  12.6446    245.553     45.2199     65.5525     
1 1 1 29 3  38 o 3  35.2296 5.28582 37.1994     9.33507  10.7341     9.46769  9.69423    344.037     59.4438     344.037     
1 1 1 29 3  39 o 4  94.3092 2.91014 152.088     13.5803  165.941     13.852   62.3302    43.5361     2.84353     223.536     
1 1 1 29 3  40 o 5  54.8725 3.7676  54.8331     10.0443  54.0994     10.4087  26.5349    7.43283     14.2246     187.433     
1 1 1 29 3  41 o 4  23.2517 5.57205 0.582206    8.05605  15.5974     8.9033   11.2371    285.753     41.4133     285.753     
1 1 1 29 3  42 o 14 20.5977 5.55869 7.29455     8.11437  3.47987     7.96658  8.19131    329.988     30.2135     329.988     
1 1 1 29 3  43 o 16 66.1991 3.36179 82.6927     11.0407  75.2284     11.0927  40.5128    229.108     7.34092     49.1084     
1 1 1 29 3  44 o 19 52.3107 4.00247 51.3258     10.0767  48.4113     10.5418  25.6726    249.314     17.5834     69.3139     
1 1 1 29 3  45 f 0  185.396 2.83454 613.33      26.2849  616.058     26.3864  107.528    22.7139     0           0           
1 1 1 29 3  46 o 1  26.6974 5.87284 14.4007     8.45678  11.8696     9.00325  6.99957    250.435     5.94483     70.4351     
1 1 1 29 3  47 o 16 77.4425 3.23152 106.025     12.4769  110.221     12.4908  66.4467    5.9196      29.5862     5.9196      
1 1 1 29 3  48 o 16 100.295 2.84792 172.937     13.8523  188.432     14.7222  74.6028    108.511     12.2508     108.511     
1 1 1 29 3  49 o 10 55.7122 4.06357 63.8642     10.8974  50.4093     11.2592  47.0929    298.311     24.421      298.311     
1 1 1 29 3  50 o 8  32.4805 5.53052 18.6259     8.91289  22.1147     8.90417  15.665     118.157     4.15181     298.157     
1 1 1 29 3  51 o 5  134.306 2.72462 325.944     17.7993  321.881     18.8174  111.68     215.811     39.9475     215.811     
1 1 1 29 3  52 o 4  95.6091 3.07585 168.781     14.1172  161.299     15.2247  65.778     303.625     2.14706     303.626     
1 1 1 29 3  53 o 4  28.2591 5.8896  17.3594     8.33957  13.0545     9.7262   10.7024    136.12      1.75252     136.12      
1 1 1 29 3  54 o 7  36.0925 5.65259 27.0396     8.54698  23.4478     11.3654  14.778     51.611      14.8041     231.611     
1 1 1 29 3  55 o 13 32.2832 6.00539 22.4097     8.55881  18.1632     11.4323  11.2086    345.731     16.4965     165.731     
1 1 1 29 3  56 o 17 41.4309 5.5605  35.0522     10.2955  31.5364     11.8627  25.9281    351.46      0.392659    351.46      
1 1 1 29 3  57 o 17 112.241 3.02901 230.955     16.0441  225.664     17.8887  73.7312    142.634     3.49083     322.635     
1 1 1 29 3  58 o 9  120.666 2.92988 251.106     17.0499  276.991     18.3397  103.182    244.976     44.8087     244.976     
1 1 1 29 3  59 o 15 33.228  6.42618 25.0923     9.92124  19.5452     12.4926  10.0628    234.943     21.2149     54.9429     
1 1 1 29 3  60 o 2  16.267  5.25088 -4.36575    8.64986  -4.43423    10.3094  0.940507   314.883     2.79169     134.883     
1 1 1 29 3  61 o 19 92.4174 3.1831  160.308     14.6807  152.839     14.7075  77.6224    340.863     33.4784     340.863     
1 1 1 29 3  62 f 0  57.0493 4.45222 61.6638     12.5743  62.6182     12.4578  34.4103    4.53472     0           0           
1 1 1 29 3  63 o 3  19.4135 5.81251 0.142252    10.0823  4.54884     9.62578  3.70547    166.986     8.77998     346.986     
1 1 1 29 3  64 o 4  27.1539 6.54855 11.7351     11.6695  17.4241     10.142   6.80464    159.366     17.5449     339.366     
1 1 1 29 3  65 o 3  23.6    6.39548 4.05678     11.8883  13.1402     10.1624  7.7873     338.089     3.28075     158.089     
1 1 1 29 3  66 o 8  48.7903 5.72587 45.7881     13.5603  50.8507     13.4223  31.2102    160.105     2.14113     160.105     
1 1 1 29 3  67 o 11 60.4074 5.74489 66.4351     18.3302  80.6714     14.4022  38.9792    289.006     1.46792     289.006     
1 1 1 29 3  68 o 16 19.2072 6.12247 -9.88799    14.062   1.80754     11.6155  3.17524    283.833     11.2371     103.833     
1 1 1 29 3  69 o 16 20.6876 6.60566 -2.1919     15.0995  -1.73766    14.0234  4.54053    132.591     0.458558    312.591     
1 1 1 29 3  70 o 13 25.5952 7.20828 0.948705    15.1136  18.896      14.3246  12.0141    33.4913     1.25802     33.4913     
1 1 1 29 3  71 o 4  40.9599 7.75014 44.1053     16.332   35.3395     16.2832  25.5802    344.773     2.80282     344.773     
1 1 1 29 3  72 o 8  27.5006 7.34818 0.700746    15.3349  27.9319     15.3903  10.043     14.2102     3.87095     14.2102     
1 1 1 29 3  73 o 1  31.9492 8.04321 23.1025     16.5535  29.0213     16.0952  16.8565    141.524     4.75414     141.524     
1 1 1 29 3  74 o 14 18.2442 6.10877 -6.85642    14.6418  -10.2765    15.137   0.540069   314.846     5.18101     134.846     
1 1 1 29 3  75 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 4  0  o 18 220.752 2.60911 864.752     28.8459  864.752     28.8459  223.862    180         119.799     180         
1 1 1 29 4  1  o 18 167.216 2.461   498.023     20.6492  494.059     20.5967  154.242    202.498     74.1062     202.498     
1 1 1 29 4  2  o 6  40.8476 3.86886 31.1772     7.60174  29.1973     7.82092  30.133     340.259     102.771     340.259     
1 1 1 29 4  3  o 19 80.5816 2.60035 114.787     10.666   116.116     10.2741  47.1565    194.405     6.48362     194.405     
1 1 1 29 4  4  o 7  219.117 2.6748  852.49      28.8988  851.415     29.8363  190.618    225.304     64.5809     225.304     
1 1 1 29 4  5  o 15 131.182 2.42584 315.94      16.2756  295.217     15.5944  108.099    233.33      37.3936     233.33      
1 1 1 29 4  6  o 9  47.3483 3.41987 37.9133     7.95466  42.6211     8.02655  2.40387    337.832     44.5257     337.832     
1 1 1 29 4  7  o 5  146.299 2.5283  377.052     18.5062  382.449     18.5666  70.0566    270.202     69.2112     90.2021     
1 1 1 29 4  8  o 6  247.404 2.84024 1078.15     34.5037  1094.69     35.9202  186.23     162.047     11.5785     162.047     
1 1 1 29 4  9  o 2  131.021 2.43823 309.051     16.2386  300.516     15.7533  87.2686    176.592     8.74966     356.592     
1 1 1 29 4  10 o 19 74.7504 2.7127  97.0799     10.0896  101.799     10.1635  38.2588    300.946     12.708      300.946     
1 1 1 29 4  11 o 14 327.799 3.26903 1889.68     54.6519  1927.44     52.7102  238.212    224.712     4.87735     44.7115     
1 1 1 29 4  12 o 11 147.819 2.50559 394.978     18.0988  380.527     18.9909  97.4495    44.4349     15.2698     224.435     
1 1 1 29 4  13 o 15 141.551 2.47052 358.433     17.0897  352.875     17.9277  91.0015    192.257     18.7787     12.2568     
1 1 1 29 4  14 o 19 266.384 2.94083 1275.75     38.4511  1244.31     40.0265  236.354    90.9824     85.0267     90.9824     
1 1 1 29 4  15 o 17 91.1801 2.67736 152.693     12.1084  143.041     12.2894  35.211     6.24211     54.277      186.242     
1 1 1 29 4  16 o 19 110.145 2.63321 211.795     14.124   219.425     14.9038  94.5269    12.7224     43.6632     12.7224     
1 1 1 29 4  17 o 15 166.114 2.59372 482.493     21.4694  497.171     21.7136  141.911    115.458     47.405      115.458     
1 1 1 29 4  18 o 19 225.566 2.89083 898.529     32.4111  908.697     32.9452  157.942    355.594     11.8214     175.594     
1 1 1 29 4  19 o 4  203.243 3.00588 744.937     32.5477  722.767     28.6108  160.832    9.40717     28.0496     9.40717     
1 1 1 29 4  20 o 10 150.41  2.66983 401.416     19.4627  402.243     20.7479  76.5922    67.2763     62.9413     247.276     
1 1 1 29 4  21 o 6  112.864 2.76297 222.379     15.5392  230.673     15.667   83.2049    232.589     10.0332     232.589     
1 1 1 29 4  22 o 16 168.734 2.75994 514.422     24.0798  497.1       22.5926  128.809    18.6503     16.0727     18.6504     
1 1 1 29 4  23 o 1  137.145 2.68806 340.448     17.0118  328.306     19.7437  89.1761    157.83      16.361      337.83      
1 1 1 29 4  24 o 5  241.917 2.99699 1047.77     33.8852  1032.96     38.5928  229.533    243.221     110.593     243.221     
1 1 1 29 4  25 o 6  168.991 2.79298 525.727     22.528   489.916     24.6134  131.69     345.096     22.1919     345.096     
1 1 1 29 4  26 o 18 123.551 2.7668  284.051     15.2621  259.359     18.6067  117.077    317.829     65.8566     317.829     
1 1 1 29 4  27 o 16 187.02  2.80007 651.092     24.2906  593.11      27.8619  161.407    297.781     55.9913     297.781     
1 1 1 29 4  28 o 18 331.062 3.42138 1978.25     53.3232  1926.15     59.9123  243.232    262.699     7.55853     262.699     
1 1 1 29 4  29 o 2  19.9033 5.46142 3.98629     7.73728  5.05919     7.85248  23.1964    306.18      58.7522     306.18      
1 1 1 29 4  30 o 2  91.5291 2.82441 161.185     12.2669  137.889     13.4023  65.8802    102.421     8.33545     102.421     
1 1 1 29 4  31 o 12 28.8955 5.74866 17.1005     8.26432  13.6681     9.20496  0.650231   230.427     5.51255     230.427     
1 1 1 29 4  32 o 2  114.417 3.00041 239.89      16.6787  227.13      17.6201  83.0422    122.258     7.14544     122.258     
1 1 1 29 4  33 o 15 178.307 2.92968 563.773     24.8871  568.796     27.4189  105.732    319.018     42.5044     139.018     
1 1 1 29 4  34 o 1  91.9112 2.99013 149.375     13.0626  152.37      14.3879  81.4056    53.5095     42.6313     53.5095     
1 1 1 29 4  35 o 4  120.764 2.91582 269.669     17.1815  250.994     18.0021  93.5629    143.025     19.7267     143.025     
1 1 1 29 4  36 o 3  114.216 2.78972 229.296     15.369   236.252     16.5124  81.1737    56.6304     4.34581     56.6305     
1 1 1 29 4  37 o 4  140.72  2.71964 357.945     18.1097  348.441     20.1271  107.205    124.752     17.9251     124.752     
1 1 1 29 4  38 o 2  199.154 2.75185 728.664     26.606   686.014     28.23    159.921    202.771     38.893      202.771     
1 1 1 29 4  39 o 2  21.8623 5.44457 1.60213     7.8253   12.1106     7.94277  13.3705    221.376     43.7943     221.376     
1 1 1 29 4  40 f 0  75.075  3.20677 103.299     12.1387  99.0812     11.8786  34.3905    316.028     0           0           
1 1 1 29 4  41 o 6  96.6528 2.72395 161.501     12.8924  172.592     13.4442  71.8675    117.874     10.716      117.874     
1 1 1 29 4  42 o 14 85.1967 2.83738 121.697     11.8035  138.543     12.3476  73.099     347.89      30.2242     347.89      
1 1 1 29 4  43 o 9  102.031 2.91861 182.454     14.4896  190.69      15.2972  73.1107    207.336     4.96302     207.336     
1 1 1 29 4  44 o 8  60.1459 4.03192 66.7019     11.6216  65.1577     12.3673  51.099     268.393     24.8845     268.393     
1 1 1 29 4  45 o 9  61.9742 4.04023 54.3849     12.0846  87.675      12.0918  49.0277    129.161     16.711      129.161     
1 1 1 29 4  46 o 2  88.895  3.28173 138.208     14.6482  146.893     14.4728  51.2313    336.818     19.6829     156.818     
1 1 1 29 4  47 o 13 50.8785 4.27489 48.3727     11.0844  47.1048     10.2808  37.0171    84.6586     9.2338      84.6586     
1 1 1 29 4  48 o 10 118.127 3.20715 250.084     19.959   253.29      17.864   86.3086    261.835     10.0262     261.835     
1 1 1 29 4  49 o 17 46.4573 4.66406 34.0927     10.2187  47.0706     10.7268  36.7082    203.335     17.8484     203.335     
1 1 1 29 4  50 o 16 42.2896 4.8931  26.7836     8.8989   41.5496     11.1519  28.1597    321.322     4.54129     321.322     
1 1 1 29 4  51 o 18 111.091 3.00092 215.216     14.8041  230.063     18.4456  74.6055    28.2066     2.5661      208.207     
1 1 1 29 4  52 f 0  59.604  3.61343 58.7194     10.0255  71.4558     11.3647  39.7572    287.279     0           0           
1 1 1 29 4  53 o 18 44.0939 4.82215 35.6035     9.84026  37.9098     10.783   18.6888    50.4961     19.6231     230.496     
1 1 1 29 4  54 o 15 42.2936 4.62266 28.253      8.89082  39.7478     10.0273  30.4894    87.8036     23.0716     87.8036     
1 1 1 29 4  55 o 4  22.3526 5.73588 10.7197     8.05992  5.04675     8.91826  6.72115    250.786     5.24495     70.7856     
1 1 1 29 4  56 o 6  18.4265 5.26761 -6.2665     7.56643  9.14512     8.84866  2.84459    297.314     8.35346     117.314     
1 1 1 29 4  57 o 10 78.7699 3.17063 115.002     12.0405  111.316     12.8552  53.2754    339.099     1.36348     339.099     
1 1 1 29 4  58 o 6  34.4008 5.69993 27.728      9.41923  19.723      10.029   24.4353    340.853     15.4665     340.853     
1 1 1 29 4  59 o 8  25.2467 5.9839  5.21007     9.19617  18.2199     9.70206  12.106     192.154     1.49127     12.1541     
1 1 1 29 4  60 o 3  39.8271 5.41661 35.7437     9.84336  27.5275     10.8737  19.1995    161.065     12.0427     341.065     
1 1 1 29 4  61 o 10 30.5817 6.3179  21.914      9.36557  16.4619     11.6892  17.8917    196.468     1.81719     196.468     
1 1 1 29 4  62 o 16 45.639  5.95506 40.2337     12.9742  44.7553     13.258   28.6594    342.142     0.0379296   162.143     
1 1 1 29 4  63 f 0  63.6487 4.4389  74.5861     14.2357  80.6521     13.6502  41.314     138.386     0           0           
1 1 1 29 4  64 o 8  25.5234 6.90665 5.13858     13.2672  16.7118     12.3595  9.44883    248.852     0.575689    248.852     
1 1 1 29 4  65 o 15 16.8395 5.52705 -0.98069    10.8176  -18.4097    12.7004  0.470791   205.262     7.82867     25.2623     
1 1 1 29 4  66 o 15 41.9243 7.33055 57.6328     16.1748  21.2548     17.0089  26.9834    132.406     3.53714     132.405     
1 1 1 29 4  67 o 7  37.0564 7.32294 25.1176     15.8496  35.4881     13.2086  26.2966    125.592     10.6456     125.592     
1 1 1 29 4  68 o 14 28.2516 7.27507 23.805      14.6994  9.10076     12.6597  9.05448    310.143     14.6221     130.143     
1 1 1 29 4  69 o 9  33.3432 7.49336 36.7861     15.1396  13.0595     15.3442  20.0571    142.167     2.5687      142.167     
1 1 1 29 4  70 o 6  29.5702 7.97423 17.402      15.0938  22.3862     17.7022  16.4207    177.042     3.96847     177.042     
1 1 1 29 4  71 o 10 27.1092 7.20738 24.4288     15.1247  8.03119     12.0152  12.2185    184.856     1.44592     4.85585     
1 1 1 29 4  72 o 8  27.3737 7.18809 27.1775     15.0808  6.91548     12.2792  10.881     138.002     4.83147     318.002     
1 1 1 29 4  73 o 7  18.2867 6.00038 4.24637     14.9127  -11.3331    10.8514  0.527751   300.895     8.38409     120.895     
1 1 1 29 4  74 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 5  0  o 8  185.28  2.48315 609.339     23.0377  609.339     23.0377  184.15     8.50815e-06 92.7078     8.50815e-06 
1 1 1 29 5  1  o 7  120.389 2.4791  258.772     14.6097  256.018     15.2612  78.1688    262.56      12.0685     82.5596     
1 1 1 29 5  2  o 14 70.316  2.82891 91.0592     10.1277  85.102      9.72821  26.6006    311.61      34.3886     131.61      
1 1 1 29 5  3  o 18 89.4696 2.54622 146.154     11.5166  138.461     11.2687  64.0187    15.9785     16.8114     15.9785     
1 1 1 29 5  4  o 12 316.193 3.3156  1798.63     52.4858  1753.87     52.583   297.687    6.56554     130.789     6.56554     
1 1 1 29 5  5  o 12 163.504 2.53597 476.419     19.9985  472.421     21.5253  122.499    49.7649     10.1516     49.7649     
1 1 1 29 5  6  o 16 74.9535 2.71719 103.198     10.1428  96.8211     10.192   40.5719    90.624      18.7648     90.624      
1 1 1 29 5  7  o 9  122.591 2.46727 270.961     15.4955  262.872     14.789   82.5285    9.22984     6.95351     189.23      
1 1 1 29 5  8  o 8  85.3796 2.77107 139.704     12.0778  120.039     11.5543  23.4913    287.208     70.2171     107.208     
1 1 1 29 5  9  o 14 33.2972 4.85409 20.5492     7.39168  20.409      8.26291  11.156     72.8087     43.116      72.8087     
1 1 1 29 5  10 o 16 129.913 2.47118 292.032     16.0561  307.546     16.0845  91.9324    258.784     0.317589    258.784     
1 1 1 29 5  11 o 16 257.762 2.77971 1154.64     35.8674  1204.98     35.9356  192.22     58.7221     6.62318     58.722      
1 1 1 29 5  12 o 15 53.5625 3.25494 51.1471     8.66393  51.5607     8.64057  6.1974     68.5026     80.3314     68.5026     
1 1 1 29 5  13 o 1  19.8745 5.23275 7.88085     6.91849  1.77116     7.47745  3.41127    4.58237     8.20044     4.58237     
1 1 1 29 5  14 o 15 118.978 2.40072 257.872     14.2687  245.079     14.3221  94.033     269.134     22.2443     269.134     
1 1 1 29 5  15 o 9  105.802 2.59037 202.354     14.2372  195.614     13.1851  74.0817    215.53      1.40087     215.53      
1 1 1 29 5  16 o 13 68.8229 2.99213 84.8969     10.266   84.0419     10.2737  12.3293    157.331     119.884     157.331     
1 1 1 29 5  17 o 17 75.7639 2.83342 98.1504     10.3901  106.427     11.0529  54.2137    289.209     15.9017     289.209     
1 1 1 29 5  18 o 14 319.179 3.23125 1826.98     50.6205  1795.64     52.7072  239.442    185.312     11.2        185.312     
1 1 1 29 5  19 o 15 47.8069 3.97726 43.215      8.96846  39.3693     9.64924  19.1845    244.246     100.287     244.246     
1 1 1 29 5  20 o 17 246.856 2.90562 1086.93     36.6164  1079.1      35.2659  177.205    293.883     5.3101      113.883     
1 1 1 29 5  21 o 19 130.107 2.68764 296.137     17.2469  305.908     17.7645  85.2513    113.413     14.4624     293.413     
1 1 1 29 5  22 o 18 93.1029 2.77247 160.976     12.8987  147.801     12.8966  45.2847    163.735     38.7696     343.735     
1 1 1 29 5  23 o 3  70.3335 3.28204 85.9199     11.4919  90.9399     11.5081  39.6262    274.514     11.5422     94.5144     
1 1 1 29 5  24 o 7  45.547  4.0969  38.3223     9.00062  36.8912     9.26718  21.6413    344.218     102.338     344.218     
1 1 1 29 5  25 o 15 97.9255 2.7959  169.712     13.2124  171.849     14.1613  85.6916    157.888     41.3333     157.888     
1 1 1 29 5  26 o 10 106.214 2.77198 197.803     14.151   203.987     15.3     92.7097    183.724     41.1061     183.724     
1 1 1 29 5  27 o 3  104.971 2.67743 189.032     13.3757  203.477     14.7502  77.9384    134.458     10.7333     134.458     
1 1 1 29 5  28 o 18 211.15  3.1639  847.589     34.0256  742.437     32.888   183.868    31.3625     64.5972     31.3625     
1 1 1 29 5  29 o 3  117.757 3.1158  253.468     15.9034  241.35      20.3966  103.208    211.741     43.4963     211.741     
1 1 1 29 5  30 o 19 79.0478 3.35794 109.194     12.3369  114.544     14.1193  66.5777    328.887     33.5943     328.887     
1 1 1 29 5  31 o 15 164.713 3.02546 487.658     23.191   479.724     26.5794  146.555    110.025     59.7454     110.025     
1 1 1 29 5  32 o 4  96.5496 3.26992 164.334     15.2139  169.161     16.3305  57.6694    205.386     18.3087     25.3864     
1 1 1 29 5  33 o 13 61.7154 3.57343 76.0713     10.4403  61.4205     11.2477  38.2195    15.5394     0.154473    195.539     
1 1 1 29 5  34 o 16 89.4904 2.9989  154.54      12.5716  132.264     14.0262  71.723     291.57      23.8535     291.57      
1 1 1 29 5  35 f 0  46.541  4.03383 33.9591     8.86344  45.3347     9.46837  35.4642    246.897     0           0           
1 1 1 29 5  36 o 2  73.1467 3.17709 95.9912     11.1104  95.9291     12.0485  28.0265    184.023     43.1758     4.02285     
1 1 1 29 5  37 o 9  44.6427 4.00757 34.3066     8.33849  38.4812     9.19643  22.1935    319.367     2.70847     139.367     
1 1 1 29 5  38 o 14 69.9193 3.28972 89.5832     10.8769  86.1851     11.989   35.2221    134.082     24.3119     314.082     
1 1 1 29 5  39 o 19 81.0856 3.02968 116.11      11.1064  119.673     13.3514  53.5527    193.101     4.14601     13.1011     
1 1 1 29 5  40 o 18 57.7079 3.67761 63.9148     9.291    56.81       11.4392  43.7527    216.915     11.9374     216.915     
1 1 1 29 5  41 o 4  70.8113 3.38954 90.6331     10.904   90.1705     12.9101  59.3411    287.466     23.566      287.466     
1 1 1 29 5  42 o 17 102.297 3.02693 184.744     14.6522  190.916     16.2929  73.4862    85.1137     4.72065     85.1137     
1 1 1 29 5  43 o 19 120.261 3.03525 257.095     16.654   262.27      19.7625  85.021     57.108      2.21067     57.108      
1 1 1 29 5  44 o 19 38.7871 5.12823 27.4592     9.09349  29.4361     10.1102  19.0342    20.9354     9.98338     200.935     
1 1 1 29 5  45 o 9  65.6234 3.6731  86.3015     11.8077  70.6764     12.0242  49.3027    277.559     10.7268     277.559     
1 1 1 29 5  46 o 8  73.579  3.29006 103.592     12.0784  92.4612     12.031   49.8782    153.054     0.251879    333.054     
1 1 1 29 5  47 o 13 82.168  3.1687  116.632     12.442   127.451     13.5615  45.1427    274.151     22.4201     94.1513     
1 1 1 29 5  48 o 16 175.913 2.92116 518.902     26.0709  595.635     25.2488  141.565    77.1483     39.0336     77.1483     
1 1 1 29 5  49 o 17 41.0185 4.97192 27.7956     9.60278  36.2756     10.0527  28.4755    189.931     7.60643     189.931     
1 1 1 29 5  50 o 1  79.954  3.2536  96.864      12.6602  136.531     13.0617  48.6699    161.467     11.351      341.467     
1 1 1 29 5  51 o 16 67.4258 3.45102 75.1459     11.5211  90.8537     11.5573  52.8085    51.5313     15.9338     51.5313     
1 1 1 29 5  52 f 0  19.3359 5.29968 10.5251     7.95581  -10.811     9.7569   26.6125    168.763     0           0           
1 1 1 29 5  53 o 3  81.3913 3.26217 128.39      12.6343  112.685     13.7185  52.1178    217.523     5.82547     37.5234     
1 1 1 29 5  54 o 12 64.3932 3.62356 70.5044     11.3497  81.9868     11.8213  33.8788    165.37      18.6188     345.37      
1 1 1 29 5  55 o 3  49.8032 4.36655 50.8477     10.1869  42.5983     10.9428  35.5316    163.963     6.37246     163.963     
1 1 1 29 5  56 o 10 51.6427 4.39804 45.8341     10.5413  55.045      11.7724  35.516     171.825     3.62802     171.825     
1 1 1 29 5  57 o 17 54.7286 4.16874 50.9704     10.9911  61.934      11.4601  30.7187    79.9874     10.7679     259.987     
1 1 1 29 5  58 o 5  16.0524 5.08615 -6.09476    8.2126   0.506428    8.8545   0.772427   47.1057     10.3675     227.106     
1 1 1 29 5  59 o 1  16.8087 5.28129 -4.16664    8.72195  0.65688     9.1957   1.4992     206.537     9.44134     26.5375     
1 1 1 29 5  60 o 17 50.917  4.54703 53.9773     10.9274  45.9308     11.5864  29.4977    186.335     6.98756     6.33499     
1 1 1 29 5  61 o 7  48.7132 4.71216 41.9417     10.9232  50.4048     11.4382  36.9802    22.0597     12.6537     22.0597     
1 1 1 29 5  62 o 7  18.1682 5.4955  -4.45446    8.62849  6.01732     9.66567  2.24535    62.8139     5.86816     242.814     
1 1 1 29 5  63 o 2  82.1989 3.66923 120.102     15.5936  132.879     14.3375  48.6413    345.304     10.5417     165.304     
1 1 1 29 5  64 o 4  32.978  6.39083 30.7389     11.3714  15.7212     11.1869  10.3368    41.8723     19.1984     221.872     
1 1 1 29 5  65 o 11 18.4511 5.77224 4.98611     10.7379  -11.5936    11.6259  3.02278    107.92      4.84779     287.92      
1 1 1 29 5  66 o 4  45.7342 6.85849 45.2804     15.3432  44.6899     15.1193  36.009     352.521     16.6501     352.521     
1 1 1 29 5  67 o 7  20.4885 6.38886 7.45106     13.841   -8.19064    12.3913  5.41027    329.284     0.946241    149.284     
1 1 1 29 5  68 o 16 22.408  6.82636 -4.43937    14.1276  11.061      14.5456  7.91943    17.5705     5.23813     197.571     
1 1 1 29 5  69 o 4  34.0815 7.4203  24.4963     15.6393  29.7209     12.7795  17.1602    339.84      5.55679     159.84      
1 1 1 29 5  70 o 1  31.0193 7.44668 32.0625     15.6879  14.8386     12.4417  17.5926    7.02731     5.77496     7.02731     
1 1 1 29 5  71 f 0  23.6742 6.88768 18.8747     14.9973  0.481337    12.0103  13.8316    97.1814     0           0           
1 1 1 29 5  72 o 13 28.2552 7.43869 16.236      16.1859  21.6764     12.8249  11.5185    345.008     1.00305     165.008     
1 1 1 29 5  73 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 6  0  o 10 115.704 2.47263 238.055     14.3077  238.055     14.3077  114.584    360         57.2885     360         
1 1 1 29 6  1  o 19 53.8332 3.30156 49.0246     8.61933  54.8373     9.01454  19.7847    121.31      9.24965     301.31      
1 1 1 29 6  2  o 12 245.225 2.8678  1081.37     36.5624  1054.68     33.9025  203.885    50.6963     47.3408     50.6963     
1 1 1 29 6  3  o 19 150.975 2.44792 420.893     18.5143  388.532     18.5056  103.956    122.903     10.3541     302.903     
1 1 1 29 6  4  o 8  138.957 2.43896 342.654     16.6743  342.974     17.2748  131.876    149.417     68.8145     149.417     
1 1 1 29 6  5  o 15 35.4816 4.47091 21.5512     7.60122  24.6991     7.70519  5.53476    268.87      37.4638     268.87      
1 1 1 29 6  6  o 6  46.3971 3.62901 40.3419     8.26499  37.1929     8.31353  5.48883    27.5196     38.7619     207.52      
1 1 1 29 6  7  o 2  176.134 2.49539 552.575     22.0101  548.811     22.0423  167.073    227.426     80.265      227.426     
1 1 1 29 6  8  o 7  138.085 2.45445 345.024     16.9272  332.155     17.0212  110.731    354.272     24.1173     354.272     
1 1 1 29 6  9  o 7  54.6551 3.43308 59.3481     9.20401  48.0204     9.30334  16.8532    309.68      31.6203     129.68      
1 1 1 29 6  10 o 4  54.443  3.29392 52.5807     8.95483  53.5741     8.84443  23.812     246.91      3.18194     66.9097     
1 1 1 29 6  11 o 4  81.4343 2.71451 122.563     11.4532  113.591     10.6443  64.3366    323.764     39.8253     323.764     
1 1 1 29 6  12 o 13 34.759  4.58011 21.9758     7.67729  22.5006     7.69194  0.00519173 271.876     6.70252     91.8762     
1 1 1 29 6  13 o 1  91.0837 2.58752 144.852     11.7747  150.298     11.7964  73.0454    42.9676     25.465      42.9676     
1 1 1 29 6  14 o 14 147.169 2.44522 390.333     18.0053  378.81      18.0589  108.489    326.729     5.18904     326.73      
1 1 1 29 6  15 o 17 98.6669 2.65176 176.791     13.1065  169.596     13.0661  67.5631    221.616     1.54179     41.6161     
1 1 1 29 6  16 o 10 65.4826 3.01736 82.108      9.79356  71.194      9.85653  34.8965    98.765      12.7824     278.765     
1 1 1 29 6  17 f 0  32.9676 4.82062 20.4367     7.70554  19.8362     7.69698  83.0062    3.20591     0           0           
1 1 1 29 6  18 o 15 60.1729 3.12205 70.6081     9.33396  59.1372     9.3058   21.9761    105.521     11.3545     105.521     
1 1 1 29 6  19 o 10 204.041 2.60454 740.313     26.5463  739.11      26.7179  134.886    206.156     27.5064     26.1561     
1 1 1 29 6  20 o 7  213.601 2.69264 823.382     28.1536  798.517     29.4529  164.315    40.6283     17.9103     40.6284     
1 1 1 29 6  21 o 7  35.8334 4.99236 23.8747     8.67341  23.6937     8.6188   5.01597    5.01543     45.8539     5.01543     
1 1 1 29 6  22 o 16 56.5083 3.44206 59.5817     9.4999   55.0697     9.77742  27.753     204.688     11.7833     24.6876     
1 1 1 29 6  23 o 13 220.349 2.99672 860.657     33.1219  867.447     33.0608  186.262    101.431     53.0786     101.431     
1 1 1 29 6  24 o 7  112.216 2.75573 218.559     15.3453  230.008     15.5998  99.5487    151.914     44.1368     151.914     
1 1 1 29 6  25 o 15 83.0345 3.25653 134.931     12.7608  112.055     13.9917  65.2851    350.325     20.8622     350.325     
1 1 1 29 6  26 o 1  20.7662 5.72747 7.58173     8.37717  0.75983     9.31151  4.86108    134.748     13.933      134.748     
1 1 1 29 6  27 o 19 122.428 3.0782  269.942     19.496   264.893     18.2038  80.8556    303.118     11.966      123.118     
1 1 1 29 6  28 o 6  134.464 2.90715 316.722     20.2445  328.054     18.8328  116.443    202.805     43.1209     202.805     
1 1 1 29 6  29 o 14 183.681 2.8684  605.703     26.0558  596.505     26.7407  138.843    335.57      13.9538     335.57      
1 1 1 29 6  30 o 12 54.696  3.68752 53.9117     9.57336  54.0716     10.3793  32.9007    22.5002     4.45589     22.5002     
1 1 1 29 6  31 o 12 164.372 2.80445 490.453     22.4005  473.034     23.7316  138.199    341.467     42.5422     341.467     
1 1 1 29 6  32 o 17 49.8542 4.59831 42.0213     9.41542  49.0964     12.932   25.0596    50.0026     5.43611     230.003     
1 1 1 29 6  33 o 17 47.4161 4.53811 50.2379     8.66595  33.0284     11.155   18.3652    275.594     5.69007     275.594     
1 1 1 29 6  34 o 16 22.5715 5.76051 7.91798     7.16666  7.7374      9.5893   14.5482    170.889     47.1928     170.889     
1 1 1 29 6  35 o 15 106.569 3.02112 198.973     13.864   207.523     18.1284  67.8892    42.8141     13.4749     222.814     
1 1 1 29 6  36 o 10 51.6597 4.10918 51.8344     9.01356  45.5103     11.4636  34.3053    350.779     5.78919     350.779     
1 1 1 29 6  37 o 3  100.762 3.11486 176.511     15.0969  187.6       16.2873  84.5464    22.5422     29.0199     22.5422     
1 1 1 29 6  38 o 18 23.8193 5.80864 13.5349     8.13175  3.32492     9.82899  1.37352    124.062     27.2843     124.062     
1 1 1 29 6  39 o 3  89.4858 3.16336 140.746     13.3643  147.031     14.9029  65.3021    90.5337     6.0131      90.5337     
1 1 1 29 6  40 o 6  62.6146 3.5584  67.7942     10.7824  74.2546     11.3628  53.8676    359.064     25.188      359.064     
1 1 1 29 6  41 o 14 28.3662 5.76782 15.0042     8.46919  15.5214     8.80375  7.42633    269.473     0.0230789   269.473     
1 1 1 29 6  42 o 18 191.87  2.71152 650.309     25.1759  667.834     26.958   163.973    291.898     57.3527     291.898     
1 1 1 29 6  43 o 6  84.8816 2.95605 116.761     11.6603  143.191     13.4313  71.5072    268.7       26.6145     268.7       
1 1 1 29 6  44 o 4  30.9092 5.67969 17.387      8.00775  19.5342     9.75778  1.34564    7.91149     36.0625     187.911     
1 1 1 29 6  45 o 10 53.2077 3.97895 58.8497     9.71992  45.5725     10.8006  27.3485    140.587     16.5816     320.587     
1 1 1 29 6  46 o 4  36.9474 5.03198 17.9236     8.30266  35.3316     9.68341  18.6103    38.6415     8.52736     218.642     
1 1 1 29 6  47 o 7  71.5939 3.47024 96.5399     11.4912  89.933      13.119   57.6977    121.057     18.8456     121.057     
1 1 1 29 6  48 o 4  95.8416 3.01439 151.395     14.5353  180.92      14.2256  73.3841    294.433     15.2038     294.433     
1 1 1 29 6  49 o 4  116.467 2.85629 250.599     16.8201  238.313     16.4707  85.1445    340.8       9.71145     340.8       
1 1 1 29 6  50 o 11 58.8095 3.94278 61.4223     11.5593  66.057      11.3799  42.5575    275.551     7.11813     275.551     
1 1 1 29 6  51 o 7  87.277  3.22049 136.237     14.5201  140.36      13.5147  73.8106    216.423     29.3016     216.423     
1 1 1 29 6  52 f 0  94.7136 3.32251 159.175     16.7439  167.412     14.5408  75.65      355.524     0           0           
1 1 1 29 6  53 o 4  27.3545 6.18658 6.56894     10.2804  21.0476     10.1862  14.0074    65.6391     1.36096     245.639     
1 1 1 29 6  54 o 9  52.9396 4.23811 47.7823     10.5679  57.588      11.5153  37.6038    58.0136     5.51244     58.0136     
1 1 1 29 6  55 o 17 38.9265 5.31731 25.5801     9.72319  34.2719     10.2648  21.2939    283.108     7.199       103.108     
1 1 1 29 6  56 o 9  23.7272 5.71168 17.1996     8.85453  0.250909    9.55918  10.8032    184.004     0.151351    4.00381     
1 1 1 29 6  57 o 4  45.7045 4.75854 39.9146     10.1365  40.876      10.9966  33.7056    270.085     8.99769     270.085     
1 1 1 29 6  58 o 3  58.5211 4.00929 65.2329     11.2825  63.9199     11.9174  31.6736    5.68586     14.101      185.686     
1 1 1 29 6  59 o 2  27.7261 6.21872 15.5778     9.07039  15.9436     10.3524  15.3215    130.84      4.92211     130.84      
1 1 1 29 6  60 o 16 23.5452 6.14177 11.8736     9.09019  7.71376     10.3126  5.46783    185.247     1.24205     185.247     
1 1 1 29 6  61 o 13 55.5977 4.6093  71.9823     11.1926  48.5007     12.9092  28.9973    201.621     14.3281     21.6208     
1 1 1 29 6  62 o 4  18.2597 5.67965 0.83968     9.66331  -1.14425    10.4955  0.187923   315.591     15.2174     135.591     
1 1 1 29 6  63 f 0  26.6683 6.71934 11.5422     10.0224  17.4554     12.6149  17.2545    221.252     0           0           
1 1 1 29 6  64 o 10 23.4433 6.47982 13.9265     10.6147  0.303946    13.1135  9.26471    241.036     3.16342     61.0358     
1 1 1 29 6  65 o 18 31.8776 7.19211 27.3926     12.5279  16.4761     14.3967  15.0587    279.399     10.4169     279.399     
1 1 1 29 6  66 o 5  39.7992 7.30968 19.3763     15.1307  53.8576     16.5168  20.3289    175.307     8.54243     355.307     
1 1 1 29 6  67 o 8  17.9955 5.86125 -6.21673    10.8363  -2.45532    13.3891  3.40167    311.779     26.2594     311.779     
1 1 1 29 6  68 o 4  19.0931 5.90536 4.44733     11.1143  -1.74464    10.4922  2.79213    217.425     1.49598     37.4249     
1 1 1 29 6  69 o 4  25.135  6.77407 19.1196     12.0435  4.84308     13.0832  9.06002    232.841     1.4673      232.841     
1 1 1 29 6  70 o 1  28.6147 7.13656 22.96       12.4715  15.6279     13.526   13.3393    184.166     0.21425     184.166     
1 1 1 29 6  71 o 10 54.0089 6.7103  54.2221     17.6557  80.2119     16.7031  38.0207    269.013     10.8122     269.013     
1 1 1 29 6  72 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 7  0  o 7  62.1593 3.31096 69.7423     10.176   69.7423     10.176   1.63387    180         89.1887     360         
1 1 1 29 7  1  o 11 18.1111 5.13643 3.38005     7.286    2.17988     6.91788  28.4579    146.585     66.8759     146.585     
1 1 1 29 7  2  o 8  92.831  2.64532 150.436     12.5377  156.194     12.0051  61.7895    148.91      4.84841     328.91      
1 1 1 29 7  3  o 3  241.665 2.7445  1043.11     33.2051  1031.86     33.2701  203.918    322.732     51.6808     322.732     
1 1 1 29 7  4  o 2  173.781 2.55367 535.898     22.2341  536.71      22.2452  148.329    207.494     43.7253     207.494     
1 1 1 29 7  5  o 19 210.199 2.61636 765.004     27.5446  804.735     27.5639  175.135    228.154     41.7426     228.154     
1 1 1 29 7  6  o 4  157.073 2.53378 451.278     19.4801  425.198     20.3601  116.321    152.164     4.28702     152.164     
1 1 1 29 7  7  o 13 65.2876 2.97927 78.4397     9.69803  73.7538     9.6861   15.8918    352.576     56.2554     172.576     
1 1 1 29 7  8  o 9  32.6935 4.86553 23.6694     7.71131  16.1586     7.7516   0.373197   13.7555     5.81253     13.7555     
1 1 1 29 7  9  o 2  77.8602 2.79292 105.355     11.0791  110.679     10.6232  22.5204    62.5067     63.3782     242.507     
1 1 1 29 7  10 o 13 125.337 2.53552 277.55      15.5368  280.961     16.2778  85.6168    160.098     8.58898     340.098     
1 1 1 29 7  11 o 9  233.654 2.7991  973.689     33.3877  966.881     32.1562  193.04     190.8       42.774      190.8       
1 1 1 29 7  12 o 7  105.589 2.52012 199.213     13.3044  197.324     13.3275  70.5769    219.986     7.88543     39.986      
1 1 1 29 7  13 o 14 131.9   2.53163 321.594     16.3448  297.219     17.0378  87.3387    69.9525     15.3051     249.952     
1 1 1 29 7  14 o 11 70.3864 2.88337 82.9897     10.1163  93.9354     10.1062  51.6828    157.857     25.9979     157.857     
1 1 1 29 7  15 o 15 137.48  2.53405 339.909     17.4377  332.187     17.4484  116.528    33.5939     36.5744     33.5939     
1 1 1 29 7  16 o 18 43.4296 3.94027 29.9922     8.24437  38.6646     8.40591  6.35854    64.6661     35.4936     244.666     
1 1 1 29 7  17 o 1  69.9419 2.90268 80.1946     10.0475  94.7195     10.1651  46.2708    276.604     2.99219     276.604     
1 1 1 29 7  18 o 19 131.449 2.46535 306.743     16.1814  307.754     16.2707  85.8963    45.106      17.2214     225.106     
1 1 1 29 7  19 o 3  143.393 2.44917 358.576     17.5472  372.276     17.6497  82.3612    333.196     42.7892     153.196     
1 1 1 29 7  20 o 2  191.524 2.52374 656.519     24.1376  647.611     24.3062  155.015    186.964     31.6842     186.964     
1 1 1 29 7  21 o 5  226.56  2.8909  913.918     34.0916  913.16      31.5031  186.272    297.506     42.1866     297.506     
1 1 1 29 7  22 o 7  65.0467 3.50543 82.2762     12.1792  69.8074     10.5207  29.0102    88.4956     28.7984     268.496     
1 1 1 29 7  23 o 4  115.518 2.96865 231.73      17.5784  244.295     16.6905  92.7265    260.941     22.4946     260.941     
1 1 1 29 7  24 f 0  57.5789 3.77031 59.7614     10.647   59.7379     10.8631  5.21648    317.035     0           0           
1 1 1 29 7  25 o 1  76.1248 3.35226 98.6002     12.1599  109.169     13.2982  65.6464    97.8101     37.3146     97.8101     
1 1 1 29 7  26 o 15 59.3064 4.26759 72.1857     10.6112  55.7687     13.5432  24.3235    3.13439     29.2951     183.134     
1 1 1 29 7  27 o 6  65.1682 3.40151 78.2304     10.9933  74.3502     11.0597  48.5408    214.09      17.9075     214.09      
1 1 1 29 7  28 o 15 48.7934 4.05524 47.2672     9.5391   39.4573     9.80354  8.30485    350.019     45.9141     170.019     
1 1 1 29 7  29 o 1  35.2456 5.06434 31.9175     8.26058  15.3108     9.00658  4.10146    143.705     24.7125     323.705     
1 1 1 29 7  30 o 1  74.6613 3.08831 99.4138     11.0692  100.354     11.927   28.3401    17.5908     46.1101     197.591     
1 1 1 29 7  31 o 4  184.999 2.73227 598.534     25.1401  622.218     25.5208  145.216    193.304     25.0463     193.304     
1 1 1 29 7  32 o 13 29.0911 5.64293 22.5191     8.17557  7.39498     10.2922  3.3325     336.382     34.3573     336.382     
1 1 1 29 7  33 o 14 131.402 2.7309  305.952     17.5378  310.77      18.3853  92.4865    200.617     1.86638     20.6173     
1 1 1 29 7  34 o 17 104.09  2.9325  193.527     15.5482  194.313     14.9776  70.0215    141.686     6.77688     321.686     
1 1 1 29 7  35 o 4  63.8956 3.49978 72.0802     10.9376  75.3241     11.3018  51.3483    125.11      17.5846     125.11      
1 1 1 29 7  36 o 6  122.864 2.98054 290.772     17.0507  250.773     19.2779  74.1539    102.21      26.6056     282.21      
1 1 1 29 7  37 o 13 26.3203 6.22931 12.9645     8.46767  11.1883     11.0623  3.95216    186.915     19.7201     6.91485     
1 1 1 29 7  38 o 8  47.3043 4.5613  35.2486     9.94197  47.9983     11.0579  37.322     324.801     17.0182     324.801     
1 1 1 29 7  39 o 18 179.213 2.94762 561.508     22.9924  590.552     29.6455  136.097    262.375     17.3585     262.375     
1 1 1 29 7  40 o 17 47.38   4.36687 30.7741     8.84161  53.8071     11.3143  37.5506    243.389     16.6402     243.389     
1 1 1 29 7  41 o 11 24.2285 5.9385  8.44388     7.58415  12.0568     10.0049  5.14535    343.832     9.86294     163.832     
1 1 1 29 7  42 o 2  128.226 2.87145 290.847     16.7674  300.173     19.9886  102.713    154.229     25.3255     154.229     
1 1 1 29 7  43 o 19 82.3764 3.11849 111.298     12.0248  134.346     13.6451  49.3516    139.799     15.6563     319.799     
1 1 1 29 7  44 o 4  85.5504 3.07195 124.683     12.7707  139.84      13.4821  60.0035    111.358     1.61062     111.358     
1 1 1 29 7  45 o 7  52.9385 4.1163  59.8292     10.6173  44.2267     10.6189  31.7952    56.2212     7.20209     236.221     
1 1 1 29 7  46 o 18 77.2701 3.25398 110.118     12.2686  106.432     12.7988  74.0268    45.147      44.101      45.147      
1 1 1 29 7  47 o 11 105.959 2.85177 201.679     15.1309  203.032     15.0997  88.1562    251.359     29.9262     251.359     
1 1 1 29 7  48 o 14 36.2412 5.49549 25.5759     9.13083  25.4403     10.2275  20.9796    93.1117     2.26666     273.112     
1 1 1 29 7  49 f 0  35.1153 5.76966 27.6132     9.84364  20.8944     10.1558  28.7225    63.2586     0           0           
1 1 1 29 7  50 o 2  36.8515 5.82552 28.8223     9.35325  24.563      11.6495  27.3007    303.773     15.7747     303.773     
1 1 1 29 7  51 o 11 68.9004 3.69185 83.6148     12.3545  91.1104     12.9516  50.4014    81.3233     7.56851     81.3233     
1 1 1 29 7  52 f 0  74.093  3.67359 96.0449     13.1349  106.331     13.9764  54.6649    165.455     0           0           
1 1 1 29 7  53 o 17 54.5529 4.37498 58.0187     11.5942  54.2821     11.8757  30.8715    256.09      11.2728     76.0904     
1 1 1 29 7  54 o 8  18.0204 5.54865 1.43554     8.75857  -1.87117    10.135   3.34567    94.7121     5.80314     274.712     
1 1 1 29 7  55 f 0  24.4087 6.23483 9.62826     9.4435   12.1666     10.1324  24.8644    48.9528     0           0           
1 1 1 29 7  56 o 18 47.2299 4.83382 47.0697     10.0422  39.6486     11.792   28.7396    215.878     4.25848     35.8782     
1 1 1 29 7  57 o 6  17.656  5.40893 3.89347     8.41277  -5.40287    9.97043  2.51282    192.983     8.78688     12.9827     
1 1 1 29 7  58 f 0  33.9147 5.66705 7.25517     10.2365  41.2699     11.2457  23.5188    170.55      0           0           
1 1 1 29 7  59 o 2  26.4712 6.29504 16.2281     9.04043  11.454      11.1877  8.38342    49.8221     13.7126     229.822     
1 1 1 29 7  60 o 15 20.5431 5.96722 4.74639     9.15109  5.28233     10.5439  3.10211    269.462     13.4977     89.462      
1 1 1 29 7  61 o 19 47.3575 4.92807 43.9799     10.5717  44.5603     12.0572  29.8326    90.5724     0.430602    270.572     
1 1 1 29 7  62 o 9  21.6878 6.09303 3.82132     9.60564  9.9529      10.3697  5.6238     144.015     0.776829    324.015     
1 1 1 29 7  63 o 6  24.5628 6.32028 16.8877     9.98522  2.60895     12.0216  11.3557    277.308     1.3691      97.3076     
1 1 1 29 7  64 o 4  20.3636 6.31272 -3.81899    12.4334  5.16465     12.5693  5.68447    100.79      0.891534    280.79      
1 1 1 29 7  65 o 17 25.3558 6.90667 8.94823     12.1222  15.3069     12.8239  12.4643    64.7569     0.014637    244.754     
1 1 1 29 7  66 o 5  34.7947 7.19816 31.9781     15.1199  24.1868     11.5936  22.3151    359.253     4.14493     359.253     
1 1 1 29 7  67 o 15 30.6495 7.29428 19.0801     12.8881  25.0635     13.7098  18.0724    91.9666     4.28909     91.9666     
1 1 1 29 7  68 f 0  28.6988 7.41909 27.3619     15.3637  11.9583     12.9972  19.464     350.653     0           0           
1 1 1 29 7  69 o 10 21.4507 6.61712 5.01071     15.1233  5.10854     11.7282  4.4159     167.534     6.32224     347.534     
1 1 1 29 7  70 x 8  ?       ?       ?           ?        ?           ?        13.4094    17.0269     0           0           
1 1 1 29 7  71 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 8  0  o 3  208.276 2.69863 770.531     28.1458  770.531     28.1458  169.639    8.39349e-07 28.1332     8.39349e-07 
1 1 1 29 8  1  o 5  43.9533 3.85371 32.777      8.29069  37.2126     8.28974  0.665893   211.768     51.1987     31.7684     
1 1 1 29 8  2  o 2  141.056 2.51766 362.474     18.129   345.018     17.4389  102.611    263.834     0.347331    263.833     
1 1 1 29 8  3  o 11 190.591 2.52961 656.926     24.1406  633.855     24.175   185.596    104.09      92.9338     104.09      
1 1 1 29 8  4  o 7  29      5.30692 15.4047     7.68952  15.8783     7.85371  8.84632    174.71      37.8227     174.71      
1 1 1 29 8  5  o 7  72.508  2.80974 96.7152     10.1834  90.8169     10.151   52.6979    321.876     13.6166     321.876     
1 1 1 29 8  6  o 12 31.3875 4.9364  23.2122     7.62474  13.6967     7.63282  29.99      262.505     96.5473     262.505     
1 1 1 29 8  7  o 1  91.0047 2.61993 152.097     11.93    142.817     11.9086  72.1274    123.694     20.0622     123.694     
1 1 1 29 8  8  f 0  25.2933 5.30937 7.63221     7.45723  15.2507     7.40852  27.5757    134.937     0           0           
1 1 1 29 8  9  o 2  58.1295 3.24258 63.8697     9.49173  57.2657     9.23719  11.9376    244.119     6.63755     244.119     
1 1 1 29 8  10 o 17 186.811 2.6171  616.626     24.9235  623.944     24.0651  140.738    46.2462     7.37619     46.2462     
1 1 1 29 8  11 o 18 207.133 2.66027 752.862     27.0547  772.617     28.1738  193.954    352.757     84.5713     352.757     
1 1 1 29 8  12 o 16 103.733 2.57146 195.388     13.018   187.64      13.651   69.2229    199.383     8.79448     19.3826     
1 1 1 29 8  13 o 17 160.385 2.45122 467.341     19.692   447.009     19.704   149.553    245.95      67.1785     245.95      
1 1 1 29 8  14 o 3  126.858 2.67949 283.177     17.7041  289.698     16.2778  116.279    89.9817     52.4691     89.9817     
1 1 1 29 8  15 o 18 143.352 2.51468 360.242     17.7087  370.407     18.4222  123.139    149.709     39.6943     149.709     
1 1 1 29 8  16 o 11 132.925 2.52344 324.247     17.1003  304.63      16.4899  104.957    40.078      18.6501     40.078      
1 1 1 29 8  17 o 18 38.6982 5.03614 20.3292     9.51977  35.9651     9.00974  8.42374    143.732     12.7693     323.732     
1 1 1 29 8  18 o 4  126.083 2.77144 295.972     17.5497  270.684     17.4099  103.071    277.956     25.7841     277.956     
1 1 1 29 8  19 o 7  59.1518 3.63197 65.1066     10.7552  60.8202     10.5601  29.0294    200.087     18.8395     20.0866     
1 1 1 29 8  20 o 5  66.5907 3.37879 77.3208     11.2793  81.7656     11.1085  26.5936    305.372     37.8156     125.372     
1 1 1 29 8  21 f 0  120.615 2.76205 262.465     16.6723  256.181     16.6723  104.437    110.341     0           0           
1 1 1 29 8  22 o 7  89.8782 3.2523  157.237     15.3052  132.363     13.9008  61.5417    313.066     2.20408     133.066     
1 1 1 29 8  23 o 19 148.908 2.643   400.641     19.5227  389.332     19.8961  102.476    117.007     10.3439     297.007     
1 1 1 29 8  24 o 4  85.1124 2.88221 130.864     12.3333  128.028     12.1825  78.4173    257.868     46.2274     257.868     
1 1 1 29 8  25 f 0  105.559 2.81085 208.794     13.3797  189.28      16.0212  75.3451    51.8854     0           0           
1 1 1 29 8  26 o 18 148.804 2.57728 395.181     19.3064  393.725     19.1319  154.016    61.5488     97.5157     61.5488     
1 1 1 29 8  27 f 0  79.4644 2.75516 115.733     10.8474  110.039     11.0187  27.1798    7.20885     0           0           
1 1 1 29 8  28 o 3  75.6487 2.91519 103.96      10.6031  100.946     11.3876  56.5409    135.849     11.8486     135.849     
1 1 1 29 8  29 o 15 133.985 2.643   315.345     17.6361  325.39      17.8215  95.0244    223.663     1.75977     43.6628     
1 1 1 29 8  30 o 5  84.6522 3.07886 117.76      12.532   139.595     13.4956  67.1141    198.744     17.5684     198.744     
1 1 1 29 8  31 o 17 177.325 2.8129  553.809     25.135   569.329     24.8501  125.775    354.621     4.24147     174.621     
1 1 1 29 8  32 o 12 32.8223 5.98387 17.9419     10.0892  23.1069     9.82174  10.8079    345.092     13.6328     165.092     
1 1 1 29 8  33 o 7  21.1608 5.51296 -5.86885    8.92575  13.0941     8.85949  11.0362    262.36      45.6371     262.36      
1 1 1 29 8  34 o 12 147.651 2.94815 376.312     22.0719  404.93      21.4632  114.988    300.327     18.2937     300.327     
1 1 1 29 8  35 o 2  36.2488 5.39887 23.2326     9.35003  26.7273     9.65128  19.3862    110.383     4.3222      290.383     
1 1 1 29 8  36 f 0  48.245  4.47999 40.6514     10.1123  45.3956     11.0345  40.9535    216.906     0           0           
1 1 1 29 8  37 o 18 39.2378 5.02814 29.982      8.77522  28.0419     10.1961  25.0962    24.8724     2.94347     24.8724     
1 1 1 29 8  38 o 19 104.773 3.05476 191.459     14.7759  203.641     17.2015  104.856    277.292     63.4599     277.292     
1 1 1 29 8  39 o 8  81.1579 3.27074 102.474     12.6819  136.789     13.7292  56.8981    56.4921     0.503275    56.4913     
1 1 1 29 8  40 o 9  68.7694 3.4552  83.0649     11.3346  88.6795     12.3275  23.6599    238.836     48.7348     58.8364     
1 1 1 29 8  41 o 18 30.5604 5.92829 17.4224     9.0551   18.8472     9.6496   11.2409    135.562     13.5414     315.562     
1 1 1 29 8  42 o 7  32.0376 5.93271 22.9718     8.84957  16.7109     10.7353  7.96538    36.8075     24.2874     216.808     
1 1 1 29 8  43 o 19 16.2037 5.17611 -4.69578    7.6494   -2.37409    10.056   1.50219    25.1153     10.1728     25.1153     
1 1 1 29 8  44 o 3  103.613 3.15791 190.599     15.2448  197.821     17.4311  67.6303    251.803     9.65196     71.8032     
1 1 1 29 8  45 f 0  33.7846 6.05907 16.623      8.75554  29.098      11.9686  23.6811    342.503     0           0           
1 1 1 29 8  46 o 2  58.233  4.04244 60.4831     10.3985  64.8096     12.8171  41.407     206.727     4.45081     206.727     
1 1 1 29 8  47 o 13 51.7477 4.41419 48.3217     9.71545  51.7766     12.5732  37.2154    6.88412     5.8538      6.88413     
1 1 1 29 8  48 o 8  36.7168 5.62128 23.3474     9.27925  29.6686     10.8371  26.3146    293.106     8.99878     293.106     
1 1 1 29 8  49 o 3  18.706  5.50843 1.58114     8.01934  3.35991     9.07404  2.40224    121.67      2.90394     301.67      
1 1 1 29 8  50 o 12 20.3406 5.63389 8.5572      7.98897  0.351372    9.50045  3.26354    0.557244    15.1317     180.557     
1 1 1 29 8  51 o 14 70.0938 3.46129 84.3076     11.3043  96.5752     12.873   38.6888    267.868     18.4463     87.868      
1 1 1 29 8  52 o 17 34.2844 5.84162 25.4507     9.09299  21.9293     10.8308  19.4721    220.106     4.12329     40.106      
1 1 1 29 8  53 o 11 20.0564 5.79287 -0.615786   9.29412  8.0514      9.63094  3.08884    117.842     0.183618    297.842     
1 1 1 29 8  54 o 11 18.7005 5.65255 -0.223589   9.25921  3.31096     9.59641  3.83839    264.829     8.95548     84.8285     
1 1 1 29 8  55 o 7  16.1091 5.1692  -11.3034    9.01608  1.3906      9.64432  0.839507   60.7726     2.2469      240.773     
1 1 1 29 8  56 o 6  32.8828 6.36148 15.2851     10.6367  30.751      11.6314  9.79567    90.5257     22.1067     270.526     
1 1 1 29 8  57 o 8  31.6642 6.30818 24.7284     10.1633  17.4673     11.065   9.86419    248.158     19.7575     68.1583     
1 1 1 29 8  58 o 11 17.8702 5.49314 3.49157     8.77751  -3.90534    10.0294  2.08782    296.612     5.29154     116.612     
1 1 1 29 8  59 o 8  35.2555 6.01375 26.4031     9.93224  25.7455     11.0886  12.7119    17.0072     18.6199     197.007     
1 1 1 29 8  60 o 7  22.203  6.28203 9.20099     9.35549  4.33786     12.3299  3.42359    161.694     0.0356075   161.693     
1 1 1 29 8  61 o 14 22.0711 6.20131 8.67525     9.81873  5.88034     10.8051  5.84527    245.968     11.3636     65.9684     
1 1 1 29 8  62 o 14 22.2799 6.09277 14.2464     10.2144  -1.86729    10.91    7.46803    211.694     1.61984     211.694     
1 1 1 29 8  63 o 1  42.379  6.54175 37.8296     12.8759  39.5194     14.1284  36.574     62.781      24.6922     62.781      
1 1 1 29 8  64 o 16 23.0683 7.01564 8.18873     14.0183  2.30484     15.5452  5.74675    330.881     14.0417     150.881     
1 1 1 29 8  65 o 11 26.4354 7.02253 26.7298     15.4895  2.59137     10.9916  2.51919    346.559     26.6945     166.559     
1 1 1 29 8  66 o 7  31.8969 7.47584 26.2121     16.0295  23.1654     12.0171  15.2443    197.752     6.46636     17.7519     
1 1 1 29 8  67 o 14 17.7294 5.88109 -9.5278     15.1277  -3.91667    11.4497  1.32203    90.6288     8.14902     270.629     
1 1 1 29 8  68 o 5  26.3214 7.56167 12.9046     16.7645  17.8623     14.8202  8.88447    41.7069     0.493639    41.7069     
1 1 1 29 8  69 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 8  70 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 9  0  o 9  16.312  6.35902 6.59776     7.54623  6.59776     7.54623  18.5962    6.40638e-05 44.1065     6.40638e-05 
1 1 1 29 9  1  o 13 117.611 2.58295 244.75      15.805   247.555     14.5725  104.671    70.3752     41.9923     70.3752     
1 1 1 29 9  2  o 6  43.6459 4.13845 33.3207     8.75674  35.9826     8.88418  10.0357    54.4236     29.2489     234.424     
1 1 1 29 9  3  f 0  230.018 2.68857 946.528     30.9782  935.325     31.004   165.91     256.009     0           0           
1 1 1 29 9  4  o 18 96.9034 2.59687 171.61      12.5582  162.837     12.6099  61.1541    353.908     15.6571     173.908     
1 1 1 29 9  5  o 9  79.1197 2.74904 109.423     10.8407  113.832     10.8902  64.3111    337.601     47.3208     337.601     
1 1 1 29 9  6  o 14 180.544 2.66685 581.702     24.1155  577.72      24.1424  160.278    181.398     55.6468     181.398     
1 1 1 29 9  7  o 18 153.172 2.49979 431.333     19.173   403.078     19.1871  136.257    86.5692     49.5995     86.5692     
1 1 1 29 9  8  o 19 18.53   5.16378 -0.84508    7.04956  6.67851     7.54217  6.2928     332.659     16.2484     332.659     
1 1 1 29 9  9  o 9  132.321 2.72494 316.049     18.8415  307.503     17.2425  122.429    201.442     54.852      201.442     
1 1 1 29 9  10 o 11 189.395 2.69319 642.483     26.0127  633.865     25.1086  107.772    232.62      64.182      52.6199     
1 1 1 29 9  11 o 8  137.155 2.65166 335.087     18.5659  334.73      17.8449  98.5932    106.067     2.48915     286.067     
1 1 1 29 9  12 o 8  145.753 2.6378  387.135     19.1054  369.129     19.3948  94.9789    292.592     23.1815     112.592     
1 1 1 29 9  13 o 12 36.2205 5.34711 17.5521     9.99346  31.8284     8.80678  6.16789    314.67      10.7704     134.67      
1 1 1 29 9  14 o 2  57.5596 3.81063 54.6736     10.9445  65.0252     10.6816  29.6055    252.831     15.185      72.8306     
1 1 1 29 9  15 o 3  50.8427 4.26127 38.1954     10.2641  56.6343     10.7384  20.0835    343.34      23.9696     163.34      
1 1 1 29 9  16 o 10 106.638 2.9925  195.929     15.6136  210.188     16.3093  70.1613    254.323     12.5892     74.3227     
1 1 1 29 9  17 o 11 53.7166 4.21884 50.3842     11.6124  54.3724     10.628   20.9807    152.644     11.6992     152.644     
1 1 1 29 9  18 o 6  32.6695 5.24608 18.9853     8.11154  21.0863     8.67814  2.50598    311.836     19.4874     131.837     
1 1 1 29 9  19 o 7  125.136 2.62985 284.589     16.2271  273.682     16.7024  100.113    325.19      20.4267     325.19      
1 1 1 29 9  20 o 16 22.4116 5.44724 11.3137     7.59301  4.76201     7.60218  47.7742    326.229     121.728     326.229     
1 1 1 29 9  21 o 12 75.5329 2.96675 99.3365     11.2407  104.901     11.1205  47.2714    234.255     9.15652     54.2551     
1 1 1 29 9  22 o 19 23.686  5.94866 8.08991     8.73326  9.83803     9.00822  11.8355    349.327     41.1873     349.327     
1 1 1 29 9  23 o 2  19.6217 5.3466  7.60946     7.73994  0.889039    7.52348  13.837     222.053     38.7751     222.053     
1 1 1 29 9  24 o 6  102.887 2.78137 186.596     13.7978  191.627     14.8244  39.2801    190.762     69.0955     10.7616     
1 1 1 29 9  25 o 2  89.9576 3.03519 154.538     14.141   135.567     13.1491  69.0631    253.511     12.7969     253.511     
1 1 1 29 9  26 o 1  144.952 2.77439 368.169     20.5319  382.371     19.7078  131.993    322.031     55.7061     322.031     
1 1 1 29 9  27 o 17 15.6265 4.92744 -0.713739   8.14546  -5.57464    7.62078  9.54737    319.799     25.3083     319.799     
1 1 1 29 9  28 o 10 173.154 2.88177 554.203     25.8929  517.58      24.127   153.334    321.409     55.9851     321.409     
1 1 1 29 9  29 o 16 30.6387 5.96683 21.8237     10.155   13.9813     8.91216  5.66373    245.636     23.1858     65.6358     
1 1 1 29 9  30 o 11 83.0543 3.14435 119.565     12.9365  128.33      13.1365  45.9052    162.391     26.6015     342.391     
1 1 1 29 9  31 o 11 33.8068 5.84748 17.3022     9.85436  26.5523     9.9924   12.0148    83.0337     17.6618     263.034     
1 1 1 29 9  32 o 4  68.6221 3.52594 79.9452     11.2025  90.5219     12.8932  40.4969    349.817     15.4164     169.817     
1 1 1 29 9  33 o 14 84.2257 3.15181 127.328     12.6766  128.023     13.8121  83.0651    112.508     49.3408     112.508     
1 1 1 29 9  34 o 13 115.449 2.98722 230.796     17.0285  248.129     17.4752  70.5476    126.981     24.3518     306.981     
1 1 1 29 9  35 o 16 76.3479 3.40482 103.284     13.2284  107.577     12.6695  59.6074    267.372     12.5113     267.372     
1 1 1 29 9  36 o 14 77.7111 3.21322 104.315     12.7432  113.893     12.1163  60.7474    48.3047     12.8577     48.3046     
1 1 1 29 9  37 o 11 131.294 2.76969 304.998     18.754   314.031     17.6131  110.764    75.8224     34.4917     75.8224     
1 1 1 29 9  38 o 5  47.1988 4.26066 38.8955     9.73307  43.735      9.94373  11.636     331.872     9.69382     331.872     
1 1 1 29 9  39 o 6  61.9154 3.41546 72.0689     9.97499  67.3969     10.9755  49.8408    349.053     15.4181     349.053     
1 1 1 29 9  40 o 3  94.6185 2.83072 148.496     12.9453  174.481     13.8298  58.8595    16.9074     15.7638     196.907     
1 1 1 29 9  41 o 16 64.6266 3.33811 74.4353     10.3572  77.4656     11.1138  55.6839    234.678     23.6502     234.678     
1 1 1 29 9  42 o 16 42.3287 4.56144 29.4296     8.92615  38.2212     9.78594  34.5153    334.466     19.8624     334.466     
1 1 1 29 9  43 o 9  42.5884 4.75602 35.1428     9.27446  33.4266     10.2899  21.3431    142.511     13.6975     322.511     
1 1 1 29 9  44 o 10 37.0208 5.29724 34.9163     8.803    18.669      10.0842  22.6812    43.7717     0.752968    223.772     
1 1 1 29 9  45 o 8  23.0969 5.97524 11.1285     8.5289   5.4628      9.96194  6.3553     313.873     10.1121     133.873     
1 1 1 29 9  46 o 9  118.303 2.89837 256.609     16.8729  249.398     17.4261  100.634    17.401      36.045      17.401      
1 1 1 29 9  47 o 7  48.5111 4.64812 44.0689     9.87476  44.9843     12.0194  26.8656    155.102     11.6655     335.102     
1 1 1 29 9  48 o 11 32.7937 5.65314 32.2339     8.99214  9.40754     11.2852  13.2503    287.704     15.7261     107.704     
1 1 1 29 9  49 f 0  51.4447 4.67044 59.4908     10.1522  41.8019     12.3406  28.5935    138.17      0           0           
1 1 1 29 9  50 o 16 36.3474 5.87097 32.5107     9.33563  20.6859     11.8708  26.5641    173.06      8.28875     173.06      
1 1 1 29 9  51 o 8  52.2617 4.50306 47.6264     10.3276  56.859      12.7833  38.9698    102.019     8.17482     102.019     
1 1 1 29 9  52 o 8  24.6008 6.23856 6.148       8.63236  16.6074     11.2215  10.6988    103.855     5.86616     283.855     
1 1 1 29 9  53 o 19 39.4277 5.42888 21.5455     9.87463  42.2741     10.8016  22.2254    216.486     6.70528     36.4863     
1 1 1 29 9  54 o 17 21.5001 5.93442 9.0476      8.86986  4.54414     9.88317  6.4933     116.094     9.06354     296.094     
1 1 1 29 9  55 o 1  49.4685 4.99773 44.2747     11.9903  52.2422     12.0002  24.3016    3.55034     17.0789     183.55      
1 1 1 29 9  56 o 12 35.3549 6.11576 33.5423     10.9127  19.3735     11.0467  22.3137    28.7942     1.76001     28.7942     
1 1 1 29 9  57 o 11 26.7955 6.53101 15.919      10.5426  13.5138     10.7777  0.539815   133.588     31.786      313.587     
1 1 1 29 9  58 o 8  44.4265 5.70883 44.2373     11.7207  36.7871     12.6355  37.6429    265.56      22.8492     265.56      
1 1 1 29 9  59 o 6  45.3177 5.77664 48.4531     12.148   36.2324     12.9051  32.0876    179.683     6.72019     179.683     
1 1 1 29 9  60 o 18 33.4746 6.7651  18.918      11.0773  30.4416     12.9929  18.0676    23.0192     4.69494     203.019     
1 1 1 29 9  61 o 17 25.3997 6.58001 8.87216     10.6222  16.3288     11.5138  12.9604    158.916     0.689765    338.916     
1 1 1 29 9  62 f 0  22.0351 6.58077 0.199855    14.2243  8.71496     11.4728  9.82619    300.27      0           0           
1 1 1 29 9  63 o 9  20.1947 6.30325 5.09945     14.3609  -1.06836    10.3167  5.08152    247.864     0.554819    67.8644     
1 1 1 29 9  64 o 19 46.795  7.36964 38.2873     19.3272  64.7387     15.1422  33.884     123.902     9.53449     123.902     
1 1 1 29 9  65 o 8  23.096  6.99935 12.3052     16.4548  3.99404     12.2998  7.89207    350.129     3.47106     170.129     
1 1 1 29 9  66 o 16 33.9053 7.71455 35.5914     16.0636  23.9954     13.8643  17.6549    38.3052     3.35003     218.305     
1 1 1 29 9  67 o 8  33.2621 8.38774 36.0001     20.2584  26.8963     15.0917  18.4835    214.631     4.90455     214.631     
1 1 1 29 9  68 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 10 0  o 1  13.0201 5.76108 1.75552     7.74079  1.75552     7.74079  2.30618    360         5.20427     360         
1 1 1 29 10 1  o 17 78.6687 3.21689 118.954     13.261   102.806     12.0053  24.3547    333.228     63.8224     153.228     
1 1 1 29 10 2  o 14 73.8693 3.12766 98.8403     11.5985  96.4142     11.452   34.1302    319.822     35.6044     139.822     
1 1 1 29 10 3  o 17 116.596 2.8221  237.562     16.8379  247.23      16.0627  66.3547    115.149     37.5265     295.149     
1 1 1 29 10 4  o 2  155.981 2.79278 430.152     22.3197  436.634     21.3009  111.119    126.309     7.56326     306.309     
1 1 1 29 10 5  o 3  79.6012 3.041   118.573     12.3108  108.076     11.858   62.6331    200.517     16.3352     200.517     
1 1 1 29 10 6  o 9  83.9637 2.98397 132.61      12.5245  119.461     12.4821  59.7095    49.1045     1.7735      49.1047     
1 1 1 29 10 7  o 3  48.8973 4.06969 42.416      9.99696  44.3909     9.54143  17.3534    41.1431     27.1673     221.143     
1 1 1 29 10 8  o 18 113.62  2.91582 230.717     16.4353  229.965     16.7132  107.437    58.7782     53.414      58.7782     
1 1 1 29 10 9  o 13 185.245 2.98182 606.197     28.2726  617.268     27.0639  137.445    339.302     1.17636     339.303     
1 1 1 29 10 10 o 11 83.411  3.29269 122.708     13.7503  126.475     13.6637  49.0064    46.8534     19.9975     226.853     
1 1 1 29 10 11 o 13 107.915 3.02331 215.937     16.7174  200.223     15.9212  69.1846    227.12      17.6344     47.1201     
1 1 1 29 10 12 o 2  86.5269 3.09953 142.121     13.1072  125.963     13.61    63.7814    101.127     6.34391     101.127     
1 1 1 29 10 13 o 9  41.8803 5.0434  26.7586     10.636   38.6774     9.37785  7.81629    358.555     34.8645     178.555     
1 1 1 29 10 14 o 2  36.0883 5.00852 25.0109     8.92295  23.593      8.54767  0.235377   65.2637     41.6343     65.2636     
1 1 1 29 10 15 o 15 66.1491 3.20686 77.2294     10.2855  79.8167     10.8469  34.0792    234.995     22.3014     54.9948     
1 1 1 29 10 16 o 11 173.863 2.61692 530.838     22.7467  546.363     22.8537  120.418    59.8703     14.7078     239.87      
1 1 1 29 10 17 o 3  94.4726 2.75246 160.488     12.963   158.317     13.0425  77.2125    115.463     21.9165     115.463     
1 1 1 29 10 18 o 13 127.792 2.61402 303.849     16.6734  278.988     16.7462  94.8996    97.7839     4.72952     97.7839     
1 1 1 29 10 19 f 0  175.206 2.54517 556.333     22.7342  537.729     21.9621  88.9927    34.0028     0           0           
1 1 1 29 10 20 o 8  25.8567 5.46242 8.98306     7.95919  15.332      7.61324  5.63936    215.13      30.1914     215.13      
1 1 1 29 10 21 o 12 51.8046 3.83584 45.2004     9.80614  52.3302     9.76125  29.9733    323.835     16.1879     323.835     
1 1 1 29 10 22 o 2  40.3578 4.73041 36.9643     9.58892  24.1        8.7633   17.1258    4.68749     1.44546     4.68749     
1 1 1 29 10 23 o 5  34.4897 5.60919 21.6059     9.72625  23.4932     9.26741  1.79697    143.539     46.3076     143.539     
1 1 1 29 10 24 o 5  90.7283 3.26877 152.612     15.8669  143.098     13.7375  69.3237    21.4697     9.71315     21.4697     
1 1 1 29 10 25 o 10 62.3075 3.86826 76.3858     12.3457  64.6398     11.5538  40.4248    69.4182     5.09656     249.418     
1 1 1 29 10 26 o 19 140.956 2.7778  356.186     19.7634  354.436     19.4419  129.205    132.736     54.004      132.736     
1 1 1 29 10 27 o 11 56.8894 3.47782 57.6152     9.73028  59.5022     9.90551  33.974     135.995     11.2005     315.995     
1 1 1 29 10 28 o 1  126.708 2.58954 289.391     16.3125  284.633     16.5359  98.8276    114.536     14.0418     114.536     
1 1 1 29 10 29 o 17 24.7092 5.32878 16.7893     7.72166  4.61507     7.7752   3.73307    178.251     37.0086     178.251     
1 1 1 29 10 30 o 13 47.9614 4.17473 58.2425     9.21361  28.8245     9.29924  22.4753    338.626     20.7386     158.626     
1 1 1 29 10 31 o 17 94.7283 2.69027 155.548     12.8677  166.259     12.6011  70.2415    178.758     4.94011     178.758     
1 1 1 29 10 32 o 18 25.1481 5.62641 9.9945      7.84035  13.2871     8.11382  6.63519    89.8049     9.53982     269.805     
1 1 1 29 10 33 o 12 20.4696 5.37619 3.70524     7.4702   8.32585     7.44987  5.65977    108.522     33.4965     108.522     
1 1 1 29 10 34 o 3  49.193  4.00837 41.7528     9.3043   47.3913     10.1026  23.3603    323.876     20.8029     143.876     
1 1 1 29 10 35 o 10 45.916  4.42955 44.4865     9.4374   34.2782     10.1235  26.2484    111.734     9.21738     291.734     
1 1 1 29 10 36 o 7  39.3039 4.8233  25.9852     8.88634  32.6139     9.40617  28.5148    175.746     9.9394      175.746     
1 1 1 29 10 37 o 5  102.796 2.77411 187.366     13.8738  192.906     14.6537  85.1151    313.753     24.343      313.753     
1 1 1 29 10 38 f 0  43.502  4.55111 31.8693     9.39042  39.3039     9.80725  32.6861    230.582     0           0           
1 1 1 29 10 39 o 15 53.7203 3.91307 48.8736     10.1114  57.6265     10.6339  40.7197    225.509     8.91051     225.509     
1 1 1 29 10 40 o 10 57.4606 3.76621 61.9167     10.465   59.3394     10.954   45.8746    270         13.8257     270         
1 1 1 29 10 41 f 0  46.6171 4.53578 48.8132     9.77656  33.3821     10.3538  32.5629    273.856     0           0           
1 1 1 29 10 42 o 1  72.5269 3.39495 91.9609     12.2711  99.8732     12.25    51.3783    114.212     1.869       114.212     
1 1 1 29 10 43 o 5  36.0431 5.41273 22.3363     9.12864  28.4305     9.84529  21.1431    36.8721     3.40513     216.872     
1 1 1 29 10 44 o 1  120.315 2.89973 255.732     17.1745  267.906     17.7437  75.5504    183.941     18.6525     3.94126     
1 1 1 29 10 45 o 8  25.9837 6.05291 7.62635     8.52545  18.0155     10.1953  1.85324    14.0827     29.1342     194.083     
1 1 1 29 10 46 o 17 28.153  6.18282 14.3924     8.7629   17.0472     10.5165  8.35128    244.777     18.834      64.7765     
1 1 1 29 10 47 o 8  27.3228 6.09642 17.2037     8.90369  11.8083     10.1222  10.2869    259.094     13.0743     79.0937     
1 1 1 29 10 48 o 3  41.5616 5.68707 32.7872     11.2594  36.1532     11.5753  16.5708    104.813     22.7019     284.813     
1 1 1 29 10 49 o 14 41.114  5.4652  46.1796     10.1752  22.4761     11.0968  18.9923    240.525     16.9479     60.5247     
1 1 1 29 10 50 o 7  22.46   6.04996 4.70776     8.73865  11.7596     10.3156  7.605      63.0393     1.54231     63.0393     
1 1 1 29 10 51 o 10 31.0974 6.22146 17.615      9.44044  22.9278     10.8538  17.9142    19.8575     2.12305     199.858     
1 1 1 29 10 52 o 2  48.4961 4.98974 53.0243     11.1914  39.8026     11.9489  24.0416    340.208     17.0126     160.208     
1 1 1 29 10 53 o 3  15.1396 5.03654 -6.21244    7.91987  -8.69244    11.4102  0.32112    13.2731     11.4308     13.2732     
1 1 1 29 10 54 o 5  20.3461 6.04974 3.36904     8.76959  4.76399     12.0954  5.33431    121.906     3.87052     301.906     
1 1 1 29 10 55 f 0  38.5522 6.48514 35.8698     10.2223  27.418      14.9118  33.157     275.727     0           0           
1 1 1 29 10 56 o 4  32.9732 6.8025  22.0995     9.86721  25.6373     14.1601  20.4134    332.389     3.53178     332.389     
1 1 1 29 10 57 o 15 71.8327 4.27504 94.0881     14.5317  104.066     15.9704  59.5574    27.7229     23.4356     27.7229     
1 1 1 29 10 58 o 18 23.5607 6.46718 10.0268     10.4221  9.07545     11.4718  8.04517    160.627     9.69477     340.627     
1 1 1 29 10 59 o 1  39.5564 6.86023 31.5688     14.6753  36.9981     12.4928  25.4764    280.294     1.01317     280.294     
1 1 1 29 10 60 o 4  23.142  6.84132 11.017      14.242   3.10684     12.3846  9.95429    7.51978     1.1757      7.51978     
1 1 1 29 10 61 o 6  21.3133 6.41821 4.52087     13.9959  4.95376     10.1281  7.41121    260.168     0.17828     80.168      
1 1 1 29 10 62 o 5  48.1924 6.81907 44.193      16.6346  59.9332     15.0041  35.4188    251.746     9.61815     251.746     
1 1 1 29 10 63 o 7  22.7197 6.78466 15.7138     15.0288  -1.3532     11.9804  7.62015    55.9557     6.78968     235.956     
1 1 1 29 10 64 o 16 28.4495 7.75506 19.7442     19.1213  19.5154     12.9287  14.0233    233.605     3.38695     233.605     
1 1 1 29 10 65 o 2  21.1064 6.48546 -15.7629    16.5651  13.046      12.7215  3.61347    270.573     2.76855     90.5734     
1 1 1 29 10 66 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 10 67 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 11 0  o 12 95.5394 2.85354 163.105     13.6069  163.105     13.6069  69.1198    360         5.19516     180         
1 1 1 29 11 1  o 15 124.63  2.79641 262.208     16.9458  292.57      17.9424  89.0393    122.411     4.3073      302.411     
1 1 1 29 11 2  o 4  46.0927 4.25036 39.7081     10.0172  37.8904     9.14614  11.4789    168.925     4.38181     168.925     
1 1 1 29 11 3  o 11 97.5123 2.8331  175.849     13.6657  163.913     13.9399  64.9075    318.504     10.6785     138.504     
1 1 1 29 11 4  o 6  48.3846 3.97915 42.9435     9.21756  42.1494     9.70489  21.9643    182.151     8.3541      182.151     
1 1 1 29 11 5  o 8  75.7848 3.15175 109.436     12.0129  96.6034     11.7973  68.0078    74.0368     48.7549     74.0368     
1 1 1 29 11 6  o 10 110.977 2.86069 215.316     16.0023  224.635     15.752   109.515    249.105     61.9403     249.105     
1 1 1 29 11 7  o 16 37.9318 5.12236 32.4962     9.33183  21.6448     9.3566   10.69      291.362     9.10994     111.362     
1 1 1 29 11 8  o 9  40.0752 5.10587 32.7466     9.44562  27.1509     10.216   12.5334    111.873     17.0875     291.873     
1 1 1 29 11 9  o 4  20.5704 5.55239 6.30686     8.21863  4.61109     7.71216  14.1705    99.875      41.6855     99.875      
1 1 1 29 11 10 o 10 135.136 2.61535 327.663     18.1757  323.736     17.2063  131.121    317.987     66.6236     317.987     
1 1 1 29 11 11 o 5  49.818  3.73244 43.3778     9.26854  46.6193     9.06292  26.6394    198.974     10.379      198.974     
1 1 1 29 11 12 o 19 140.022 2.59521 341.156     18.858   358.114     17.4743  117.533    217.807     30.5798     217.807     
1 1 1 29 11 13 o 5  116.977 2.56467 249.213     14.96    239.062     15.0655  83.0488    130.549     3.8179      310.549     
1 1 1 29 11 14 o 8  49.5862 3.81357 47.9627     9.74903  41.4394     8.90365  28.6078    67.3564     0.749504    247.356     
1 1 1 29 11 15 o 14 65.0869 3.09325 75.8066     9.92845  76.31       10.1328  45.673     320.111     4.02522     320.111     
1 1 1 29 11 16 o 10 110.823 2.54944 213.983     14.0781  224.439     14.1989  68.5539    291.779     24.1492     111.779     
1 1 1 29 11 17 o 8  35.6356 5.17048 20.9352     9.48604  26.8551     8.31742  11.057     172.039     13.8064     352.039     
1 1 1 29 11 18 o 4  104.618 2.99165 202.068     16.3477  189.973     14.9577  83.3577    229.707     15.8396     229.707     
1 1 1 29 11 19 f 0  93.7846 3.01655 158.445     14.4909  156.788     13.7843  61.9182    181.745     0           0           
1 1 1 29 11 20 f 0  55.3827 4.20615 48.5387     11.5792  63.8998     11.1055  76.582     294.96      0           0           
1 1 1 29 11 21 o 8  41.4419 4.63409 33.1209     9.47103  30.5983     9.13764  16.7938    230.095     20.772      50.0947     
1 1 1 29 11 22 o 4  74.3175 3.23456 100.693     12.2358  98.0717     11.7406  71.6171    334.692     40.2233     334.692     
1 1 1 29 11 23 o 14 81.8906 3.28191 121.964     12.7274  119.415     14.0474  49.7727    175.645     18.7641     355.645     
1 1 1 29 11 24 o 6  109.69  2.81479 233.519     15.4759  198.234     15.3483  102.494    174.326     46.2926     174.326     
1 1 1 29 11 25 o 5  49.6414 3.70443 44.4004     9.17678  45.3855     8.97145  12.1124    271.815     45.6957     91.8146     
1 1 1 29 11 26 o 3  24.1595 5.6376  8.03759     8.25761  12.4677     7.80511  5.09515    352.257     6.75125     172.257     
1 1 1 29 11 27 o 8  60.2293 3.40857 65.7381     9.68958  65.6788     10.6861  50.3609    305.476     17.822      305.476     
1 1 1 29 11 28 o 16 83.3198 2.87611 118.229     12.0691  131.475     11.8354  76.8029    290.92      35.4886     290.92      
1 1 1 29 11 29 o 5  44.2133 4.17894 40.3711     9.0948   32.1116     8.87428  21.6781    170.349     16.7491     350.349     
1 1 1 29 11 30 o 5  17.9126 5.21863 0.684414    7.49781  3.58328     7.69745  0.868739   124.517     10.8875     124.517     
1 1 1 29 11 31 o 18 56.6287 3.4756  59.8441     9.95529  56.9024     9.57755  35.5221    338.252     7.86591     158.252     
1 1 1 29 11 32 o 1  54.1292 3.70195 53.5451     9.82528  53.6557     10.0076  28.2058    182.596     19.1065     2.59645     
1 1 1 29 11 33 o 1  77.2521 3.14887 106.835     12.8441  109.082     11.3652  58.5878    22.6436     7.71376     22.6436     
1 1 1 29 11 34 o 16 22.8162 5.71292 9.33736     8.16493  8.28139     8.18231  4.87268    239.003     4.17807     59.0025     
1 1 1 29 11 35 o 11 33.3003 5.26004 20.2495     8.71967  22.5801     8.40035  15.5651    249.811     10.7939     69.8114     
1 1 1 29 11 36 o 12 29.3584 5.49692 16.567      8.31994  16.9312     8.1101   15.2805    88.43       0.545739    88.43       
1 1 1 29 11 37 o 16 83.5323 3.08392 134.146     12.6133  118.711     13.0449  54.8619    116.474     8.83851     296.474     
1 1 1 29 11 38 o 3  28.1785 5.88507 17.1816     8.52875  13.4365     9.40169  7.75654    90.5774     19.0668     270.577     
1 1 1 29 11 39 o 2  43.1577 4.67364 36.5696     9.42929  33.8524     10.0882  19.0088    105.781     20.5344     285.781     
1 1 1 29 11 40 o 19 59.4327 3.76461 60.2288     10.5216  69.9608     11.6758  48.9375    118.299     16.5104     118.299     
1 1 1 29 11 41 o 18 20.8191 5.74154 9.01694     8.63996  1.02618     9.25447  5.01833    145.093     6.49066     325.093     
1 1 1 29 11 42 o 18 53.048  4.44989 53.4395     11.4302  52.2553     11.759   41.3982    344.954     10.7338     344.954     
1 1 1 29 11 43 o 19 31.8612 6.00197 15.1695     9.74982  25.6186     10.1255  18.1195    83.6913     11.7049     83.6913     
1 1 1 29 11 44 o 10 57.4108 4.02845 61.8952     11.0301  61.1124     11.8191  46.5953    11.2071     14.5818     11.2071     
1 1 1 29 11 45 o 2  66.6629 3.70689 82.3801     11.7986  82.2593     12.7457  45.6928    177.098     1.24466     357.098     
1 1 1 29 11 46 o 10 32.4911 6.09149 26.2225     9.42698  16.5203     11.354   21.6737    299.897     3.42332     299.897     
1 1 1 29 11 47 o 7  20.5617 5.73657 8.96667     8.30097  0.54718     9.95235  4.38889    166.382     0.309756    166.382     
1 1 1 29 11 48 o 2  23.193  5.85724 -1.87424    9.57631  17.5218     9.9044   7.02428    290.708     13.2477     110.708     
1 1 1 29 11 49 o 18 41.6787 5.75016 41.534      11.565   29.5167     11.5425  31.2762    1.98466     8.48417     1.98466     
1 1 1 29 11 50 o 17 84.2921 3.44753 144.534     13.3729  119.942     15.2423  71.5063    166.472     26.9166     166.472     
1 1 1 29 11 51 o 3  16.5678 5.25819 -0.558657   8.31537  -4.17892    9.94896  1.81314    221.435     7.54967     41.4354     
1 1 1 29 11 52 o 4  55.1365 4.46627 62.8729     11.0039  54.684      12.8617  43.9533    120.895     14.5155     120.895     
1 1 1 29 11 53 o 9  14.282  4.7863  -12.7813    8.41964  -4.8105     9.78037  1.4631     277.201     11.3702     277.201     
1 1 1 29 11 54 o 1  39.0696 5.79136 30.9597     10.2197  32.4438     11.7252  28.304     4.29636     20.7011     4.29636     
1 1 1 29 11 55 o 13 41.1383 5.69665 29.7987     10.9711  40.3734     11.6789  27.1371    135.041     1.8445      135.041     
1 1 1 29 11 56 o 6  17.0512 5.53997 -15.0206    9.81955  2.81011     12.1321  2.05559    166.661     21.8632     166.661     
1 1 1 29 11 57 o 2  32.0295 6.71333 17.1918     11.9945  27.5198     11.653   21.2679    303.028     4.79851     303.028     
1 1 1 29 11 58 o 13 39.4552 7.3825  37.3382     13.7988  33.6402     16.0458  23.6191    140.451     3.0047      320.451     
1 1 1 29 11 59 o 6  60.9421 5.94122 75.7007     17.6254  79.5549     17.6886  49.4245    178.632     18.6153     178.632     
1 1 1 29 11 60 o 12 25.6647 7.09657 21.3049     14.5009  3.14625     13.1996  13.0001    30.1559     4.41764     30.1559     
1 1 1 29 11 61 o 6  68.3338 5.20067 93.8423     18.3616  97.5908     16.5342  63.3747    89.2396     37.7837     89.2396     
1 1 1 29 11 62 o 8  17.7537 5.87202 -4.67941    14.6735  -5.70433    11.0485  2.11157    69.3334     5.25669     249.333     
1 1 1 29 11 63 o 9  49.5878 6.70247 64.9683     17.045   49.2724     15.0873  35.8484    8.95271     9.56469     8.95271     
1 1 1 29 11 64 o 17 33.0755 8.16871 34.997      20.0092  26.6003     13.6357  18.6008    139.893     2.80523     139.893     
1 1 1 29 11 65 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 12 0  o 9  145.72  2.83176 378.488     20.644   378.488     20.644   122.956    180         26.747      180         
1 1 1 29 12 1  o 11 100.297 2.95458 181.847     14.8714  178.147     14.7644  96.8379    50.3326     51.8576     50.3326     
1 1 1 29 12 2  o 12 47.9598 4.46693 49.649      10.6612  35.3281     10.1052  9.36809    235.229     5.13752     235.229     
1 1 1 29 12 3  o 13 41.8446 4.51261 41.0026     8.91405  24.5795     8.95881  13.1059    345.214     3.29651     345.214     
1 1 1 29 12 4  o 4  104.772 2.77788 189.195     14.2076  203.291     14.9142  73.8248    38.7722     4.92286     218.772     
1 1 1 29 12 5  o 18 25.3389 5.57999 15.185      8.02741  7.73542     8.08962  7.91006    316.522     38.4525     316.522     
1 1 1 29 12 6  o 12 109.479 2.55789 210.381     13.8849  217.497     14.1443  67.9081    173.685     24.6468     353.685     
1 1 1 29 12 7  o 14 58.1658 3.25436 64.0881     9.37206  57.8409     9.42172  7.81994    204.421     66.7114     24.4207     
1 1 1 29 12 8  o 15 56.4812 3.44979 60.8931     9.48089  54.3788     9.80544  36.5075    122.317     1.91512     302.317     
1 1 1 29 12 9  o 4  18.5989 5.02613 9.47454     7.42677  -6.00756    7.49491  22.1254    161.274     61.3382     161.274     
1 1 1 29 12 10 o 2  62.5996 3.44844 71.7047     10.9283  69.6457     10.5378  35.392     77.9825     16.5124     257.983     
1 1 1 29 12 11 o 8  101.12  2.98736 179.938     15.8512  186.354     14.2836  89.3188    19.7404     32.7106     19.7404     
1 1 1 29 12 12 o 12 143.004 2.88036 378.454     21.6001  353.267     19.6442  124.174    190.916     37.5953     190.916     
1 1 1 29 12 13 o 10 81.6993 3.2821  121.142     14.3542  118.838     12.3482  62.2856    298.538     7.56286     298.538     
1 1 1 29 12 14 o 15 101.192 3.37994 189.278     17.8672  178.931     16.3136  84.3456    89.1234     21.6225     89.1234     
1 1 1 29 12 15 o 9  40.631  5.20959 42.0323     10.6354  21.4114     9.63092  24.0704    120.843     0.87067     300.843     
1 1 1 29 12 16 o 12 100.349 3.30633 177.292     16.8433  184.772     16.2975  57.5918    132.656     32.1322     312.656     
1 1 1 29 12 17 o 18 98.5122 3.29063 180.24      17.204   168.827     15.1829  71.4109    8.12598     1.31482     188.126     
1 1 1 29 12 18 o 4  114.964 2.91999 250.233     17.1129  223.84      16.4685  123.857    132.887     80.8635     132.887     
1 1 1 29 12 19 o 15 130.469 2.80653 314.224     18.7154  295.54      17.9446  95.7349    16.9649     0.847295    196.965     
1 1 1 29 12 20 o 4  46.0765 4.12731 42.7925     9.32558  35.3908     9.23429  38.5187    41.6834     20.2246     41.6834     
1 1 1 29 12 21 o 18 28.6876 5.58961 13.1417     8.33517  18.1636     8.37595  7.4311     8.50598     1.21133     8.50598     
1 1 1 29 12 22 o 2  53.5851 4.1031  63.3224     11.4598  42.8958     10.1033  48.5868    243.782     26.729      243.782     
1 1 1 29 12 23 o 4  58.6382 3.87544 70.2887     10.659   55.5799     11.5613  28.947     54.2019     25.6353     234.202     
1 1 1 29 12 24 o 18 132.4   2.87494 326.83      18.5897  302.737     19.4497  126.872    346.927     60.393      346.927     
1 1 1 29 12 25 o 2  33.8892 5.32421 19.454      9.09921  24.5666     8.54611  0.611681   244.671     47.2404     244.671     
1 1 1 29 12 26 o 5  64.8927 3.32147 79.5396     10.9416  73.1258     10.5145  54.7054    330.385     18.3898     330.385     
1 1 1 29 12 27 o 10 50.6024 4.13792 48.0392     10.7019  46.404      9.89187  38.6617    86.0552     8.59123     86.0552     
1 1 1 29 12 28 o 8  56.9434 3.5851  63.4322     10.0018  55.0236     10.183   36.3381    116.197     7.31878     296.197     
1 1 1 29 12 29 o 10 114.254 2.77995 230.533     16.2642  238.999     15.4941  80.8364    206.858     4.37907     26.8581     
1 1 1 29 12 30 o 10 34.3611 5.26557 24.5898     8.97899  20.9475     8.64195  19.4724    13.5178     3.66919     193.518     
1 1 1 29 12 31 o 7  86.2154 2.88671 128.485     12.305   139.743     12.5613  79.2339    66.8528     35.6484     66.8528     
1 1 1 29 12 32 o 4  33.4124 5.33695 23.3615     8.77063  19.9054     8.69469  17.0615    295.337     7.92294     115.337     
1 1 1 29 12 33 o 7  32.3288 5.4728  17.2928     8.4651   23.551      9.10155  19.295     201.95      1.06752     201.95      
1 1 1 29 12 34 o 8  41.9718 4.47647 36.3571     8.97313  30.0063     9.17631  23.5326    347.892     9.53413     167.892     
1 1 1 29 12 35 o 4  28.1024 5.69048 14.6095     8.21116  16.1078     8.63909  11.3201    251.775     3.83552     251.775     
1 1 1 29 12 36 o 13 39.7441 4.76608 33.8232     8.97923  26.4346     9.21961  24.4435    102.77      3.58361     282.77      
1 1 1 29 12 37 o 18 47.7047 4.12393 45.7398     9.45881  39.1427     9.7542   36.8252    59.7702     9.53602     59.7702     
1 1 1 29 12 38 o 4  36.4985 5.11513 22.6581     8.88196  29.0175     9.16675  22.8209    321.644     1.51978     141.644     
1 1 1 29 12 39 o 6  90.6428 3.03261 157.577     12.8683  140.799     14.4247  82.8296    285.002     37.412      285.002     
1 1 1 29 12 40 o 19 34.9895 5.86296 24.476      9.93533  24.3145     10.3103  24.0795    342.972     4.10954     342.972     
1 1 1 29 12 41 o 2  24.3257 5.86095 14.8736     8.39042  5.52532     9.6724   7.43041    273.616     14.616      93.6162     
1 1 1 29 12 42 o 13 19.9547 5.65358 7.07147     8.13274  1.23978     9.48044  5.99539    42.6908     6.19425     222.691     
1 1 1 29 12 43 o 9  37.4887 5.47974 23.3969     9.29933  32.8757     10.6583  25.6069    48.8239     2.12893     48.8239     
1 1 1 29 12 44 o 16 17.4638 5.41363 -1.6734     8.42368  0.849806    9.67942  3.27987    191.19      7.40089     11.1902     
1 1 1 29 12 45 o 8  36.2115 5.79073 34.5912     9.93211  19.1759     10.9502  8.75622    16.9144     31.5176     196.914     
1 1 1 29 12 46 o 13 56.3654 4.81822 48.2611     12.5521  76.3717     13.6925  40.5797    282.933     3.75294     282.933     
1 1 1 29 12 47 o 11 50.9958 4.71708 45.9608     10.8899  55.3866     12.6647  37.9347    156.346     6.76461     156.346     
1 1 1 29 12 48 o 17 35.4026 5.82386 17.5184     10.0481  35.2556     10.7154  28.2437    212.738     18.1954     212.738     
1 1 1 29 12 49 o 4  28.6583 6.23529 21.5081     9.31417  11.9048     11.3589  17.9312    187.552     4.92176     187.552     
1 1 1 29 12 50 o 6  19.7891 5.62224 10.4029     8.81079  -5.77407    10.1933  5.16193    6.12983     3.6276      186.13      
1 1 1 29 12 51 o 1  50.4504 4.66974 53.1669     10.738   46.5471     12.0563  34.941     57.0413     2.55955     57.0412     
1 1 1 29 12 52 f 0  37.2779 6.25643 20.6848     12.0146  39.3101     11.6644  21.2851    290.519     0           0           
1 1 1 29 12 53 o 6  19.3721 5.89034 0.895767    10.2098  3.55823     10.4528  4.22049    23.5216     6.35815     203.522     
1 1 1 29 12 54 o 4  26.1967 6.77585 12.5682     10.7855  15.1859     12.4088  9.21876    290.647     4.40865     290.647     
1 1 1 29 12 55 o 13 33.9763 6.68327 32.2355     11.7072  18.1149     12.8798  25.893     117.243     13.304      117.243     
1 1 1 29 12 56 o 9  44.4684 6.89618 47.6581     15.3335  39.5923     14.5864  19.6021    233.08      19.7166     53.0796     
1 1 1 29 12 57 o 10 44.672  6.37558 52.511      12.8259  34.1943     14.5861  36.0522    348.988     15.1475     348.988     
1 1 1 29 12 58 o 1  27.7042 6.82856 13.283      12.978   19.7982     10.9557  12.0965    57.9323     9.04843     237.932     
1 1 1 29 12 59 o 8  26.0245 6.68184 30.6695     14.9844  -3.89622    10.6175  13.1354    270.139     1.81126     90.1389     
1 1 1 29 12 60 o 7  39.7084 7.04364 31.7018     16.634   43.192      12.3276  30.6704    359.695     14.497      359.695     
1 1 1 29 12 61 o 5  22.2292 6.61192 19.1666     14.5214  -9.38406    12.745   5.14104    42.2075     0.758062    222.208     
1 1 1 29 12 62 o 5  22.4562 6.85324 1.82941     15.1541  11.8603     13.6688  5.40638    250.654     9.56271     70.6544     
1 1 1 29 12 63 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 12 64 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 13 0  o 1  29.5212 7.26416 20.5432     9.70746  20.5432     9.70746  10.4785    360         12.9665     180         
1 1 1 29 13 1  o 1  70.4949 3.47789 84.565      11.698   94.9027     12.7284  29.6549    7.71256     43.4106     187.713     
1 1 1 29 13 2  o 18 36.3306 5.53667 26.8304     9.44449  23.2754     10.124   16.5403    327.121     10.6941     147.121     
1 1 1 29 13 3  o 11 99.3188 3.05412 179.096     15.0914  174.79      15.2344  95.8287    328.41      47.1542     328.41      
1 1 1 29 13 4  o 18 57.4859 4.0641  61.7673     10.8666  58.66       12.1434  40.3252    199.621     0.445072    199.621     
1 1 1 29 13 5  o 1  53.9499 3.88484 66.6655     10.4452  40.8398     9.85414  19.8355    287.121     37.2904     107.121     
1 1 1 29 13 6  o 12 48.8242 4.35433 55.7511     11.2011  33.2763     9.4376   31.212     356.625     4.11973     176.625     
1 1 1 29 13 7  o 16 27.1115 5.90809 11.5144     9.5141   15.3813     8.33534  6.27033    5.86167     14.8429     185.862     
1 1 1 29 13 8  o 18 23.2447 5.82621 7.38471     9.07453  9.9958      8.04849  2.87175    22.4809     8.94748     202.481     
1 1 1 29 13 9  o 3  75.7614 3.51865 116.206     13.2461  91.7425     13.1792  63.9681    214.293     18.5146     214.293     
1 1 1 29 13 10 o 4  94.8155 3.0485  160.474     14.5071  162.315     14.3862  68.0112    322.744     3.74479     142.744     
1 1 1 29 13 11 o 16 22.6181 5.7701  5.78588     8.76615  9.99054     8.19063  3.02805    29.5688     10.8949     209.569     
1 1 1 29 13 12 o 7  76.2603 3.15262 97.8497     11.838   111.721     12.1298  45.0868    347.055     21.3886     167.055     
1 1 1 29 13 13 o 5  81.4857 3.06178 129.981     12.0043  109.232     12.7543  32.8868    169.375     54.2649     349.375     
1 1 1 29 13 14 o 17 37.7684 5.19504 26.4613     9.26803  27.5083     9.69018  20.8355    247.082     7.37646     67.0824     
1 1 1 29 13 15 f 0  118.118 2.5801  257.117     14.8713  242.296     15.5956  76.2055    165.443     0           0           
1 1 1 29 13 16 o 6  158.386 2.61447 463.039     20.6951  434.575     20.7899  121.837    327.715     8.29143     327.715     
1 1 1 29 13 17 o 3  34.8334 4.95958 19.3909     8.22438  26.7887     8.49465  11.4083    161.902     23.4963     341.902     
1 1 1 29 13 18 o 17 114.365 2.65691 234.301     15.2315  234.463     15.1823  111.788    287.631     55.9628     287.631     
1 1 1 29 13 19 o 18 24.256  5.72153 11.32       7.72212  9.53261     8.66879  3.2547     215.986     20.1005     35.9855     
1 1 1 29 13 20 o 17 19.389  5.31306 1.61726     7.37794  7.22625     7.63514  16.2063    56.6983     56.1497     56.6983     
1 1 1 29 13 21 o 18 16.7323 5.10837 -0.544639   8.04097  -0.103119   7.5997   1.36982    326.752     9.6763      326.752     
1 1 1 29 13 22 o 2  37.0636 5.17031 27.3965     9.35679  25.02       9.16806  18.3132    196.931     12.3458     16.9307     
1 1 1 29 13 23 o 8  28.1822 5.78095 14.1682     8.37465  16.3428     8.91712  7.69135    250.736     18.9979     70.7359     
1 1 1 29 13 24 o 4  98.0426 3.00394 187.763     13.6748  159.44      15.4783  74.9417    134.297     6.85091     134.297     
1 1 1 29 13 25 o 14 20.6618 5.40497 -3.83488    7.76322  13.0167     8.86802  2.58075    220.495     10.281      40.495      
1 1 1 29 13 26 o 11 50.4616 4.01988 50.8102     9.60191  43.3285     10.2324  36.9694    224.255     4.29802     224.255     
1 1 1 29 13 27 o 13 25.0372 5.94278 10.9471     8.97194  11.8463     8.63545  7.09074    223.688     13.1325     43.6885     
1 1 1 29 13 28 o 9  16.9599 5.14157 -4.56982    7.63679  3.67785     8.39055  1.69305    346.75      15.4568     346.75      
1 1 1 29 13 29 o 14 64.1047 3.49061 72.3392     10.7026  77.701      11.5556  51.9603    34.7349     13.3848     34.7349     
1 1 1 29 13 30 o 17 62.4952 3.47282 69.8445     10.6531  72.799      10.9257  16.4145    196.483     57.0747     16.4828     
1 1 1 29 13 31 o 7  45.8273 4.58366 42.192      10.5153  36.8828     9.94481  34.5795    300.323     7.46598     300.323     
1 1 1 29 13 32 f 0  89.6491 3.0326  154.377     13.0358  136.858     14.0113  68.2179    306.446     0           0           
1 1 1 29 13 33 o 17 19.83   5.5582  3.79628     8.10343  5.51316     8.34738  1.7686     50.7979     25.4151     50.798      
1 1 1 29 13 34 o 15 63.0093 3.56048 73.1335     10.962   72.417      11.3305  60.1816    160.811     33.2889     160.811     
1 1 1 29 13 35 o 18 68.4151 3.49753 85.7056     11.5331  85.6976     12.2741  39.0925    314.403     19.3897     134.403     
1 1 1 29 13 36 o 9  30.7407 5.68225 14.6083     8.82954  22.8752     9.10591  19.7508    259.638     3.62846     259.638     
1 1 1 29 13 37 f 0  47.6639 4.37881 41.8144     9.96281  43.7998     10.4631  40.5869    54.261      0           0           
1 1 1 29 13 38 f 0  66.027  3.54066 88.95       11.4306  71.9867     11.6783  43.1264    155.439     0           0           
1 1 1 29 13 39 o 9  18.615  5.52249 2.41445     8.26114  2.15908     9.12499  4.50196    25.4907     5.83906     205.491     
1 1 1 29 13 40 o 19 31.155  5.916   18.1502     9.22196  21.2262     9.66173  10.958     276.184     19.4053     96.1844     
1 1 1 29 13 41 o 16 34.3631 5.96923 23.6592     9.47576  24.5579     10.9441  22.3416    211.062     0.125461    211.062     
1 1 1 29 13 42 o 14 44.0359 5.4912  43.8887     10.6076  33.5273     12.3735  34.5931    280.845     10.0781     280.845     
1 1 1 29 13 43 o 3  15.9228 5.15931 -4.43207    8.3618   -4.33823    10.1506  1.94702    255.117     6.10316     75.1174     
1 1 1 29 13 44 o 7  75.3157 3.62034 101.643     12.9191  110.082     14.2502  52.9712    168.571     0.0421879   168.571     
1 1 1 29 13 45 o 1  65.5198 3.80509 81.8239     11.9905  79.7672     12.7473  61.5425    191.268     32.9199     191.268     
1 1 1 29 13 46 o 1  37.1677 5.91665 32.1292     9.9536   25.3295     11.6317  25.6742    61.5819     3.27546     61.5819     
1 1 1 29 13 47 o 10 21.3948 5.64461 -6.29155    8.91692  16.4122     9.96858  6.32278    181.659     10.6149     1.65924     
1 1 1 29 13 48 o 10 41.5081 5.53035 27.249      10.6109  43.9856     11.4966  21.0303    91.4245     13.4859     271.425     
1 1 1 29 13 49 o 15 20.8838 6.0982  9.65185     10.8297  -0.562725   10.4737  5.66743    255.201     8.34557     75.2005     
1 1 1 29 13 50 o 10 41.6319 6.32032 48.5447     12.382   26.3918     13.4861  31.8818    235.486     11.3292     235.486     
1 1 1 29 13 51 o 15 69.4269 4.22376 91.3907     13.816   93.9229     15.2602  39.724     285.63      16.1197     105.63      
1 1 1 29 13 52 o 17 50.885  5.74446 68.9003     12.7776  38.9016     14.1974  37.9373    92.9871     8.08395     92.9871     
1 1 1 29 13 53 f 0  32.7754 6.87412 25.0358     11.5343  22.5474     12.7892  21.1922    217.066     0           0           
1 1 1 29 13 54 o 5  19.3412 5.91469 7.88737     10.785   -9.74577    11.8686  5.35761    335.341     0.771086    155.341     
1 1 1 29 13 55 o 19 29.7432 7.10736 19.3561     11.8454  20.5806     13.3342  13.6006    113.67      9.69971     293.67      
1 1 1 29 13 56 o 9  22.6172 6.25839 19.1193     11.8821  -16.0018    13.7732  8.69616    32.8328     7.53319     212.833     
1 1 1 29 13 57 o 1  23.787  6.60688 7.65929     12.2256  13.3926     11.166   11.1597    298.981     1.08741     298.981     
1 1 1 29 13 58 o 11 25.4776 6.92751 6.28426     14.5397  19.122      12.0068  12.1625    353.494     2.01998     353.494     
1 1 1 29 13 59 o 16 27.7258 7.30097 19.4877     15.4171  17.9747     11.9188  14.2167    132.657     1.63972     132.657     
1 1 1 29 13 60 o 18 27.8215 7.77475 7.49735     18.8106  28.0149     16.0095  12.091     186.214     2.88363     186.214     
1 1 1 29 13 61 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 13 62 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 14 0  o 2  17.1012 6.79305 7.27326     8.80536  7.27326     8.80536  34.2584    8.65137e-06 93.3912     8.65137e-06 
1 1 1 29 14 1  o 12 61.1638 3.63169 65.383      10.9231  70.5299     11.1289  37.2135    117.708     14.2189     297.708     
1 1 1 29 14 2  o 9  36.6506 5.04656 24.2701     9.15313  26.5388     8.70402  5.82089    221.6       39.2033     41.5996     
1 1 1 29 14 3  o 15 66.2787 3.56517 75.8964     12.2153  83.4545     11.1857  51.79      245.055     7.85243     245.055     
1 1 1 29 14 4  o 19 77.1092 3.3857  97.0999     13.344   118.243     12.4798  50.4908    63.5989     12.4184     243.599     
1 1 1 29 14 5  o 18 89.572  3.32149 138.547     15.0632  151.053     14.604   63.2178    151.655     6.02983     331.655     
1 1 1 29 14 6  o 13 35.389  5.42614 26.0712     8.86123  21.777      9.83507  2.70034    256.387     43.6146     76.3866     
1 1 1 29 14 7  o 3  107.331 3.0792  209.61      15.8884  204.829     17.1258  82.0128    243.833     4.55197     243.833     
1 1 1 29 14 8  o 3  47.1713 4.77202 37.8301     10.3127  45.2532     11.6192  33.5253    104.448     2.2543      104.448     
1 1 1 29 14 9  o 3  30.6391 5.79376 14.9248     8.71214  21.3142     9.53473  15.164     89.5289     3.68117     269.529     
1 1 1 29 14 10 o 13 83.7135 3.1373  127.837     12.6379  124.824     13.5602  85.0795    49.9801     49.1628     49.9801     
1 1 1 29 14 11 o 1  42.4677 4.54921 29.6079     9.46144  37.8647     9.12881  7.34643    88.4053     45.672      268.405     
1 1 1 29 14 12 o 10 96.829  2.88198 172.956     14.0565  164.172     13.848   86.0755    159.445     29.6527     159.445     
1 1 1 29 14 13 o 2  50.0106 3.91394 34.4476     9.29277  58.9188     9.3547   23.3579    315.295     24.6799     135.295     
1 1 1 29 14 14 o 4  81.665  3.07372 124.634     12.6099  116.002     12.4509  65.7226    128.548     12.0382     128.548     
1 1 1 29 14 15 o 4  96.8939 2.78397 168.215     12.9961  169.239     13.9684  71.3924    326.07      0.232829    146.07      
1 1 1 29 14 16 o 12 26.6095 5.52809 16.6539     7.98872  10.1029     8.01274  10.4169    68.1398     4.60622     248.14      
1 1 1 29 14 17 o 1  46.7232 4.03372 48.8936     9.04294  32.4986     9.06781  19.3326    274.225     27.6326     94.2248     
1 1 1 29 14 18 o 15 55.9911 3.7185  56.9115     10.1763  57.8113     10.447   33.7042    135.441     12.7502     315.441     
1 1 1 29 14 19 o 3  46.8132 3.99305 45.9258     9.11543  35.3438     9.08691  33.0931    152.577     1.62293     152.577     
1 1 1 29 14 20 o 1  76.3933 3.15424 104.076     12.3092  107.216     11.7169  56.5065    112.788     1.86079     112.788     
1 1 1 29 14 21 o 7  16.2276 4.94715 1.5393      7.44658  -2.23381    7.28781  2.23135    115.567     14.5287     115.567     
1 1 1 29 14 22 o 10 73.143  3.1724  98.6535     11.8993  95.2909     11.2448  54.3301    333.714     2.67801     333.714     
1 1 1 29 14 23 o 12 26.8934 5.43485 20.7783     8.07483  5.56803     8.83714  9.79784    204.205     11.9093     24.2054     
1 1 1 29 14 24 o 3  34.3629 5.18014 26.8168     8.67737  18.9537     8.65438  10.2719    347.091     26.0187     167.091     
1 1 1 29 14 25 o 9  17.3393 5.10173 -3.07966    7.68203  4.9244      7.5294   1.01944    258.515     15.2748     258.515     
1 1 1 29 14 26 f 0  103.16  2.77549 187.779     14.5517  195.968     14.0731  74.5085    43.0729     0           0           
1 1 1 29 14 27 o 18 25.8474 5.66879 9.93197     8.21542  15.3675     8.21259  9.87619    11.7893     9.20347     191.789     
1 1 1 29 14 28 o 17 54.6457 3.93469 53.4177     10.7192  56.9538     10.5102  37.4544    40.4358     2.25872     220.436     
1 1 1 29 14 29 o 9  36.0478 5.05482 24.5992     8.71763  25.4953     8.90074  18.8463    338.707     10.3815     158.707     
1 1 1 29 14 30 o 14 13.5305 4.45816 -5.74127    7.46752  -6.5794     7.29747  1.7555     234.007     7.98725     234.007     
1 1 1 29 14 31 o 11 28.1227 5.93387 15.3458     8.58193  15.6201     9.41914  15.0301    101.225     1.68344     281.225     
1 1 1 29 14 32 o 11 38.9352 4.91095 35.2628     9.11323  23.463      9.17958  24.6301    34.8195     3.19354     214.819     
1 1 1 29 14 33 o 7  64.3886 3.38842 73.6371     10.8147  78.2699     10.8895  36.5536    220.039     19.2028     40.0389     
1 1 1 29 14 34 o 14 50.8631 3.95517 49.518      9.87317  46.9075     9.94724  46.1454    347.737     22.6158     347.737     
1 1 1 29 14 35 o 10 69.5113 3.28154 93.4002     11.2422  83.7328     11.4463  57.538     126.249     16.0005     126.249     
1 1 1 29 14 36 o 5  21.1859 5.81335 5.28505     9.37686  7.47561     8.37267  8.0266     163.829     2.05278     343.829     
1 1 1 29 14 37 o 3  50.237  4.20875 48.6712     10.568   46.6706     10.2135  35.8673    336.014     1.54953     336.014     
1 1 1 29 14 38 o 10 56.5141 3.96606 63.3853     11.5658  56.6129     10.61    45.5559    70.8978     11.9215     70.8978     
1 1 1 29 14 39 o 5  47.7158 4.83406 59.1761     10.4689  31.0399     10.8413  28.2917    187.711     9.98738     7.71133     
1 1 1 29 14 40 f 0  42.0396 5.2297  32.1554     10.685   38.099      10.4912  27.4329    71.5751     0           0           
1 1 1 29 14 41 o 13 51.7098 4.29376 51.8891     11.1702  50.4316     10.6585  39.8044    172.159     7.9872      172.159     
1 1 1 29 14 42 o 4  17.7466 5.39248 3.03523     8.74747  -0.834265   8.62016  3.97858    100.786     5.75425     280.786     
1 1 1 29 14 43 o 17 60.1045 3.96827 59.2152     11.5814  78.4854     11.8656  38.1309    7.14749     7.96162     187.147     
1 1 1 29 14 44 o 2  38.0087 5.77764 28.4981     10.2666  31.3797     11.0933  32.5885    10.5046     19.0229     10.5046     
1 1 1 29 14 45 o 15 24.3385 6.41404 13.3977     10.5715  8.69013     10.5447  0.39022    94.1627     30.1608     274.163     
1 1 1 29 14 46 o 8  42.2107 6.55446 39.32       11.9302  37.3846     15.032   30.1064    320.185     4.7855      320.185     
1 1 1 29 14 47 o 17 46.3314 6.05876 45.58       12.6484  44.404      14.3803  23.5271    292.624     15.779      112.624     
1 1 1 29 14 48 o 13 25.0248 6.83476 7.18        11.0615  16.452      13.4102  11.2605    317.958     2.14458     137.958     
1 1 1 29 14 49 o 2  75.0178 4.23873 102.51      14.8409  114.246     16.7717  62.5565    90.2304     21.5206     90.2304     
1 1 1 29 14 50 o 15 38.848  6.81307 39.7244     12.4712  26.9346     14.5024  33.0198    170.278     21.9897     170.278     
1 1 1 29 14 51 o 1  36.3952 7.26052 26.4924     13.185   34.0055     14.5156  29.2802    354.414     14.9076     354.414     
1 1 1 29 14 52 o 2  18.3306 5.91462 -5.42847    11.1986  -0.93983    12.8359  4.99606    336.275     6.17163     156.275     
1 1 1 29 14 53 o 15 26.9073 7.2945  13.9076     12.8351  16.564      14.7106  14.2127    330.753     2.82649     150.753     
1 1 1 29 14 54 o 6  28.9091 6.87714 15.6635     12.0371  22.0734     11.8029  16.7089    91.1335     1.07619     271.134     
1 1 1 29 14 55 o 17 39.02   6.86611 31.5611     12.9364  39.0498     13.8653  29.3957    137.539     9.91181     137.539     
1 1 1 29 14 56 f 0  33.0648 8.07618 37.2784     16.0524  18.7944     19.1304  19.0005    241.52      0           0           
1 1 1 29 14 57 f 0  26.2443 6.80824 -22.3825    20.7357  28.4319     13.012   12.017     347.931     0           0           
1 1 1 29 14 58 o 7  27.0608 8.50679 44.7341     30.5964  3.54093     12.8524  11.1768    101.118     1.22292     101.118     
1 1 1 29 14 59 o 19 24.4201 8.06128 27.944      32.3514  1.27028     12.903   7.59465    241.29      4.3167      61.2896     
1 1 1 29 14 60 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 15 0  o 7  14.8276 6.27458 4.39635     8.30153  4.39635     8.30153  9.46989    180         33.5327     180         
1 1 1 29 15 1  o 12 54.0784 3.98956 52.8033     9.93201  54.6594     11.3406  50.0976    229.786     25.8524     229.786     
1 1 1 29 15 2  o 11 75.2264 3.28144 110.888     11.481   94.3231     12.9006  63.4593    64.3925     16.8051     64.3925     
1 1 1 29 15 3  o 16 90.4002 3.07677 151.604     13.0223  143.319     14.6619  82.6554    15.247      31.9343     15.247      
1 1 1 29 15 4  o 11 69.7333 3.36775 74.9773     11.3831  102.48      11.8498  53.1309    357.188     4.32142     357.188     
1 1 1 29 15 5  o 17 91.4944 2.95846 143.528     12.6827  158.353     14.3803  66.709     31.6932     2.4745      211.693     
1 1 1 29 15 6  o 2  46.7252 4.11413 41.3258     9.18254  39.4128     9.64071  23.2863    64.459      19.9927     244.459     
1 1 1 29 15 7  o 11 45.856  4.15829 32.978      8.99621  45.3884     9.53956  37.0054    339.182     11.9034     339.182     
1 1 1 29 15 8  o 16 97.6765 2.79085 181.708     13.2703  161.826     13.912   82.6746    295.631     20.4921     295.631     
1 1 1 29 15 9  o 17 24.2973 5.68931 7.23055     7.97669  13.9473     8.46271  7.50169    115.796     5.56795     295.796     
1 1 1 29 15 10 o 11 56.3009 3.65055 57.6678     9.69015  58.2506     10.6575  52.0344    293.699     25.5839     293.699     
1 1 1 29 15 11 o 6  49.4751 4.11913 50.1442     9.24843  40.6121     10.4561  39.6277    222.112     10.5684     222.112     
1 1 1 29 15 12 f 0  18.8126 5.44069 1.79628     7.90687  4.08069     8.40621  23.3118    344.132     0           0           
1 1 1 29 15 13 o 10 30.7028 5.91421 19.4455     9.47036  17.3672     9.23192  5.94937    68.7526     29.0981     248.753     
1 1 1 29 15 14 o 18 69.4127 3.48372 93.3969     11.6479  82.2752     12.3293  45.7081    318.875     10.1822     138.875     
1 1 1 29 15 15 o 7  46.67   4.39644 36.9856     10.3469  44.4578     9.49258  9.89682    147.31      47.5496     327.31      
1 1 1 29 15 16 o 16 21.0966 5.73952 2.57695     8.71915  8.92967     8.72624  2.16819    28.8436     16.8707     208.844     
1 1 1 29 15 17 o 4  26.2449 6.00156 15.7568     9.24631  9.95043     8.96732  3.11598    74.443      27.1801     254.443     
1 1 1 29 15 18 o 10 65.3038 3.47351 83.9232     10.6463  71.897      11.7353  41.6251    187.184     11.8476     7.18359     
1 1 1 29 15 19 o 8  38.6425 5.13146 28.5867     9.59521  28.7243     9.54955  13.651     76.8105     26.5967     256.811     
1 1 1 29 15 20 o 4  33.3228 5.30819 25.0827     8.50205  18.1448     8.87076  11.4825    289.224     22.0568     109.224     
1 1 1 29 15 21 o 3  38.3177 4.92768 25.0299     8.95176  31.2686     9.25404  10.8401    76.9775     31.9854     256.977     
1 1 1 29 15 22 o 16 37.1932 5.021   27.8454     8.82998  25.3061     9.18925  17.9001    67.5235     15.0259     247.524     
1 1 1 29 15 23 o 10 111.136 3.14927 228.675     16.7383  219.158     18.1967  96.3907    353.139     29.142      353.139     
1 1 1 29 15 24 o 4  95.7085 2.96796 167.047     14.1498  164.477     14.25    90.0204    187.519     40.2512     187.519     
1 1 1 29 15 25 o 13 16.1366 5.00894 -0.433366   7.73065  -1.94479    7.86149  0.437934   78.1254     9.82686     78.1254     
1 1 1 29 15 26 o 19 68.9861 3.35296 92.2744     11.2357  81.6584     11.7294  50.4604    223.66      1.14607     223.66      
1 1 1 29 15 27 o 13 42.9671 4.58279 34.0598     9.76947  35.9057     9.3262   31.2903    277.262     3.77772     277.262     
1 1 1 29 15 28 o 4  22.0091 5.48708 15.7673     9.0686   -2.61972    8.07041  7.26066    274.325     2.29585     94.3246     
1 1 1 29 15 29 o 7  38.9382 5.1161  35.871      9.47885  23.3865     9.61012  25.8317    174.524     1.21313     354.524     
1 1 1 29 15 30 o 17 29.2969 5.61169 24.0363     8.80465  9.60007     9.10285  19.1522    359.766     4.15278     359.766     
1 1 1 29 15 31 f 0  64.0994 3.65443 68.0492     11.4919  84.1489     11.6934  38.8649    196.884     0           0           
1 1 1 29 15 32 o 2  33.1294 5.59728 21.8106     9.18375  22.0648     9.14758  23.9167    135.322     5.32166     135.322     
1 1 1 29 15 33 o 4  35.7325 5.48498 26.2041     9.40085  24.6724     9.67953  23.975     30.5277     0.0616318   30.5268     
1 1 1 29 15 34 o 19 68.2403 3.4876  88.2278     12.0472  83.9269     11.6468  51.3704    182.531     4.75334     182.531     
1 1 1 29 15 35 o 5  17.6378 5.30413 -1.04787    8.35764  3.45775     8.20957  4.05776    182.999     5.96886     2.99864     
1 1 1 29 15 36 o 7  34.9316 5.42659 31.1499     9.33671  18.4595     9.30596  20.2838    15.3697     6.66019     195.37      
1 1 1 29 15 37 o 17 18.881  5.51238 0.1276      8.59271  6.08771     8.61391  1.94709    31.5491     18.1038     211.549     
1 1 1 29 15 38 o 3  39.1941 5.17677 23.5065     9.66161  38.5425     9.78119  32.4827    241.082     13.1845     241.082     
1 1 1 29 15 39 o 13 39.6792 5.14914 32.6048     9.77644  30.3944     9.93776  32.2155    30.2414     11.8011     30.2414     
1 1 1 29 15 40 o 1  45.0071 5.0404  39.8052     10.7435  40.7294     11.235   34.4852    226.525     7.49879     226.525     
1 1 1 29 15 41 o 9  41.522  5.38049 30.1728     11.0375  39.9491     10.3719  35.7924    337.452     17.2473     337.452     
1 1 1 29 15 42 o 1  35.5798 6.08643 22.8451     10.9678  30.8996     10.6516  24.4871    147.389     2.93019     147.389     
1 1 1 29 15 43 o 9  23.1137 6.22391 5.66715     10.5186  12.6054     9.9066   7.5563     327.05      11.4417     147.05      
1 1 1 29 15 44 o 1  29.0682 6.56514 19.2764     11.0262  17.3264     10.5681  15.2416    317.002     4.77505     137.002     
1 1 1 29 15 45 o 3  35.2492 6.28387 35.3023     11.8877  19.0881     10.8193  26.8713    215.373     13.1296     215.373     
1 1 1 29 15 46 o 2  41.8511 6.5541  42.1794     13.38    34.0847     13.4336  26.721     118.24      2.16839     298.24      
1 1 1 29 15 47 o 15 73.8062 4.16915 109.639     14.9138  99.8176     15.5855  56.5405    119.931     10.0736     119.931     
1 1 1 29 15 48 o 18 52.3129 5.37463 57.4292     12.9497  53.5611     14.2639  45.271     270.213     20.0013     270.213     
1 1 1 29 15 49 o 15 26.6335 6.64589 21.8813     11.3971  4.72816     12.8191  15.1742    110.488     7.80794     110.488     
1 1 1 29 15 50 o 15 25.6466 6.81722 17.2125     11.501   7.86454     13.1711  14.7583    139.392     1.67731     139.392     
1 1 1 29 15 51 o 5  26.7966 6.905   0.227418    12.3082  27.7718     14.3892  13.1035    250.512     7.31092     250.512     
1 1 1 29 15 52 o 4  19.6824 6.03423 -8.12341    12.2389  8.66218     11.231   4.83791    164.27      11.6946     344.27      
1 1 1 29 15 53 o 14 21.1313 6.39136 5.43691     12.6286  5.22175     11.4248  7.64881    170.035     0.980636    350.035     
1 1 1 29 15 54 o 13 46.6738 6.83315 34.8167     17.2931  68.3649     13.8757  35.4047    305.262     10.0303     305.262     
1 1 1 29 15 55 o 17 33.766  7.46992 15.7893     20.7079  39.3481     13.3297  21.6883    100.15      3.72409     100.15      
1 1 1 29 15 56 o 2  32.9115 9.50788 64.6206     32.2431  18.7248     16.5851  18.1369    128.475     8.31205     128.475     
1 1 1 29 15 57 o 15 25.1309 8.06131 23.4751     32.858   8.4889      12.0425  4.36937    90.9209     0.451593    90.9209     
1 1 1 29 15 58 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 16 0  o 1  54.5091 3.83853 54.9269     10.2292  54.9269     10.2292  47.0769    180         41.5939     180         
1 1 1 29 16 1  o 19 119.739 2.74201 261.939     17.1174  254.26      15.7342  102.202    13.7487     24.86       13.7487     
1 1 1 29 16 2  o 4  78.6129 3.07782 99.6403     12.025   124.808     12.0035  73.355     210.666     31.2128     210.666     
1 1 1 29 16 3  o 5  119.697 2.8671  258.492     17.1958  258.095     17.1512  91.0641    172.502     2.43614     172.502     
1 1 1 29 16 4  o 12 69.627  3.3836  85.4113     11.4027  91.1241     12.0693  54.8208    197.697     7.40003     197.697     
1 1 1 29 16 5  o 15 26.3705 5.76518 13.1813     8.46528  13.3281     8.31546  1.18357    37.5408     37.4351     37.5409     
1 1 1 29 16 6  o 8  53.4959 3.86524 51.5493     9.65147  53.9071     10.7683  31.0711    230.602     15.5206     50.6016     
1 1 1 29 16 7  o 15 75.2204 3.15611 101.714     11.3567  103.516     12.3172  53.7902    8.32365     3.66599     188.324     
1 1 1 29 16 8  o 10 62.0457 3.39777 68.0498     10.5831  72.3871     10.3642  42.4187    199.349     5.915       19.3491     
1 1 1 29 16 9  o 12 55.4564 3.68601 55.66       9.8864   57.2687     10.3606  44.2062    210.066     8.87195     210.066     
1 1 1 29 16 10 o 19 33.0748 5.41092 17.6336     8.47473  25.1852     9.18856  20.2064    83.8102     1.54444     263.81      
1 1 1 29 16 11 o 16 41.7483 4.65581 33.7126     9.03144  32.1854     9.76558  23.1802    59.7537     12.2663     239.754     
1 1 1 29 16 12 o 4  75.2112 3.15573 104.781     11.5092  100.586     12.1445  49.3867    129.122     12.4343     309.122     
1 1 1 29 16 13 o 12 22.0977 5.77498 10.0491     8.54587  5.06709     8.60497  4.5107     184.807     14.3377     4.80713     
1 1 1 29 16 14 o 8  27.3617 5.90017 18.4606     8.26722  9.06324     10.3715  2.54456    198.396     31.2103     18.3963     
1 1 1 29 16 15 o 14 53.8699 4.24962 64.0219     9.91321  44.7297     11.7511  32.1752    305.34      13.5855     125.34      
1 1 1 29 16 16 o 9  59.083  3.91825 67.2266     10.9185  61.6844     11.9123  43.3607    58.4852     1.20585     58.4851     
1 1 1 29 16 17 o 11 26.5266 5.98365 14.2096     8.80261  12.6133     9.16821  0.830849   321.286     33.4964     141.286     
1 1 1 29 16 18 o 3  22.0156 5.79116 11.1738     8.62535  2.68352     9.12416  3.41421    112.987     18.138      292.987     
1 1 1 29 16 19 o 14 59.5563 3.80233 67.2716     11.4476  63.5257     11.0064  50.4791    126.79      15.5387     126.79      
1 1 1 29 16 20 o 12 41.2021 4.95061 23.7243     9.84408  42.3897     9.3231   30.5411    293.799     5.07215     293.799     
1 1 1 29 16 21 o 9  35.9831 5.26239 32.1768     9.52206  18.8782     8.90146  7.98072    232.317     34.5784     52.3167     
1 1 1 29 16 22 o 1  30.9716 5.79327 24.9812     9.44639  13.0798     9.35473  1.90485    306.5       39.0365     126.5       
1 1 1 29 16 23 o 11 58.835  3.99076 72.5153     11.9391  56.4658     11.229   43.4359    123.105     1.98092     123.105     
1 1 1 29 16 24 o 8  33.4403 5.5799  17.8477     8.88437  26.6802     9.63816  23.2827    100.282     14.8368     100.282     
1 1 1 29 16 25 o 14 36.5007 5.19862 29.9036     9.05832  22.2913     9.28271  28.7519    318.686     9.96592     318.686     
1 1 1 29 16 26 o 17 46.6445 4.55341 53.1788     9.75919  30.7953     10.1272  46.2322    228.457     30.5929     228.457     
1 1 1 29 16 27 o 13 41.5629 4.95483 31.022      9.37406  35.9129     10.5451  30.1347    47.2661     2.54688     47.2661     
1 1 1 29 16 28 o 3  35.1826 5.62152 23.3896     9.75725  26.123      9.60744  27.2236    245.927     19.8225     245.927     
1 1 1 29 16 29 o 1  27.2592 6.30605 12.3183     9.60837  17.1467     10.3265  15.5636    39.4946     2.40262     219.495     
1 1 1 29 16 30 o 1  25.0959 5.97724 11.6646     8.72845  12.6475     9.06909  14.4781    293.621     1.7344      293.621     
1 1 1 29 16 31 o 16 29.3232 5.86391 23.3929     9.08277  11.0996     9.84666  20.9736    246.779     7.3133      246.779     
1 1 1 29 16 32 o 4  16.2333 4.99353 4.80844     8.15806  -10.9859    8.4109   5.05811    261.966     29.6002     261.966     
1 1 1 29 16 33 o 8  22.6902 5.44751 17.6585     8.68393  -3.796      9.11671  9.96946    14.7477     6.88072     194.748     
1 1 1 29 16 34 o 15 43.0294 4.93587 41.5378     10.1157  31.63       10.275   33.8302    320.203     8.25968     320.203     
1 1 1 29 16 35 o 19 39.8149 5.54504 32.7256     11.3255  31.6904     10.001   27.4934    240.999     0.369971    240.999     
1 1 1 29 16 36 o 11 38.1979 5.60701 30.4838     10.4893  29.3324     10.2746  22.2028    294.101     8.09028     114.101     
1 1 1 29 16 37 o 5  31.4689 6.12869 17.97       10.4523  23.9722     9.72697  21.9224    175.758     4.29574     175.758     
1 1 1 29 16 38 o 14 43.1689 5.67786 40.041      11.9896  36.6097     11.6726  32.0805    337.767     5.15451     337.767     
1 1 1 29 16 39 o 4  34.8513 6.52991 23.4596     12.0499  29.3401     11.2966  28.1433    123.62      15.6404     123.62      
1 1 1 29 16 40 o 6  23.7302 6.26069 3.8255      10.5577  15.6655     10.4142  10.1443    155.114     2.10264     155.114     
1 1 1 29 16 41 o 12 27.6105 6.47777 21.3241     10.9321  10.8239     10.5998  1.04155    142.129     34.4592     322.129     
1 1 1 29 16 42 o 6  20.9353 6.02793 10.9843     10.6375  -0.579626   9.96949  4.86092    204.754     12.6105     24.7536     
1 1 1 29 16 43 o 12 19.4311 5.86346 7.23787     10.5942  -2.84149    10.0637  4.67593    119.297     4.37686     299.297     
1 1 1 29 16 44 o 1  22.1497 6.24862 2.62488     10.7903  11.7747     10.6822  8.96932    121.544     2.47246     301.544     
1 1 1 29 16 45 f 0  71.4085 4.07975 105.042     14.5643  90.7734     14.3323  43.2988    251.144     0           0           
1 1 1 29 16 46 o 11 17.1606 5.55862 -2.68031    11.4446  -4.96404    10.0562  2.46558    244.529     12.5235     64.5292     
1 1 1 29 16 47 o 5  27.5899 7.33745 10.8177     14.8441  20.4641     13.4902  10.9124    247.658     13.1997     67.6575     
1 1 1 29 16 48 o 2  41.6098 7.23711 38.9185     14.2614  40.988      15.7154  32.9091    290.499     11.3233     290.499     
1 1 1 29 16 49 o 1  28.4665 7.62321 27.2856     16.2433  8.87743     14.6949  17.8695    307.161     2.99529     307.161     
1 1 1 29 16 50 o 1  24.2299 6.66424 4.11686     13.0794  16.7764     11.5099  11.9521    96.5329     3.2864      276.533     
1 1 1 29 16 51 o 10 35.2569 7.64965 36.2316     17.0283  27.1379     12.6268  24.7434    311.551     5.9494      311.551     
1 1 1 29 16 52 o 17 24.2773 7.07114 10.3193     16.3512  12.7388     11.9452  2.27442    77.5072     0.867541    77.5072     
1 1 1 29 16 53 o 10 26.7877 7.02745 4.29072     16.8063  24.6373     12.23    12.4334    278.127     4.79047     98.1267     
1 1 1 29 16 54 o 1  36.5965 8.09656 48.7709     19.7009  27.9502     13.3352  25.856     349.598     14.277      349.598     
1 1 1 29 16 55 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 16 56 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 17 0  o 14 60.6864 3.43729 67.336      10.2946  67.336      10.2946  60.1655    180         28.1454     180         
1 1 1 29 17 1  o 3  29.9467 5.52881 20.0861     8.37773  15.0777     8.50256  4.91578    251.47      31.2645     71.47       
1 1 1 29 17 2  o 7  66.0388 3.24776 79.6481     10.7034  79.2437     10.6595  56.6336    353.565     16.472      353.565     
1 1 1 29 17 3  o 2  25.4977 5.59107 17.1923     8.28891  7.00148     8.21628  10.5548    346.86      8.08734     166.86      
1 1 1 29 17 4  o 16 16.7238 4.82948 -12.3402    7.72964  7.68735     7.4598   4.18041    200.827     25.4575     200.827     
1 1 1 29 17 5  o 16 51.1615 4.07065 46.6432     10.3656  50.6623     10.1119  48.9504    159.954     26.9771     159.954     
1 1 1 29 17 6  o 8  42.4191 4.67006 33.4676     9.65184  34.7619     9.55195  26.5451    101.717     6.81799     281.717     
1 1 1 29 17 7  o 1  34.9635 5.57104 22.5862     10.0715  25.3319     8.99713  21.6847    332.622     3.28035     152.622     
1 1 1 29 17 8  o 5  97.8703 2.94354 178.6       14.414   168.189     14.3847  91.1515    64.1414     36.3651     64.1414     
1 1 1 29 17 9  o 1  29.6146 5.83142 16.4973     8.98883  18.0704     8.97023  16.2025    31.5016     4.28642     211.502     
1 1 1 29 17 10 o 5  93.5556 2.91206 156.556     13.3502  160.267     13.8884  88.6566    284.799     38.2383     284.799     
1 1 1 29 17 11 o 15 98.6418 2.87007 178.416     14.0504  173.588     14.2585  79.2175    251.361     11.0264     251.361     
1 1 1 29 17 12 o 6  69.9868 3.25643 88.0541     11.1001  90.5792     11.6152  46.8289    253.357     9.89202     73.3574     
1 1 1 29 17 13 o 11 46.1029 4.43418 33.4738     10.0161  47.1042     9.54686  39.3287    5.48729     14.7176     5.48729     
1 1 1 29 17 14 o 17 51.4581 4.10129 38.4696     10.0315  61.4985     10.2459  42.1661    114.954     10.9074     114.954     
1 1 1 29 17 15 o 19 71.2239 3.45158 99.8538     12.1757  86.1758     12.2513  45.9957    235.608     13.4012     55.6078     
1 1 1 29 17 16 o 9  44.4432 4.56963 27.2148     9.50686  49.116      9.55021  25.5891    334.214     12.4124     154.214     
1 1 1 29 17 17 o 12 42.0937 5.25276 34.8768     10.2191  33.8372     11.1036  22.5706    34.6947     14.7634     214.695     
1 1 1 29 17 18 o 3  20.0725 5.68595 5.48168     8.21773  3.71413     9.22219  4.30148    11.4623     2.0233      191.462     
1 1 1 29 17 19 o 2  29.3199 6.17907 15.2575     8.66873  19.2104     10.8608  18.5864    70.4111     8.72564     70.4111     
1 1 1 29 17 20 o 19 21.9422 5.7363  13.5383     8.31356  -7.06553    11.8021  5.48993    113.135     15.3951     293.136     
1 1 1 29 17 21 o 6  70.6593 3.61925 84.8077     11.7577  99.7351     13.7202  64.0912    182.738     24.8452     182.738     
1 1 1 29 17 22 o 4  38.8907 5.72636 44.43       10.3191  17.26       11.6387  14.9833    219.513     25.5021     39.5134     
1 1 1 29 17 23 o 19 16.3577 5.30391 -5.74083    9.64485  -4.63515    10.0542  5.65136    101.8       31.0476     101.8       
1 1 1 29 17 24 o 15 44.235  5.19941 33.9        10.5435  42.9373     11.6984  26.3788    60.6759     10.5135     240.676     
1 1 1 29 17 25 o 1  53.1691 4.34848 54.3348     11.0884  52.9771     11.6362  20.8063    77.0144     36.0435     257.014     
1 1 1 29 17 26 o 6  40.8755 5.11248 34.9096     10.5558  30.8816     9.63112  25.5635    352.636     6.63189     172.636     
1 1 1 29 17 27 o 2  78.6723 3.37355 111.177     13.5467  117.501     12.8896  66.9345    223.897     18.6178     223.897     
1 1 1 29 17 28 o 1  20.1395 5.88882 3.17452     9.47836  5.12086     9.89118  6.44891    337.31      0.04067     157.31      
1 1 1 29 17 29 o 13 26.0201 6.14604 15.3225     9.8106   11.8514     9.04444  12.6167    190.408     8.02877     10.4078     
1 1 1 29 17 30 o 13 18.6984 5.50243 5.82441     8.52896  -0.493589   8.87084  3.36814    44.0248     14.708      224.025     
1 1 1 29 17 31 o 11 56.3025 4.15555 68.7159     11.1376  52.6806     11.6513  47.5538    36.2865     14.6132     36.2865     
1 1 1 29 17 32 o 14 52.5144 4.15072 56.5406     10.7564  49.1727     10.6689  39.0887    287.656     3.2126      287.656     
1 1 1 29 17 33 o 4  26.5804 5.9357  20.0493     9.29171  8.58708     9.26688  13.3179    39.736      7.48499     39.736      
1 1 1 29 17 34 o 6  55.0696 4.51211 60.7777     12.0963  57.2286     12.3233  31.6685    90.8529     15.6716     270.853     
1 1 1 29 17 35 o 9  35.8256 6.46121 31.2476     12.4725  24.5759     10.8326  29.906     238.308     20.0548     238.308     
1 1 1 29 17 36 o 16 44.6655 5.87735 50.4982     11.8481  33.1368     13.1192  20.7448    183.013     21.4006     3.01319     
1 1 1 29 17 37 o 14 43.2167 5.68674 45.0588     11.9055  32.7039     11.7345  29.3655    359.899     0.780874    179.899     
1 1 1 29 17 38 f 0  25.9508 6.56014 15.1563     10.6929  12.5628     10.9623  3.02686    42.158      0           0           
1 1 1 29 17 39 o 9  41.0417 6.02093 39.6697     11.6885  31.9321     12.2589  33.075     305.5       12.3153     305.5       
1 1 1 29 17 40 o 3  52.3059 5.12536 49.0719     12.785   61.4804     13.249   40.4152    26.0084     8.2499      26.0084     
1 1 1 29 17 41 o 6  44.2011 6.05308 55.7327     13.0967  28.7861     12.6463  29.9572    348.655     0.580115    168.655     
1 1 1 29 17 42 o 1  69.4795 4.4051  102.314     15.0601  85.7735     15.1569  66.5669    156.19      35.5859     156.19      
1 1 1 29 17 43 o 5  20.4403 6.15177 3.45046     11.5314  4.29192     10.5751  6.60405    192.585     0.615417    192.585     
1 1 1 29 17 44 o 4  55.2512 5.62007 75.8604     15.2159  51.1115     14.5595  48.4999    46.6452     20.6049     46.6452     
1 1 1 29 17 45 o 14 42.3668 6.76289 46.6877     14.3961  33.9918     13.7593  26.5178    4.11038     4.73608     184.11      
1 1 1 29 17 46 o 3  40.431  7.45761 47.4945     16.8386  31.1074     13.8843  26.4613    303.847     1.31905     123.847     
1 1 1 29 17 47 o 2  45.2911 6.79616 46.2433     17.1476  47.0071     12.6425  37.4447    105.332     14.3977     105.332     
1 1 1 29 17 48 o 12 14.0364 4.84923 -23.5103    14.2523  -9.01501    8.35321  0.477664   229.006     11.8085     229.006     
1 1 1 29 17 49 o 10 28.2452 6.81583 -0.450415   16.2375  30.4202     12.5593  14.0903    105.624     6.27866     285.624     
1 1 1 29 17 50 o 19 26.4458 7.27744 13.2869     16.3736  19.0479     12.3919  13.4966    174.768     1.02255     354.768     
1 1 1 29 17 51 o 12 34.8931 8.27818 32.2845     17.7674  37.7776     16.6778  20.1852    65.6299     2.80746     245.63      
1 1 1 29 17 52 o 6  21.2443 6.75595 -8.41244    16.8173  11.4747     14.9211  3.75387    314.776     1.7258      134.776     
1 1 1 29 17 53 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 17 54 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 18 0  f 0  17.7349 6.91917 8.38462     8.94209  8.38462     8.94209  9.0923     180         0           0           
1 1 1 29 18 1  o 14 74.7855 3.11739 101.317     11.6835  102.411     11.5784  77.1752    165.573     44.2265     165.573     
1 1 1 29 18 2  o 17 62.1039 3.45566 71.5698     10.6179  70.038      10.7162  49.7667    296.581     7.95486     296.581     
1 1 1 29 18 3  o 14 16.4925 5.07137 2.30482     7.97635  -4.26356    7.96982  0.591237   157.012     2.26706     337.012     
1 1 1 29 18 4  o 1  47.8336 4.16173 44.4183     9.66729  41.3532     9.842    42.5717    279.938     17.4786     279.938     
1 1 1 29 18 5  o 14 27.9549 5.94548 14.8641     9.00114  15.9634     9.01465  12.5912    65.8765     11.1862     245.876     
1 1 1 29 18 6  o 14 20.6314 5.70833 6.75778     8.62692  4.61264     8.54466  5.03295    234.061     1.71731     54.0605     
1 1 1 29 18 7  o 3  15.6177 4.93934 -3.20279    7.86298  -1.70723    8.0036   4.11535    344.014     24.6203     344.014     
1 1 1 29 18 8  o 14 34.5205 5.28177 24.1519     8.89291  22.6363     8.8517   23.6238    332.529     0.591019    332.528     
1 1 1 29 18 9  o 5  20.6562 5.60982 5.21903     8.20568  7.10961     8.14689  2.7351     106.387     0.205266    286.387     
1 1 1 29 18 10 o 2  39.8203 4.95867 33.5131     9.59717  27.8879     9.4419   35.5297    272.311     17.9236     272.311     
1 1 1 29 18 11 f 0  21.8239 5.75365 9.25644     8.71792  6.06487     8.20719  10.2666    157.938     0           0           
1 1 1 29 18 12 o 16 47.1939 4.42071 38.8269     10.2     45.6409     10.1173  47.6776    191.228     39.2389     191.228     
1 1 1 29 18 13 o 5  34.4535 5.61094 15.9162     10.0021  31.8088     9.44522  21.2168    79.5486     5.11034     259.549     
1 1 1 29 18 14 o 4  128.756 3.05541 288.486     18.2205  315.674     21.1419  115.666    51.9608     37.6686     51.9608     
1 1 1 29 18 15 o 2  55.2968 3.96538 54.5701     10.8315  59.8203     10.8185  36.7547    107.803     7.83295     287.803     
1 1 1 29 18 16 o 9  31.5648 5.78699 14.2133     9.64188  26.0283     9.35666  20.7417    159.39      14.3741     159.39      
1 1 1 29 18 17 o 14 82.9908 3.23831 135.489     13.5084  117.455     13.2831  73.9282    271.542     24.4475     271.542     
1 1 1 29 18 18 o 1  25.8883 5.78265 19.3991     8.85527  5.42095     9.37814  9.27805    213.519     15.947      33.5193     
1 1 1 29 18 19 o 19 55.2701 3.84924 58.1961     10.4909  56.1505     10.5511  37.1203    183.632     6.87408     3.6318      
1 1 1 29 18 20 o 4  16.352  5.09332 -3.40545    8.10157  1.07029     8.25168  2.83944    164.647     5.41659     344.647     
1 1 1 29 18 21 o 2  42.0295 4.80226 31.8319     9.88617  37.0655     9.58222  38.1517    33.171      18.2127     33.171      
1 1 1 29 18 22 o 15 21.1    5.69941 5.25865     8.47631  8.69309     8.41685  8.75666    307.696     0.683555    307.696     
1 1 1 29 18 23 o 17 67.2163 3.73465 96.0221     13.3348  73.8045     11.6248  53.5183    350.11      8.18784     350.11      
1 1 1 29 18 24 o 19 49.0409 4.77462 49.6718     11.581   44.1483     11.2471  38.3534    192.598     6.18615     192.598     
1 1 1 29 18 25 o 2  41.7663 5.38002 34.3434     10.8107  35.8257     10.8804  21.8458    241.18      16.2226     61.18       
1 1 1 29 18 26 o 19 27.2769 6.22968 20.153      9.35855  8.89083     11.3766  9.33668    135.736     18.1454     315.736     
1 1 1 29 18 27 o 5  43.7675 5.76973 41.4421     10.2581  37.082      13.7575  37.9555    291.895     15.1562     291.895     
1 1 1 29 18 28 o 15 22.0358 6.50541 4.28406     9.5769   8.0804      14.2104  9.5245     215.308     5.37109     35.308      
1 1 1 29 18 29 o 7  24.2799 6.73525 2.37945     11.6042  16.9219     13.1279  12.4219    280.37      3.27965     100.37      
1 1 1 29 18 30 o 16 23.5167 6.5775  8.14634     11.6469  10.3485     11.3645  11.1104    158.532     4.88362     338.532     
1 1 1 29 18 31 o 17 57.7387 5.53282 73.7762     15.936   62.0829     15.2075  53.6265    199.723     25.3117     199.723     
1 1 1 29 18 32 o 7  66.6189 4.5526  93.1137     14.7318  80.2072     15.1492  60.2642    113.272     24.7488     113.272     
1 1 1 29 18 33 o 7  30.1845 6.72904 28.7664     12.1435  10.2979     12.3584  7.94652    245.152     25.0632     65.1517     
1 1 1 29 18 34 o 7  35.9795 6.83366 21.9027     12.0895  36.6222     13.4895  29.638     343.177     17.5844     343.177     
1 1 1 29 18 35 o 4  28.4759 6.97786 15.3601     11.8084  20.315      12.5545  15.3241    80.5691     4.31661     260.569     
1 1 1 29 18 36 o 18 26.7771 6.20299 1.40805     11.5615  25.1078     10.8434  14.0852    254.532     3.35422     74.5322     
1 1 1 29 18 37 o 13 36.478  6.72689 30.5116     13.2049  28.9506     11.6559  27.8692    153.239     8.8727      153.239     
1 1 1 29 18 38 o 7  50.0255 6.32158 49.9274     16.7674  57.2059     13.2623  39.9791    345.645     10.5111     345.645     
1 1 1 29 18 39 o 19 29.1223 6.84931 18.9783     12.0911  18.6361     11.2948  20.1236    150.644     9.43178     150.644     
1 1 1 29 18 40 o 4  42.5671 6.48328 51.1297     13.9399  29.0978     13.1632  34.0724    285.069     10.2977     285.069     
1 1 1 29 18 41 o 8  36.4032 6.93196 27.2184     13.5406  33.024      12.5135  29.4845    141         11.843      141         
1 1 1 29 18 42 o 15 24.4517 6.96029 20.8795     15.4262  0.134628    11.6094  11.5429    80.1958     6.38324     260.196     
1 1 1 29 18 43 o 1  32.1155 7.60275 23.7163     16.3078  26.117      12.9698  18.16      234.502     13.157      234.502     
1 1 1 29 18 44 o 5  55.1067 6.56677 74.1561     18.9615  61.4432     16.047   50.6839    194.325     25.6534     194.325     
1 1 1 29 18 45 o 4  19.2162 6.1925  -5.7891     14.9828  1.64678     11.8092  6.17763    273.592     2.47222     93.5923     
1 1 1 29 18 46 o 3  22.1625 6.87126 8.98205     16.178   3.48864     12.9021  9.21057    73.7487     2.8131      253.749     
1 1 1 29 18 47 o 5  37.2693 7.84498 48.554      17.6779  26.7588     14.3172  26.043     250.116     4.63188     250.116     
1 1 1 29 18 48 o 17 25.146  7.3728  21.5876     17.4204  8.33487     12.9168  4.8707     166.229     1.80337     166.229     
1 1 1 29 18 49 o 4  22.9955 6.91104 23.4501     16.4328  -5.9443     12.7944  8.05686    340.501     2.99882     160.501     
1 1 1 29 18 50 x 9  ?       ?       ?           ?        ?           ?        6.27101    246.472     0           0           
1 1 1 29 18 51 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 19 0  o 4  121.279 2.72362 264.365     16.5157  264.365     16.5157  93.5503    1.04545e-05 2.03877     1.04545e-05 
1 1 1 29 19 1  o 6  49.7601 4.22421 50.1286     10.3781  43.6251     10.2289  38.1921    226.683     3.39156     226.683     
1 1 1 29 19 2  o 13 46.9054 4.44823 51.3462     9.99318  33.398      9.93815  47.1894    165.19      28.457      165.19      
1 1 1 29 19 3  o 13 69.748  3.30514 90.1964     11.4746  88.7596     11.4965  67.1907    133.608     30.6329     133.608     
1 1 1 29 19 4  o 15 26.2563 5.90874 12.9234     8.83244  14.3319     8.68665  16.9756    212.062     3.38457     212.062     
1 1 1 29 19 5  o 16 18.1436 5.37692 2.64092     8.25774  1.92462     8.19958  4.41009    279.963     9.80421     99.9635     
1 1 1 29 19 6  o 18 20.2889 5.69752 3.46019     8.72265  7.07158     8.68894  5.33724    350.333     13.7277     170.333     
1 1 1 29 19 7  o 11 35.9831 5.33242 30.0763     9.352    21.678      9.28751  19.8194    38.8755     11.7614     218.876     
1 1 1 29 19 8  o 14 40.2817 5.05737 20.7934     9.61307  44.5991     9.55535  20.4614    215.707     17.679      35.7067     
1 1 1 29 19 9  o 13 65.8581 3.41893 86.8467     11.1589  73.713      11.1825  52.8489    79.4895     7.52639     79.4895     
1 1 1 29 19 10 o 10 39.2841 5.06184 24.847      9.5021   36.2801     9.57636  22.3788    62.5318     11.9842     242.532     
1 1 1 29 19 11 o 18 66.662  3.47041 83.9605     11.7199  80.6584     11.3059  65.979     334.2       33.4835     334.2       
1 1 1 29 19 12 o 4  51.274  4.18418 54.1616     10.409   45.7625     10.5958  32.0128    145.503     11.6853     325.503     
1 1 1 29 19 13 o 12 67.67   3.77418 84.3948     12.7079  86.8265     12.6803  54.1591    240.676     7.55344     240.676     
1 1 1 29 19 14 o 3  60.992  3.63467 68.1923     10.987   70.6591     11.0231  45.75      254.812     1.00157     254.812     
1 1 1 29 19 15 o 8  61.924  3.9893  66.4935     12.5887  78.3706     11.7012  54.9228    1.09075     18.5069     1.09075     
1 1 1 29 19 16 f 0  23.0429 5.92444 13.2615     9.32785  5.60346     8.75343  16.9898    253.494     0           0           
1 1 1 29 19 17 o 8  20.3048 5.45864 15.5087     9.91338  -10.556     8.49771  7.25039    34.4683     0.978023    34.4683     
1 1 1 29 19 18 o 4  55.1306 4.29151 52.0382     11.4389  64.6957     11.783   37.1965    39.5359     6.90068     219.536     
1 1 1 29 19 19 o 18 24.4259 5.81518 18.8116     9.35274  2.43335     9.29333  14.806     217.547     1.50749     217.547     
1 1 1 29 19 20 o 11 58.8187 3.97147 66.9401     11.4857  64.37       11.6343  48.9539    16.2858     11.571      16.2858     
1 1 1 29 19 21 o 7  85.3611 3.34998 130.756     13.4376  140.167     15.1033  72.3234    65.871      17.5774     65.871      
1 1 1 29 19 22 o 16 19.1131 5.59428 1.65196     8.64579  5.77364     8.95534  4.73794    252.813     12.5622     72.8131     
1 1 1 29 19 23 o 16 37.4307 5.77932 27.3729     10.9201  30.9926     10.1607  34.8203    168.204     24.1219     168.204     
1 1 1 29 19 24 o 18 28.1512 6.28888 15.5764     10.5059  18.0134     9.47266  7.0051     328.816     24.8138     148.816     
1 1 1 29 19 25 o 17 82.5955 3.66983 137.883     15.3989  119.539     14.8027  68.4451    111.851     14.7159     111.851     
1 1 1 29 19 26 o 15 24.1667 6.14311 -0.655903   10.8188  19.4299     10.5849  10.534     354.214     9.17658     174.214     
1 1 1 29 19 27 o 2  33.3997 6.63264 22.2478     11.9117  26.9712     11.3404  20.2373    74.1591     4.81584     254.159     
1 1 1 29 19 28 o 7  22.7309 6.2161  1.76286     11.1754  13.8511     10.1618  10.6539    174.267     0.466086    174.267     
1 1 1 29 19 29 o 1  31.0766 6.81091 15.6355     11.6762  27.4928     12.2924  21.0163    95.5865     2.75574     95.5865     
1 1 1 29 19 30 o 6  29.0585 7.26444 19.7868     12.528   17.7463     14.0164  5.33952    32.587      3.40988     32.587      
1 1 1 29 19 31 o 18 71.6816 4.62372 111.605     15.1636  90.7394     17.119   65.4598    40.4926     27.2597     40.4926     
1 1 1 29 19 32 o 19 25.5902 6.88468 10.2671     11.816   16.0373     12.7146  12.3535    338.003     4.78327     158.003     
1 1 1 29 19 33 o 19 39.2394 7.01687 29.5447     14.528   40.598      13.4631  29.3516    286.854     6.03644     286.854     
1 1 1 29 19 34 o 4  27.2183 7.07472 24.3614     13.5898  4.6551      13.7418  9.80469    180.259     5.54018     180.259     
1 1 1 29 19 35 f 0  49.5775 6.25396 40.2503     15.4857  65.8504     13.5884  20.3866    351.874     0           0           
1 1 1 29 19 36 o 3  32.2324 7.87596 35.6768     16.903   13.2342     15.6967  24.6332    124.54      11.0113     124.54      
1 1 1 29 19 37 o 7  35.6203 7.89373 -0.811115   24.7754  49.6786     17.138   23.9328    276.993     0.104334    276.993     
1 1 1 29 19 38 o 14 64.9587 5.99881 93.1572     19.121   85.3071     18.9659  49.1259    179.066     5.06129     179.066     
1 1 1 29 19 39 f 0  27.6783 7.65139 7.3122      16.1004  24.4006     15.9804  15.0768    223.701     0           0           
1 1 1 29 19 40 o 19 25.0924 7.48545 10.1067     16.3721  11.9486     15.8811  14.6233    125.253     2.55722     125.253     
1 1 1 29 19 41 o 13 34.1376 8.04521 40.9654     17.3057  19.3992     16.4468  25.5541    148.674     7.78922     148.674     
1 1 1 29 19 42 f 0  27.8476 7.80102 22.7053     16.4119  14.2019     16.2405  18.9943    298.012     0           0           
1 1 1 29 19 43 o 5  45.346  8.25682 53.9585     18.526   54.7394     19.2305  37.5209    108.593     14.6009     108.593     
1 1 1 29 19 44 f 0  24.8661 7.2365  -9.57431    16.9321  26.5622     16.2784  5.55606    194.597     0           0           
1 1 1 29 19 45 o 1  22.8011 7.06014 18.3592     16.4508  -6.43541    15.9592  8.17279    123.421     0.442263    303.421     
1 1 1 29 19 46 o 10 24.1662 7.20742 11.2238     16.8552  13.8175     13.4214  9.96256    273.256     1.96981     93.2562     
1 1 1 29 19 47 o 17 24.697  7.35496 13.9982     18.0021  14.2845     13.4382  9.401      169.294     0.352429    349.294     
1 1 1 29 19 48 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 19 49 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 20 0  o 12 35.7422 6.11426 27.4492     9.4927   27.4492     9.4927   16.1494    180         22.3674     2.22466e-05 
1 1 1 29 20 1  f 0  15.5408 4.9423  0.45752     8.15012  -6.51228    8.25797  15.9356    349.229     0           0           
1 1 1 29 20 2  o 18 59.0852 3.73365 65.4153     10.9558  65.7498     10.9219  45.6471    168.812     3.06257     168.812     
1 1 1 29 20 3  o 1  19.6957 5.5525  1.03444     8.55357  8.26498     8.39906  6.81772    221.008     9.12893     41.0084     
1 1 1 29 20 4  o 1  23.7775 5.7748  16.3187     8.92933  4.23935     8.76866  3.51805    140.504     25.658      320.504     
1 1 1 29 20 5  o 19 35.9153 5.5622  35.5542     10.3747  18.1709     9.37359  20.1746    151.277     11.3019     331.277     
1 1 1 29 20 6  o 6  21.5757 5.78237 10.3347     8.607    4.69816     8.89643  10.9125    300.82      0.689351    120.82      
1 1 1 29 20 7  o 11 39.2117 5.23537 33.1889     10.0104  28.639      9.80398  27.4778    312.092     1.52056     132.092     
1 1 1 29 20 8  o 7  16.8603 5.15283 4.95935     8.51352  -6.5423     8.20527  1.16198    205.357     23.1056     205.357     
1 1 1 29 20 9  o 5  35.9109 5.59269 28.3879     9.93846  24.5973     9.65817  20.8399    127.644     9.81077     307.644     
1 1 1 29 20 10 o 8  18.4739 5.4868  3.78418     8.61013  1.71382     8.61514  5.75893    99.6769     8.19635     279.677     
1 1 1 29 20 11 o 19 19.556  5.56667 -1.88706    8.57588  9.62986     9.04488  7.57966    209.914     0.985345    29.9137     
1 1 1 29 20 12 o 7  22.115  5.73798 13.8801     8.91857  2.02454     8.81634  11.3596    116.352     2.00182     116.352     
1 1 1 29 20 13 o 16 47.6814 5.1381  38.3225     11.5615  52.9675     12.0214  39.853     320.84      10.4798     320.84      
1 1 1 29 20 14 o 11 20.7355 5.89472 1.57916     10.2481  8.98574     9.07967  8.62953    141.101     6.05207     321.101     
1 1 1 29 20 15 o 8  62.7486 3.74262 64.0012     11.5007  85.5342     11.6028  70.5027    246.735     50.1539     246.735     
1 1 1 29 20 16 f 0  28.6905 5.88094 23.6908     9.38661  10.7316     9.41995  15.4098    341.18      0           0           
1 1 1 29 20 17 o 18 24.9473 6.04459 10.0795     9.23739  15.0108     9.17106  14.7522    196.434     5.93706     196.434     
1 1 1 29 20 18 o 9  49.057  4.62938 48.0953     11.1551  46.5813     11.0385  27.3446    151.99      17.5202     331.99      
1 1 1 29 20 19 o 5  15.4613 5.02356 -5.01139    9.04726  -3.48872    8.77105  1.9924     174.396     4.5828      354.396     
1 1 1 29 20 20 o 12 72.6969 3.98096 95.5041     14.8011  106.5       13.8486  49.2523    214.988     9.88079     34.9883     
1 1 1 29 20 21 o 12 42.045  6.464   33.4712     13.2581  43.4048     13.2573  21.2489    265.583     18.1952     85.5825     
1 1 1 29 20 22 o 16 22.2511 6.38149 10.9938     11.3984  3.33992     11.1153  8.45917    96.1155     9.58119     276.116     
1 1 1 29 20 23 o 1  35.5186 7.33054 34.0361     15.3371  24.7787     12.4119  25.0797    294.881     2.1798      294.881     
1 1 1 29 20 24 o 9  50.1563 5.80029 50.6477     14.3947  54.3677     13.6973  29.854     98.8976     13.1886     278.898     
1 1 1 29 20 25 o 7  33.8337 6.84299 19.9762     12.518   31.8713     12.4297  26.9023    350.381     12.0316     350.381     
1 1 1 29 20 26 o 9  35.3312 6.70688 30.8213     12.1365  25.2688     12.2137  23.1196    178.287     1.64185     358.287     
1 1 1 29 20 27 o 17 19.7649 6.04141 6.1805      11.281   -1.61114    10.9215  5.67274    141.062     4.16025     321.062     
1 1 1 29 20 28 o 10 22.3827 6.4156  6.55451     11.1728  9.28611     11.2782  8.00517    12.6741     9.54066     192.674     
1 1 1 29 20 29 o 12 39.7675 6.40731 37.9462     12.5504  31.5435     12.4581  30.7623    250.585     7.15431     250.585     
1 1 1 29 20 30 o 10 34.9984 7.31099 29.3665     13.6549  28.0126     13.7772  24.627     48.4783     2.65597     48.4783     
1 1 1 29 20 31 o 19 24.6955 6.71642 2.82051     13.835   17.223      11.4108  13.8736    260.381     0.0456204   80.3813     
1 1 1 29 20 32 o 10 29.3365 7.25317 31.481      15.3726  7.04216     12.6422  8.43565    305.219     5.94861     305.219     
1 1 1 29 20 33 o 16 49.2193 7.61103 54.2127     21.5131  58.8405     14.9382  34.9582    84.5421     0.153635    264.542     
1 1 1 29 20 34 o 4  75.4976 5.0788  129.273     20.3738  101.898     17.6203  65.8399    257.141     21.7666     257.141     
1 1 1 29 20 35 o 3  20.7983 6.63412 6.29256     15.5763  -6.90898    13.9422  9.25057    110.296     0.558526    290.296     
1 1 1 29 20 36 f 0  25.8158 7.6143  14.1112     17.1428  11.5057     15.6026  12.5264    20.3064     0           0           
1 1 1 29 20 37 o 12 21.3876 6.76059 -11.0857    15.7742  10.4697     15.3232  9.92125    101.489     0.2763      281.489     
1 1 1 29 20 38 o 8  61.1656 7.96051 88.617      24.4392  95.8935     22.3868  52.9583    48.9419     19.1974     48.9419     
1 1 1 29 20 39 o 18 24.0543 7.29869 -19.6864    21.7577  20.6377     15.8842  12.1976    9.62413     2.36669     189.624     
1 1 1 29 20 40 o 16 40.3267 8.46181 45.345      23.4086  46.5754     15.3028  32.3279    344.559     11.953      344.559     
1 1 1 29 20 41 o 4  23.2676 7.21855 -4.60558    22.3709  13.8288     13.6175  4.72155    345.593     19.13       165.593     
1 1 1 29 20 42 o 9  19.9084 6.73647 6.86979     22.7439  -9.35161    12.1314  2.27378    0.214954    0.750469    180.215     
1 1 1 29 20 43 o 6  20.8092 6.65755 3.73147     16.6081  3.82953     13.1927  2.85149    281.905     0.661079    101.905     
1 1 1 29 20 44 o 8  18.951  6.23075 -11.3451    17.519   3.10766     12.5065  1.9929     356.96      2.43234     176.96      
1 1 1 29 20 45 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 20 46 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 21 0  o 14 55.82   4.09892 58.9722     11.1577  58.9722     11.1577  47.4697    9.6317e-06  9.35723     9.6317e-06  
1 1 1 29 21 1  o 18 79.0602 3.30043 110.974     12.8199  122.325     13.2082  75.5804    71.3821     32.0065     71.3821     
1 1 1 29 21 2  o 9  49.5868 4.39992 45.9319     10.6167  49.9723     10.7571  32.6333    293.633     8.42901     113.633     
1 1 1 29 21 3  o 1  43.0088 4.94373 37.6927     10.2369  36.3867     10.3378  34.8571    316         7.42881     316         
1 1 1 29 21 4  o 13 56.4476 4.14935 60.1457     11.1097  62.6638     12.017   52.7648    355.111     22.1038     355.111     
1 1 1 29 21 5  o 6  21.3247 5.94289 8.32021     9.71733  6.2251      8.97373  2.73972    267.287     0.978582    267.287     
1 1 1 29 21 6  o 13 20.0862 5.78779 6.79602     9.03913  3.54008     9.42288  7.84816    116.949     0.304537    296.949     
1 1 1 29 21 7  o 8  66.0848 3.85654 79.3871     12.7787  86.9754     12.4932  68.2782    66.7346     38.503      66.7346     
1 1 1 29 21 8  o 15 46.1813 4.85974 44.1218     11.0604  40.9501     10.7468  32.8096    267.591     2.23349     87.5907     
1 1 1 29 21 9  o 11 41.4209 5.37659 44.1794     10.6576  26.9784     10.6222  33.835     261.309     8.38822     261.309     
1 1 1 29 21 10 o 13 23.7264 6.09918 15.5274     9.61519  5.05343     10.0545  11.3094    302.153     4.67509     302.153     
1 1 1 29 21 11 o 4  38.9334 5.75064 30.7038     10.7768  32.9161     10.9405  37.9314    300.002     26.575      300.002     
1 1 1 29 21 12 o 2  26.6329 6.52588 17.3544     10.4745  12.441      11.0052  16.1692    237.45      1.24364     57.4503     
1 1 1 29 21 13 o 16 21.4398 6.18846 10.4905     11.2097  2.0928      10.0983  9.61319    160.591     3.5905      340.591     
1 1 1 29 21 14 o 17 22.4048 5.67055 17.8763     9.52924  -3.69383    9.37125  6.68828    157.059     15.5147     337.059     
1 1 1 29 21 15 o 17 64.9802 4.34353 85.1509     13.9483  79.2218     13.9837  64.2871    119.954     32.7642     119.954     
1 1 1 29 21 16 o 3  19.1675 5.86739 -1.66791    10.6017  5.02774     10.4149  6.1312     122.339     4.16038     302.339     
1 1 1 29 21 17 f 0  71.8446 4.18031 106.415     14.8021  93.4076     14.9561  34.8444    252.211     0           0           
1 1 1 29 21 18 o 16 43.2558 6.06978 47.7394     12.6831  32.7979     12.6625  19.2536    336.199     24.5719     156.199     
1 1 1 29 21 19 o 6  66.9855 4.48344 80.189      14.8938  96.2123     14.6885  62.203     125.339     25.6548     125.339     
1 1 1 29 21 20 o 9  45.6738 6.31485 40.0053     13.0466  50.745      14.858   22.3916    16.5274     21.7314     196.527     
1 1 1 29 21 21 o 7  49.0105 5.55528 46.9159     13.1729  52.9553     13.149   41.3589    69.3794     12.6065     69.3794     
1 1 1 29 21 22 o 6  40.8681 6.50575 32.7001     13.0506  41.3259     13.021   37.9845    25.2017     23.0688     25.2017     
1 1 1 29 21 23 o 9  24.3008 6.80585 6.76303     14.2649  13.5913     11.1569  12.6045    179.942     0.476351    179.942     
1 1 1 29 21 24 f 0  70.5107 4.52561 101.833     15.5925  94.0197     15.9888  47.225     273.853     0           0           
1 1 1 29 21 25 o 18 35.1556 6.56999 18.1461     12.4948  37.6719     12.227   25.0231    124.155     2.14484     124.155     
1 1 1 29 21 26 o 3  25.5838 7.04495 18.5533     14.6333  8.09927     11.4449  14.2052    355.063     2.73371     175.063     
1 1 1 29 21 27 o 9  36.3663 7.33536 17.3341     18.2993  42.8264     13.6876  23.5017    306.431     3.50138     126.431     
1 1 1 29 21 28 o 8  39.0693 7.76255 32.7241     18.9125  40.7458     13.9492  24.3859    234.115     6.26281     54.115      
1 1 1 29 21 29 o 17 25.3178 7.24704 4.88371     17.3331  15.9641     12.8185  16.0536    218.93      4.08784     218.93      
1 1 1 29 21 30 o 16 23.9187 7.02557 -7.76647    17.5958  17.0303     13.6126  11.0723    210.541     7.88107     30.5412     
1 1 1 29 21 31 o 12 25.3297 7.2727  5.24745     17.3711  16.5019     13.0796  14.6075    144.888     1.62701     324.888     
1 1 1 29 21 32 o 2  34.2617 8.01512 24.6308     18.844   34.8578     14.8234  22.2068    12.2519     2.04143     192.252     
1 1 1 29 21 33 o 18 27.0942 7.31    28.7959     15.9863  3.17605     13.4511  17.6815    318.152     2.61001     318.152     
1 1 1 29 21 34 o 14 37.4855 7.25552 56.4679     17.0353  15.507      14.1037  33.7012    293.797     19.2694     293.797     
1 1 1 29 21 35 o 17 21.2838 6.78809 13.8838     17.7184  -8.2597     12.707   8.8555     220.13      5.34308     40.1301     
1 1 1 29 21 36 o 19 23.0934 7.25368 12.0917     17.368   1.89694     16.3953  8.92198    220.133     2.42073     220.133     
1 1 1 29 21 37 o 6  22.3567 6.97399 10.5765     17.7372  4.88807     12.5793  9.57248    357.965     2.90671     177.965     
1 1 1 29 21 38 o 5  25.3375 7.08988 34.1696     17.1644  -8.44196    13.088   12.6635    241.56      3.26677     241.56      
1 1 1 29 21 39 o 1  32.4408 8.57258 33.6166     19.0558  33.0564     18.4377  22.1923    163.521     9.06044     163.521     
1 1 1 29 21 40 o 4  26.293  7.8504  23.9638     18.4437  13.336      17.2261  12.9001    188.678     0.0662819   8.67759     
1 1 1 29 21 41 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 21 42 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 21 43 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 22 0  o 12 43.4882 5.82389 39.1988     11.3671  39.1988     11.3671  40.2097    180         35.2449     180         
1 1 1 29 22 1  o 3  49.0481 5.77657 54.1528     12.4251  46.6975     14.6003  20.4898    316.767     32.275      136.767     
1 1 1 29 22 2  o 12 82.8832 3.70134 134.828     14.8322  126.309     15.6922  79.1193    137.107     33.0345     137.107     
1 1 1 29 22 3  f 0  60.1572 4.4901  67.7706     13.0983  74.6835     13.5582  47.473     210.133     0           0           
1 1 1 29 22 4  o 13 44.4847 5.60242 33.0463     11.6716  50.2985     12.2237  36.3307    347.76      8.39288     347.76      
1 1 1 29 22 5  o 13 27.9401 6.56112 19.2216     10.646   15.045      10.9545  10.9066    150.069     16.5409     330.069     
1 1 1 29 22 6  o 6  39.4492 6.0987  36.7667     11.6739  30.5414     11.7918  31.2594    308.452     6.85485     308.452     
1 1 1 29 22 7  o 4  35.2332 6.37308 26.3593     11.2486  28.5519     11.3557  29.1292    0.44017     20.4353     0.44017     
1 1 1 29 22 8  f 0  20.8327 5.84603 -5.01234    10.2694  13.5861     10.0022  8.99494    176.273     0           0           
1 1 1 29 22 9  o 8  45.0533 5.841   37.1802     12.0102  49.1777     13.4032  40.7865    99.6208     17.6354     99.6208     
1 1 1 29 22 10 o 4  20.4079 5.81678 15.6557     11.0922  -16.079     11.0177  4.25444    27.1033     16.3211     207.103     
1 1 1 29 22 11 o 14 22.787  6.69099 13.4969     12.6607  -1.4534     13.8101  9.12432    304.701     1.33209     304.701     
1 1 1 29 22 12 o 12 25.5725 6.75063 2.73854     13.9024  20.2051     11.695   11.5203    59.7887     9.51578     239.789     
1 1 1 29 22 13 o 8  41.1663 6.48191 30.6239     13.2876  44.8505     12.9463  36.6978    18.8452     17.0786     18.8452     
1 1 1 29 22 14 o 18 29.2514 7.2622  20.4744     12.4722  18.8325     14.0136  18.7771    304.835     0.920779    304.835     
1 1 1 29 22 15 o 4  27.7761 6.93256 16.7775     12.4151  17.6216     11.6591  17.6151    318.381     1.66836     318.381     
1 1 1 29 22 16 o 12 46.5769 6.08905 45.3925     14.264   47.8416     13.0585  40.7835    191.139     15.0434     191.139     
1 1 1 29 22 17 o 1  26.4456 6.83166 19.576      12.3032  10.1995     11.6947  3.43595    342.356     29.763      162.356     
1 1 1 29 22 18 o 9  31.7923 7.04825 25.7338     12.8419  21.2705     12.1889  20.6004    238.28      1.70198     58.2796     
1 1 1 29 22 19 o 16 29.9692 6.65044 31.7103     12.784   8.2554      11.5844  18.6943    1.20759     2.76158     181.208     
1 1 1 29 22 20 o 14 19.2304 6.22841 -1.30954    14.4379  -4.29073    12.5356  6.90079    225.168     4.65272     45.1678     
1 1 1 29 22 21 o 11 37.1802 7.16228 21.9991     16.735   41.8262     13.0022  32.1309    239.672     14.108      239.672     
1 1 1 29 22 22 o 6  22.4479 6.93147 9.17751     17.2833  2.00309     11.8293  11.7634    134.467     1.87411     134.467     
1 1 1 29 22 23 o 7  21.012  6.24147 -31.3787    16.8709  14.8781     12.0398  10.623     333.155     0.703819    153.155     
1 1 1 29 22 24 o 12 30.6383 7.55785 10.6042     18.6717  29.8651     13.5467  19.4876    182.263     2.3462      2.26338     
1 1 1 29 22 25 o 12 31.952  7.57637 10.3944     19.2665  34.4293     14.0272  26.3682    295.434     14.12       295.434     
1 1 1 29 22 26 o 15 21.5649 6.82201 11.5675     17.7939  -4.50602    11.8763  10.3432    116.467     3.63365     296.467     
1 1 1 29 22 27 o 9  21.0434 6.64717 -8.86819    18.3426  7.00822     12.2671  6.49958    112.125     13.2779     292.125     
1 1 1 29 22 28 o 10 43.188  7.85606 36.6103     21.5994  58.0447     15.3714  25.5972    89.3355     10.7949     269.336     
1 1 1 29 22 29 o 19 27.2457 7.64117 12.1444     19.3973  20.2784     13.4851  9.63918    331.812     6.23339     331.812     
1 1 1 29 22 30 o 15 18.4999 6.52666 -21.1011    29.5899  -14.0914    11.8901  4.94149    169.024     1.10403     349.024     
1 1 1 29 22 31 o 15 35.6716 8.45347 36.7071     23.1007  36.2443     14.6304  29.1577    315.675     19.5103     315.675     
1 1 1 29 22 32 f 0  43.4266 8.75701 61.8713     25.2249  48.7618     15.7221  17.7238    194.96      0           0           
1 1 1 29 22 33 o 9  26.2953 7.63364 8.11582     22.2661  21.2128     13.7192  14.6149    129.476     4.84998     129.476     
1 1 1 29 22 34 o 18 31.9534 8.76587 47.0368     24.0057  22.0019     15.9473  19.1775    124.248     2.38559     304.248     
1 1 1 29 22 35 o 18 26.3293 7.88808 30.5546     21.6762  9.67642     13.8772  13.8545    275.474     0.372667    95.4737     
1 1 1 29 22 36 f 0  25.3107 7.72983 22.6712     21.9957  12.0443     13.7904  8.2246     136.771     0           0           
1 1 1 29 22 37 o 4  24.1598 7.3303  5.25001     19.8806  17.907      14.2545  9.88008    226.203     1.39201     46.2027     
1 1 1 29 22 38 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 22 39 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 23 0  o 17 18.6898 7.84495 9.79202     12.7798  9.79202     12.7798  1.45205    180         24.1448     8.68349e-06 
1 1 1 29 23 1  o 2  130.523 3.44698 311.632     22.5264  331.496     22.4671  127.225    48.429      54.647      48.429      
1 1 1 29 23 2  o 7  18.381  5.7087  4.56435     10.2788  -3.74631    10.3479  4.77006    51.2526     1.9839      231.253     
1 1 1 29 23 3  o 6  41.5125 6.39478 30.3166     12.2717  46.6228     13.727   41.5529    0.638157    29.1485     0.638157    
1 1 1 29 23 4  o 4  48.3969 6.28314 59.1575     14.663   43.2832     14.5517  39.5233    203.155     8.10603     203.155     
1 1 1 29 23 5  o 6  33.1128 7.25879 28.1353     13.6574  23.9298     12.9534  22.2001    231.355     1.2653      51.3556     
1 1 1 29 23 6  o 16 69.3602 4.89014 106.046     17.2089  87.85       16.2775  66.2291    63.3997     28.344      63.3997     
1 1 1 29 23 7  o 6  27.6619 7.0601  15.4916     12.8549  18.7099     12.3281  18.1557    219.34      1.44332     219.34      
1 1 1 29 23 8  o 3  20.1459 6.16899 -3.81799    12.0165  7.8826      11.6479  7.96445    297.887     0.858875    117.887     
1 1 1 29 23 9  o 17 19.8223 6.18709 6.61441     12.6085  -5.09516    11.9097  7.95085    223.025     3.51302     43.0252     
1 1 1 29 23 10 o 19 26.3305 7.43216 13.0095     13.5564  15.5509     16.0187  11.0306    148.445     13.4313     328.445     
1 1 1 29 23 11 o 5  56.4132 6.46042 58.8964     18.1064  80.314      16.3585  63.0048    333.075     45.4724     333.075     
1 1 1 29 23 12 o 5  25.9735 7.32673 12.8102     16.3195  14.0569     12.6908  17.0864    303.404     5.52527     303.404     
1 1 1 29 23 13 o 15 83.5537 5.09639 143.096     23.3799  139.716     18.4558  85.0955    186.508     44.2556     186.508     
1 1 1 29 23 14 o 12 33.2171 7.59296 16.5663     17.6916  34.8583     13.9669  21.6506    121.038     3.10158     301.038     
1 1 1 29 23 15 o 15 45.5065 7.30849 63.1297     18.3913  35.5449     14.5332  43.4586    98.1366     22.1853     98.1366     
1 1 1 29 23 16 o 13 44.5392 7.54414 45.9807     18.5059  48.6235     14.8972  29.519     89.6586     6.14252     269.659     
1 1 1 29 23 17 o 9  23.6397 7.12061 18.4162     17.187   -2.03789    12.812   7.84538    190.136     15.8995     10.1359     
1 1 1 29 23 18 o 5  31.2378 7.95327 40.676      19.073   8.67054     14.6323  23.7212    346.519     15.4279     346.519     
1 1 1 29 23 19 o 9  24.8097 7.58256 -2.44517    18.0632  18.2199     17.8397  8.04757    205.342     4.52845     205.342     
1 1 1 29 23 20 o 19 19.9333 6.51542 4.37653     17.6702  -7.22502    12.0212  4.85094    39.1278     1.20771     39.1278     
1 1 1 29 23 21 o 17 27.6131 7.68769 9.37453     19.8731  22.3939     13.97    19.5997    68.1103     6.36111     68.1103     
1 1 1 29 23 22 o 2  30.8819 8.18858 26.778      19.48    23.8701     15.0331  22.0413    103.295     3.60584     103.295     
1 1 1 29 23 23 o 9  18.4852 6.17425 5.08857     16.956   -17.7983    11.9422  4.34361    120.852     13.2794     300.852     
1 1 1 29 23 24 o 18 54.6301 7.45186 88.7573     22.1949  58.2899     17.2761  50.5331    33.3422     21.9079     33.3422     
1 1 1 29 23 25 o 12 18.3702 6.22705 -1.501      18.6709  -13.8659    12.5377  3.23232    225.654     15.2398     45.654      
1 1 1 29 23 26 o 4  22.0246 6.7058  -15.8353    18.3493  15.6128     13.1687  7.53383    33.7454     2.36532     33.7454     
1 1 1 29 23 27 o 11 25.7234 7.45049 3.83909     19.2247  22.194      14.4568  15.3018    328.426     1.78722     328.426     
1 1 1 29 23 28 f 0  37.3917 8.56824 40.5871     21.1635  43.8216     16.6339  23.3871    292.448     0           0           
1 1 1 29 23 29 o 14 19.5732 6.49157 -6.96249    19.443   0.447438    13.3269  5.4724     63.8661     8.78331     243.866     
1 1 1 29 23 30 o 12 26.9406 7.58926 6.09267     20.4219  27.2791     14.716   15.0751    278.507     5.00142     278.507     
1 1 1 29 23 31 o 13 24.1338 7.32057 2.08776     20.3247  18.9053     14.4372  10.8992    104.769     0.206384    104.769     
1 1 1 29 23 32 o 4  30.6425 8.35442 35.4387     20.8426  26.1188     15.5688  19.7589    318.246     6.0803      318.246     
1 1 1 29 23 33 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 23 34 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 23 35 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 24 0  o 13 11.5703 5.7877  -13.5795    13.7497  -13.5795    13.7497  0.803764   180         10.2019     180         
1 1 1 29 24 1  o 11 86.8599 5.80552 147.416     24.8445  173.166     24.903   74.34      228.399     16.0477     228.399     
1 1 1 29 24 2  o 2  64.0311 7.79297 109.604     22.2878  86.6406     25.0555  58.9065    353.454     21.8119     353.454     
1 1 1 29 24 3  o 15 84.9602 4.98237 148.807     21.0203  144.774     21.0209  86.8177    118.152     44.4299     118.152     
1 1 1 29 24 4  o 8  33.3982 8.04713 25.1428     19.1196  31.5559     14.4759  28.6349    228.679     13.9255     228.679     
1 1 1 29 24 5  o 5  37.2249 8.25887 32.1635     21.1567  40.0328     15.1269  29.8895    345.579     7.53518     345.579     
1 1 1 29 24 6  o 11 21.2459 6.67116 -3.85442    16.9644  6.58082     12.4804  10.7667    92.9335     1.72621     92.9335     
1 1 1 29 24 7  o 7  35.2273 8.3087  28.6217     19.8952  36.7864     15.8507  18.6735    30.9372     13.404      210.937     
1 1 1 29 24 8  o 5  28.5873 7.82827 28.5333     18.1882  11.7968     13.9651  16.1227    305.586     6.87094     125.586     
1 1 1 29 24 9  o 13 20.4481 6.69777 4.13387     17.709   -9.51131    14.6354  2.28471    182.414     0.804515    182.414     
1 1 1 29 24 10 o 10 40.5683 8.24701 22.7043     26.8711  61.7598     17.6046  29.4846    165.604     0.407562    165.604     
1 1 1 29 24 11 o 8  46.3093 8.09235 45.2332     22.8837  65.5635     16.5243  37.1589    117.146     6.69708     117.146     
1 1 1 29 24 12 o 3  33.0693 8.55282 38.662      21.0237  23.4222     15.9166  21.541     22.2983     15.8443     22.2983     
1 1 1 29 24 13 o 17 33.2568 8.02278 55.3777     20.8987  4.06389     15.7783  21.8525    326.804     2.7951      146.804     
1 1 1 29 24 14 o 19 55.8266 7.91541 101.967     23.9013  57.1924     19.1221  54.4824    226.678     27.2265     226.678     
1 1 1 29 24 15 o 15 39.9744 8.85043 52.2097     22.5129  40.23       17.0015  38.3778    286.046     25.6884     286.046     
1 1 1 29 24 16 o 15 21.7904 7.03549 -4.90306    18.9841  6.47309     15.9922  11.0576    280.259     1.8791      280.259     
1 1 1 29 24 17 o 1  18.3635 6.49539 -28.4683    31.373   -13.3291    12.0275  5.73637    23.815      8.25177     203.815     
1 1 1 29 24 18 o 6  28.4552 8.1637  23.0371     21.6084  20.5768     15.299   19.4874    226.957     9.89027     226.957     
1 1 1 29 24 19 o 8  18.3942 6.12232 -17.5275    18.3909  0.101028    12.2976  6.09444    226.914     3.60455     46.9141     
1 1 1 29 24 20 o 17 27.4897 7.93073 18.6633     20.5671  20.8281     14.9157  17.5876    136.429     7.8345      136.429     
1 1 1 29 24 21 o 16 17.6459 5.95195 -23.5358    18.2535  -1.56602    12.8787  1.35907    305.04      0.513644    125.04      
1 1 1 29 24 22 o 8  30.467  8.32491 29.5538     20.6032  27.3266     15.953   13.6722    289.316     14.2601     109.316     
1 1 1 29 24 23 o 18 26.585  7.74403 16.1884     19.2989  21.1349     14.9963  15.3737    20.9086     0.618224    200.909     
1 1 1 29 24 24 o 10 25.3423 7.68038 17.3662     19.5432  15.496      15.5004  10.6599    298.542     3.97784     298.542     
1 1 1 29 24 25 o 18 38.5868 8.60561 42.5527     21.6954  51.6106     17.3736  31.7477    301.846     21.8181     301.846     
1 1 1 29 24 26 o 4  20.816  6.79812 2.8875      19.7042  3.43989     13.6772  6.69828    126.07      4.02044     306.07      
1 1 1 29 24 27 o 2  28.4179 8.13797 23.1243     21.1947  27.3981     16.164   13.6646    203.758     6.17947     203.758     
1 1 1 29 24 28 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 24 29 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 24 30 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 24 31 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 25 0  o 18 18.1026 8.89635 -5.43463    28.4872  -5.43463    28.4872  5.92813    180         12.3056     8.76202e-06 
1 1 1 29 25 1  o 15 25.157  8.39236 4.96518     27.7488  7.83604     27.436   13.3293    1.37514     5.54462     1.37514     
1 1 1 29 25 2  o 7  33.7348 10.256  58.9369     31.9548  32.1107     31.89    21.9077    189.492     2.31258     9.49177     
1 1 1 29 25 3  o 1  25.6999 8.545   3.98842     28.3269  13.8385     28.1432  10.5307    7.89296     5.40486     7.89296     
1 1 1 29 25 4  o 7  63.2913 11.4116 144.396     35.1437  137.426     37.8057  63.9813    48.5865     35.5402     48.5865     
1 1 1 29 25 5  f 0  35.5233 10.4974 46.8102     31.3872  59.5758     31.408   36.9144    221.431     0           0           
1 1 1 29 25 6  o 8  32.0397 10.5955 63.1174     41.3225  31.5996     45.6102  22.2893    322.216     3.84353     322.216     
1 1 1 29 25 7  o 14 25.9813 8.59055 25.9576     37.4315  7.43509     17.981   13.7628    140.01      5.48605     320.01      
1 1 1 29 25 8  o 15 21.5569 7.84166 -100.282    94.2946  -9.98463    14.5741  7.13882    132.199     12.0791     312.199     
1 1 1 29 25 9  o 1  26.9599 8.40992 12.0356     38.8201  19.2769     15.0197  16.7493    299.819     0.662402    299.819     
1 1 1 29 25 10 o 1  27.8521 8.10672 18.2455     21.9021  23.8545     16.0799  14.563     320.624     8.06426     140.624     
1 1 1 29 25 11 o 15 21.3043 6.93084 3.46834     20.3356  2.74164     13.7183  5.56447    274.87      1.29901     274.87      
1 1 1 29 25 12 o 12 19.657  6.538   5.30442     19.0135  -7.09511    12.871   4.27189    350.36      15.1911     170.36      
1 1 1 29 25 13 o 19 28.1151 8.05797 15.4799     21.7133  27.9775     16.2415  17.7456    132.883     0.358629    132.883     
1 1 1 29 25 14 o 8  22.65   7.26659 12.4197     21.3163  4.78097     14.0972  9.63762    297.593     1.38517     297.593     
1 1 1 29 25 15 f 0  29.6989 8.475   35.4695     22.6804  23.0801     16.2617  8.86775    58.0709     0           0           
1 1 1 29 25 16 o 11 25.6288 7.81979 25.1108     21.4602  11.8526     14.8646  14.2145    169.437     2.86946     169.437     
1 1 1 29 25 17 o 9  27.2239 7.63353 50.3882     21.2295  -10.9593    13.9407  7.28634    63.4575     4.06839     63.4575     
1 1 1 29 25 18 o 15 21.1394 7.10223 9.32732     21.1443  -12.2422    19.8807  6.87234    301.838     1.55525     121.838     
1 1 1 29 25 19 o 18 32.1766 9.24826 42.5533     23.2254  38.8824     23.5632  22.5269    236.989     8.67209     236.989     
1 1 1 29 25 20 o 2  21.9896 7.3149  9.74017     20.9504  -2.40859    20.5745  3.12198    345.726     0.215181    345.726     
1 1 1 29 25 21 o 13 21.7794 7.25631 -0.899612   20.5581  7.37665     20.5443  7.5404     73.6052     5.12866     253.605     
1 1 1 29 25 22 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 25 23 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 25 24 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 25 25 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 26 0  x 0  ?       ?       ?           ?        ?           ?        7.84088    6.5746e-06  0           0           
1 1 1 29 26 1  o 8  27.1548 9.40181 32.5832     42.1082  29.114      44.0365  14.5413    37.1024     3.4487      37.1024     
1 1 1 29 26 2  o 13 26.89   9.4229  -15.9364    45.5768  65.7601     48.3866  13.9144    310.74      3.24085     310.74      
1 1 1 29 26 3  o 1  26.3277 9.20769 35.1131     45.4722  9.95416     43.9215  12.0866    359.599     3.44854     359.599     
1 1 1 29 26 4  o 17 30.5942 10.4622 54.8363     45.7416  86.5991     51.6624  17.8255    144.488     2.64228     324.488     
1 1 1 29 26 5  o 14 24.028  8.50932 25.3271     43.4189  -39.2822    42.1065  10.4757    40.1691     0.0962208   220.169     
1 1 1 29 26 6  o 14 26.0603 9.10028 27.4763     42.2681  14.1035     44.407   9.8765     227.74      3.20587     227.74      
1 1 1 29 26 7  x 17 ?       ?       ?           ?        ?           ?        3.68342    21.8331     0           0           
1 1 1 29 26 8  o 10 23.5473 8.37785 3.17683     43.5616  -29.2669    46.2141  9.62265    53.3565     0.97668     233.357     
1 1 1 29 26 9  o 10 25.9279 9.07646 35.9996     42.1579  0.214413    47.2537  12.8816    307.637     0.407403    127.637     
1 1 1 29 26 10 o 11 27.8658 9.68402 47.718      45.0584  40.4477     49.4786  14.8884    170.88      2.70978     170.88      
1 1 1 29 26 11 o 1  20.07   7.24151 -72.2626    39.4108  -51.6283    43.3686  2.63782    298.354     1.04848     118.354     
1 1 1 29 26 12 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 26 13 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 26 14 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 26 15 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 26 16 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 26 17 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 29 26 18 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 0  0  o 7  100.234 3.59618 179.478     17.9574  179.478     17.9574  16.667     180         107.757     2.12767e-05 
1 1 1 30 0  1  o 4  121.782 2.49376 263.575     15.1905  263.575     15.1905  120.832    240         81.1847     240         
1 1 1 30 0  2  o 16 17.3534 6.25148 7.84544     6.82924  7.84544     6.82924  25.5061    300         54.803      300         
1 1 1 30 0  3  o 12 44.4529 3.72064 36.4969     7.98345  36.4969     7.98345  0.138848   180         1.14327     180         
1 1 1 30 0  4  o 9  98.035  2.69796 171.164     13.2092  171.164     13.2092  60.768     240         21.1791     60          
1 1 1 30 0  5  o 11 296.505 3.39773 1560.47     50.4573  1560.47     50.4573  240.168    120         41.2864     120         
1 1 1 30 0  6  o 16 163.42  2.58128 474.161     21.116   474.161     21.116   133.934    180         25.9699     180         
1 1 1 30 0  7  o 5  143.738 2.52638 366.949     18.173   366.949     18.173   156.759    240         106.136     240         
1 1 1 30 0  8  o 9  62.783  2.99769 70.8439     9.33143  70.8439     9.33143  9.75831    300         61.8246     120         
1 1 1 30 0  9  o 10 13.012  5.54471 2.93152     6.57259  2.93152     6.57259  27.4891    9.158e-06   57.2234     9.158e-06   
1 1 1 30 0  10 o 3  18.2242 6.4441  8.68231     7.1845   8.68231     7.1845   5.49814    59.9999     11.9634     59.9999     
1 1 1 30 0  11 o 10 105.492 2.67676 198.062     14.1097  198.062     14.1097  95.1456    120         48.7723     120         
1 1 1 30 0  12 o 10 37.6054 4.77225 27.3899     8.13254  27.3899     8.13254  10.4526    180         38.6639     180         
1 1 1 30 0  13 o 5  17.4493 6.43929 7.86822     7.36111  7.86822     7.36111  48.5958    60          104.911     60          
1 1 1 30 0  14 o 2  484.535 4.75589 4171.03     115.433  4171.03     115.433  376.942    120         39.7936     120         
1 1 1 30 0  15 o 7  101.436 2.87489 183.326     14.5607  183.326     14.5607  30.814     360         87.6266     180         
1 1 1 30 0  16 o 17 149.62  2.83508 397.806     21.2232  397.806     21.2232  152.883    60          86.2227     60          
1 1 1 30 0  17 o 1  172.891 2.72027 530.794     23.5429  530.794     23.5429  110.982    300         32.1829     120         
1 1 1 30 0  18 f 0  96.1417 2.60734 164.608     12.5203  164.608     12.5203  130.714    360         0           0           
1 1 1 30 0  19 o 7  37.741  4.79338 27.599      8.19678  27.599      8.19678  8.63543    240         37.8252     240         
1 1 1 30 0  20 o 14 289.222 3.3539  1485.14     48.5823  1485.14     48.5823  214.414    120         4.97887     120         
1 1 1 30 0  21 o 16 26.3037 6.82622 16.4235     8.30995  16.4235     8.30995  29.7319    180         76.4349     180         
1 1 1 30 0  22 o 17 183.551 2.87517 598.408     26.4179  598.408     26.4179  131.261    240         5.8435      60          
1 1 1 30 0  23 o 3  167.326 2.90648 497.495     24.3387  497.495     24.3387  144.285    120         44.2313     120         
1 1 1 30 0  24 f 0  92.1304 2.90047 151.449     13.331   151.449     13.331   25.5657    180         0           0           
1 1 1 30 0  25 o 6  185.222 3.13147 609.716     29.0295  609.716     29.0295  145.166    60          20.576      60          
1 1 1 30 0  26 o 10 150.577 2.83535 403.046     21.3613  403.046     21.3613  83.6308    300         51.7287     120         
1 1 1 30 0  27 o 6  18.6645 7.10708 8.84906     9.20289  8.84906     9.20289  9.05585    180         21.5198     180         
1 1 1 30 0  28 o 16 98.4361 2.86375 172.78      14.0725  172.78      14.0725  25.665     240         91.4025     60          
1 1 1 30 0  29 o 3  69.8138 3.16629 87.5664     10.9719  87.5664     10.9719  35.1276    300         29.7766     120         
1 1 1 30 0  30 o 11 44.953  4.14858 37.6961     8.90592  37.6961     8.90592  11.6012    3.21331e-08 7.79816     180         
1 1 1 30 0  31 o 13 159.766 2.77055 453.747     22.1524  453.747     22.1524  125.553    240         20.5751     240         
1 1 1 30 0  32 o 5  49.0279 3.84185 44.2582     9.14351  44.2582     9.14351  3.72758    300         60.6153     120         
1 1 1 30 0  33 o 10 39.5107 4.89154 30.1954     8.79785  30.1954     8.79785  2.36637    180         41.4332     8.77056e-06 
1 1 1 30 0  34 o 19 35.5093 5.49245 25.414      8.55894  25.414      8.55894  1.70099    240         27.9823     60          
1 1 1 30 0  35 o 5  28.7016 6.66516 18.7672     8.5034   18.7672     8.5034   24.6729    120         83.5617     120         
1 1 1 30 0  36 o 17 181.762 2.69266 587.293     24.5027  587.293     24.5027  194.284    180         128.714     180         
1 1 1 30 0  37 o 8  14.2334 6.01553 3.82889     7.6117   3.82889     7.6117   12.2262    240         27.978      240         
1 1 1 30 0  38 f 0  285.95  3.2505  1454.77     46.5531  1454.77     46.5531  209.183    120         0           0           
1 1 1 30 0  39 o 14 99.7214 2.78593 177.488     13.8731  177.488     13.8731  74.6452    180         7.614       180         
1 1 1 30 0  40 o 16 81.5475 2.98715 119.156     12.1324  119.156     12.1324  72.3654    240         57.971      240         
1 1 1 30 0  41 o 8  126.339 3.07458 284.861     19.414   284.861     19.414   70.8574    300         36.9927     120         
1 1 1 30 0  42 o 8  38.3509 6.51982 30.5022     10.8661  30.5022     10.8661  12.7887    360         13.8373     180         
1 1 1 30 0  43 o 6  38.7758 6.25352 30.7904     10.5888  30.7904     10.5888  4.40401    240         43.7293     60          
1 1 1 30 0  44 o 6  31.0951 7.14819 22.1148     9.8543   22.1148     9.8543   7.12903    120         4.76303     300         
1 1 1 30 0  45 o 6  54.669  4.20904 55.2579     11.1849  55.2579     11.1849  51.718     180         37.1808     180         
1 1 1 30 0  46 f 0  11.674  5.51384 -2.81195    8.8477   -2.81195    8.8477   20.5999    60          0           0           
1 1 1 30 0  47 o 19 77.5625 3.25758 108.374     12.5589  108.374     12.5589  42.2823    300         23.5585     120         
1 1 1 30 0  48 o 6  80.7494 3.2718  117.443     13.1397  117.443     13.1397  76.5049    360         40.7414     360         
1 1 1 30 0  49 o 10 82.8994 3.21012 123.708     13.2442  123.708     13.2442  84.6747    60          54.4051     60          
1 1 1 30 0  50 o 19 14.7308 6.27561 4.10075     8.41539  4.10075     8.41539  0.506633   300         1.84086     300         
1 1 1 30 0  51 o 7  9.85323 4.83996 -7.12739    8.40506  -7.12739    8.40506  2.70305    180         6.53197     180         
1 1 1 30 0  52 o 9  87.1831 3.26547 136.976     14.1752  136.976     14.1752  50.3787    60          19.1255     240         
1 1 1 30 0  53 o 3  101.982 3.07987 186.783     15.6749  186.783     15.6749  76.8788    120         13.9316     120         
1 1 1 30 0  54 o 19 16.4326 6.65926 6.52481     8.6944   6.52481     8.6944   2.24366    8.6116e-06  14.5671     8.61159e-06 
1 1 1 30 0  55 o 11 45.4773 4.82019 39.7238     10.2582  39.7238     10.2582  23.1054    240         15.7571     60          
1 1 1 30 0  56 o 11 77.8638 3.34705 109.769     12.9488  109.769     12.9488  65.5059    120         25.2143     120         
1 1 1 30 0  57 f 0  43.2357 5.19942 36.6347     10.2879  36.6347     10.2879  23.4712    6.90456e-06 0           0           
1 1 1 30 0  58 o 19 111.447 2.96312 223.157     16.496   223.157     16.496   67.4533    60          15.571      240         
1 1 1 30 0  59 o 1  107.91  2.93518 209.398     15.8194  209.398     15.8194  91.1649    120         37.0989     120         
1 1 1 30 0  60 o 6  40.1107 5.75291 32.7669     10.2379  32.7669     10.2379  26.8447    180         0.0736885   8.66352e-06 
1 1 1 30 0  61 o 18 35.3143 7.06258 27.9736     10.8228  27.9736     10.8228  25.3578    240         3.89892     240         
1 1 1 30 0  62 o 14 16.1024 6.76165 5.94622     9.50105  5.94622     9.50105  0.457565   120         1.26958     300         
1 1 1 30 0  63 o 9  60.4863 4.17507 68.4544     12.3597  68.4544     12.3597  15.4028    1.82586e-06 49.5098     180         
1 1 1 30 0  64 o 19 41.5147 6.07076 35.701      11.1481  35.701      11.1481  34.0384    60          13.368      60          
1 1 1 30 0  65 o 12 14.9641 6.86399 1.09349     12.2425  1.09349     12.2425  0.133281   120         4.86904     120         
1 1 1 30 0  66 o 16 48.1568 6.20185 47.3545     13.4981  47.3545     13.4981  16.6649    5.1462e-07  29.9337     180         
1 1 1 30 0  67 o 11 60.6599 4.95971 70.6312     14.5533  70.6312     14.5533  58.9638    240         38.5884     240         
1 1 1 30 0  68 o 7  19.7707 7.92181 11.0149     12.1109  11.0149     12.1109  4.8067     300         5.6458      120         
1 1 1 30 0  69 o 4  46.2569 7.52913 46.5204     15.1936  46.5204     15.1936  34.44      180         8.80468     180         
1 1 1 30 0  70 o 15 29.4203 9.40481 25.3698     14.9145  25.3698     14.9145  15.7045    240         5.94046     60          
1 1 1 30 0  71 o 6  19.8661 8.30932 10.8298     14.2461  10.8298     14.2461  6.00912    120         2.51351     300         
1 1 1 30 0  72 o 9  15.1505 7.07873 -0.0772656  13.9375  -0.0772656  13.9375  1.6152     180         17.464      180         
1 1 1 30 0  73 o 8  16.3419 7.50299 2.8831      14.6753  2.8831      14.6753  0.714573   240         6.87454     60          
1 1 1 30 0  74 o 4  20.2451 8.57118 12.2526     15.505   12.2526     15.505   2.67213    300         14.6046     120         
1 1 1 30 0  75 o 1  25.2632 9.44395 21.7532     15.9911  21.7532     15.9911  8.13921    360         1.08838     180         
1 1 1 30 0  76 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 1  0  o 15 67.2542 2.93612 81.1157     9.80851  81.1157     9.80851  20.978     6.46577e-05 0.892586    180         
1 1 1 30 1  1  o 14 72.1252 2.81318 96.5965     10.1138  88.6537     10.1284  18.5184    199.493     50.3786     19.4932     
1 1 1 30 1  2  o 7  65.9778 2.93282 76.1748     9.68167  78.9429     9.61056  16.6982    292.631     39.179      112.631     
1 1 1 30 1  3  o 2  75.1627 2.86103 96.5177     11.0071  104.637     10.4198  34.4544    0.12855     2.95283     0.12855     
1 1 1 30 1  4  o 6  256.927 3.10891 1177.97     39.1593  1165.4      40.871   172.906    91.3903     29.2435     271.39      
1 1 1 30 1  5  o 4  363.768 3.8827  2365.25     73.957   2337.02     67.4938  253.49     294.974     28.0393     114.974     
1 1 1 30 1  6  o 1  226.068 2.90985 914.016     32.2079  899.888     33.6947  246.535    345.393     174.8       345.393     
1 1 1 30 1  7  o 6  337.652 3.54124 2030.62     59.9389  2018.94     59.9045  263.617    72.5057     32.1043     72.5057     
1 1 1 30 1  8  o 10 73.2227 2.83826 88.9855     10.348   102.093     10.3647  10.2266    303.435     72.7655     123.435     
1 1 1 30 1  9  o 5  137.695 2.56317 347.223     17.6379  326.115     17.6904  97.5316    215.296     3.87734     215.296     
1 1 1 30 1  10 o 19 91.0586 2.64793 156.761     12.0167  138.249     12.0588  33.1663    331.206     54.7005     151.206     
1 1 1 30 1  11 o 5  169.209 2.59663 501.782     22.0194  514.195     22.0158  135.949    84.9115     32.8455     84.9115     
1 1 1 30 1  12 o 10 239.819 2.98383 1013.97     36.6324  1027.71     35.0594  191.775    322.436     36.4225     322.436     
1 1 1 30 1  13 o 6  37.8937 4.56304 27.958      8.3745   24.6022     8.31974  10.559     238.364     41.764      238.364     
1 1 1 30 1  14 o 13 96.479  2.82546 162.428     14.0337  168.559     13.1963  70.2043    223.587     25.7457     223.587     
1 1 1 30 1  15 o 7  45.5287 4.17614 41.9735     8.95192  33.2378     9.45447  1.66726    336.691     34.1099     336.691     
1 1 1 30 1  16 o 15 94.0979 2.8808  156.6       13.9091  158.325     13.1817  47.9965    16.866      28.5814     196.866     
1 1 1 30 1  17 o 13 163.985 2.87348 469.114     22.3643  485.974     24.816   117.597    121.727     2.49485     121.727     
1 1 1 30 1  18 o 6  171.989 2.85881 533.538     25.9023  516.751     23.3479  136.947    316.706     29.9219     316.706     
1 1 1 30 1  19 o 15 109.991 2.69379 212.007     14.7755  217.992     14.8757  59.5057    180.732     32.5259     0.732454    
1 1 1 30 1  20 o 7  99.0599 2.71336 179.164     13.0698  169.8       13.7824  37.5158    87.4059     61.4691     267.406     
1 1 1 30 1  21 o 3  239.046 2.96748 1013.03     36.3368  1016.6      34.7405  201.768    65.0823     58.8822     65.0823     
1 1 1 30 1  22 o 5  222.546 2.88909 886.9       31.389   872.18      33.017   173.934    62.5484     27.2973     62.5484     
1 1 1 30 1  23 o 19 309.536 3.4371  1738.48     49.7027  1668.55     56.5491  252.802    273.494     56.7088     273.494     
1 1 1 30 1  24 o 10 57.8611 3.29664 56.8345     8.99895  63.0315     9.96398  1.60083    307.013     78.3513     307.013     
1 1 1 30 1  25 o 12 212.848 2.8946  801.93      30.8372  807.718     30.9144  168.689    71.1036     31.864      71.1036     
1 1 1 30 1  26 o 4  158.077 2.81939 435.198     22.2727  453.027     22.3732  110.483    61.974      3.52022     241.974     
1 1 1 30 1  27 o 13 351.578 4.09246 2202.11     70.1378  2204.19     74.0209  293.445    22.3042     78.6969     22.3042     
1 1 1 30 1  28 o 3  104.03  2.75254 186.676     13.9077  198.542     14.7451  63.2483    93.5638     16.7537     273.564     
1 1 1 30 1  29 o 15 21.6475 5.53128 4.23803     7.611    9.42134     8.00377  9.2116     117.06      24.6425     117.06      
1 1 1 30 1  30 o 18 81.3674 3.1397  123.517     13.0557  112.874     12.4529  57.4922    325.113     10.0821     325.113     
1 1 1 30 1  31 o 8  108.838 2.92438 209.282     16.362   212.692     15.4595  59.8326    65.0583     31.4252     245.058     
1 1 1 30 1  32 o 19 114.514 2.74099 230.577     15.784   236.321     15.6263  67.418     59.2819     24.469      239.282     
1 1 1 30 1  33 o 5  47.5843 4.18043 35.8567     9.96052  46.6601     9.25129  5.30468    303.327     47.1288     123.327     
1 1 1 30 1  34 o 2  218.96  2.88206 823.03      32.1407  884.142     31.0279  164.154    24.4538     17.0053     24.4538     
1 1 1 30 1  35 o 15 59.3976 3.50679 59.364      10.3182  67.5457     10.3322  20.3191    169.433     35.8663     349.433     
1 1 1 30 1  36 o 17 131.042 2.70106 313.377     17.7353  298.527     17.6958  100.799    274.603     19.6296     274.603     
1 1 1 30 1  37 o 5  119.454 2.7526  250.115     16.0167  258.702     16.8948  67.9241    297.966     30.234      117.966     
1 1 1 30 1  38 o 16 165.367 2.82229 488.386     23.4043  486.279     23.3735  125.946    315.161     20.3176     315.161     
1 1 1 30 1  39 o 2  212.587 3.0276  807.358     32.2236  805.506     32.2861  149.951    79.094      0.398431    79.094      
1 1 1 30 1  40 o 13 109.498 2.83055 213.744     15.4821  214.472     15.5304  74.5567    127.304     0.755533    307.304     
1 1 1 30 1  41 o 10 70.4622 3.48879 102.351     12.9652  77.1657     11.4938  55.4306    226.286     22.8899     226.286     
1 1 1 30 1  42 o 8  32.4383 5.78668 20.7414     8.8602   19.079      9.98546  5.96471    339.205     17.9978     159.205     
1 1 1 30 1  43 o 7  82.9465 3.13518 137.496     14.2265  110.113     11.7797  72.2094    311.38      34.1672     311.38      
1 1 1 30 1  44 o 17 55.7435 3.76629 50.024      10.6202  63.0624     9.92936  38.6872    338.923     5.03471     338.923     
1 1 1 30 1  45 o 16 94.9163 2.87081 165.546     13.9545  157.323     13.2955  81.4824    65.8442     33.7834     65.8442     
1 1 1 30 1  46 o 12 52.0829 3.93789 48.6766     10.4873  50.3298     9.71213  32.1297    169.162     3.21967     349.162     
1 1 1 30 1  47 o 17 68.5447 3.56556 92.5521     12.5844  77.9122     11.7287  66.7505    342.965     47.5042     342.965     
1 1 1 30 1  48 o 18 61.628  3.97644 73.2071     12.1566  65.5582     12.1045  39.3694    193.783     2.9088      13.7832     
1 1 1 30 1  49 o 17 47.3963 4.90349 45.0802     11.4018  39.0641     11.1686  34.6137    10.9674     25.2905     10.9674     
1 1 1 30 1  50 f 0  26.8093 6.59665 16.43       11.5573  8.72694     10.4148  22.0779    126.395     0           0           
1 1 1 30 1  51 o 6  111.834 3.12087 223.45      16.6703  227.698     18.2192  75.0624    208.096     2.34037     28.0955     
1 1 1 30 1  52 o 12 157.083 3.00653 475.285     23.1871  414.414     23.9699  124.024    233.997     33.3846     233.997     
1 1 1 30 1  53 o 14 34.0518 5.77104 14.2865     9.43795  31.6585     10.5675  16.813     11.3298     5.91343     191.33      
1 1 1 30 1  54 o 10 33.3015 5.96659 13.3663     9.99856  30.5008     10.7066  19.1787    313.37      3.64187     313.37      
1 1 1 30 1  55 o 16 17.1946 5.30292 0.744317    8.24836  -2.82061    9.07872  0.129284   309.741     8.28039     309.741     
1 1 1 30 1  56 o 19 83.743  3.23644 123.947     13.1579  130.805     13.906   56.5224    330.254     1.18034     330.254     
1 1 1 30 1  57 o 6  35.1909 5.77845 30.2197     9.76303  18.8094     10.4753  17.5965    50.774      7.89969     230.774     
1 1 1 30 1  58 o 5  82.3332 3.27826 118.875     13.1927  128.571     13.751   40.5959    184.095     28.74       4.09533     
1 1 1 30 1  59 o 17 22.7355 6.16668 8.07959     10.1551  7.74332     9.54355  0.181182   88.8445     25.9967     268.845     
1 1 1 30 1  60 o 6  21.2137 5.91722 11.5161     10.1695  -1.62872    9.38521  6.68684    294.362     2.76918     114.362     
1 1 1 30 1  61 o 5  30.0383 6.5814  17.801      10.3689  19.2965     11.4878  16.6402    175.632     0.360552    355.632     
1 1 1 30 1  62 o 5  87.0649 3.49248 141.508     15.473   138.925     14.8767  65.3924    283.853     16.4544     283.853     
1 1 1 30 1  63 o 10 15.9841 5.13654 -0.244553   9.1618   -8.62447    9.11408  0.493146   112.401     8.685       292.401     
1 1 1 30 1  64 o 16 38.3697 5.86323 35.466      11.1102  25.1851     10.8449  18.7369    173.509     9.55533     353.509     
1 1 1 30 1  65 o 18 38.9353 6.88542 23.5108     14.0839  42.2817     13.5284  22.574     52.3288     1.14756     232.329     
1 1 1 30 1  66 o 12 81.0125 4.0464  132.412     16.4854  116.088     16.1209  52.0636    167.861     0.4008      347.861     
1 1 1 30 1  67 o 3  19.9174 6.10104 -2.33628    11.4885  4.71139     11.2523  3.95115    134.91      5.20769     314.91      
1 1 1 30 1  68 o 4  21.4961 6.4145  -6.51154    13.624   9.90276     11.6823  6.2732     277.196     7.16924     97.1958     
1 1 1 30 1  69 o 18 36.5423 7.58954 28.26       14.919   32.2119     14.7689  26.3452    200.052     16.6117     200.052     
1 1 1 30 1  70 o 16 26.0712 7.38915 11.4617     14.7959  12.8292     14.5805  5.01477    64.0065     2.48094     64.0065     
1 1 1 30 1  71 o 8  22.9029 6.9441  3.18878     14.1402  7.99944     14.4588  2.1171     112.261     0.58057     112.26      
1 1 1 30 1  72 o 6  28.1348 7.75112 21.7882     15.0274  11.5319     17.4807  13.4887    67.567      1.66584     67.567      
1 1 1 30 1  73 o 19 24.8171 7.24137 18.2678     15.0855  2.23715     15.2411  8.23608    85.0746     2.34892     265.075     
1 1 1 30 1  74 o 8  61.7759 6.23832 86.3515     19.1611  81.8424     18.3715  51.1697    128.017     29.1468     128.017     
1 1 1 30 1  75 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 2  0  o 1  255.93  3.03259 1162.57     38.8705  1162.57     38.8705  244.772    180         109.478     180         
1 1 1 30 2  1  o 15 286.437 3.18741 1459.37     45.7412  1453.93     45.7662  190.631    142.514     39.227      322.514     
1 1 1 30 2  2  f 0  185.423 2.67352 605.453     24.8291  614.661     24.8564  167.641    149.965     0           0           
1 1 1 30 2  3  o 15 49.2385 3.59731 39.453      8.48275  47.7971     8.98935  1.48411    106.759     33.1768     286.759     
1 1 1 30 2  4  o 8  99.7454 2.66978 183         13.5839  170.678     13.0595  63.6791    8.53424     2.84526     188.534     
1 1 1 30 2  5  o 3  162.671 2.50273 463.565     19.7263  475.367     21.071   134.072    187.222     38.5181     187.222     
1 1 1 30 2  6  o 17 293.892 3.31111 1513.55     48.8865  1554.19     48.6365  266.924    241.736     104.628     241.736     
1 1 1 30 2  7  o 10 80.9543 2.78181 124.786     10.5501  108.649     11.7875  29.8173    152.374     44.5822     332.374     
1 1 1 30 2  8  o 9  234.186 2.85729 992.375     32.9984  954.564     34.0303  217.202    103.843     96.2525     103.843     
1 1 1 30 2  9  o 18 84.0489 2.68303 131.305     10.8467  120.043     11.6292  25.9976    119.123     59.307      299.123     
1 1 1 30 2  10 o 16 182.434 2.58346 599.347     22.8025  581.818     24.3823  133.603    236.526     5.23808     236.526     
1 1 1 30 2  11 o 3  192.947 2.60577 671.413     24.3312  649.885     26.0009  133.698    241.54      11.0984     61.5397     
1 1 1 30 2  12 o 7  129.384 2.44908 302.264     15.3839  292.215     16.3139  52.7466    163.852     78.1983     343.852     
1 1 1 30 2  13 f 0  120.94  2.49577 255.94      14.621   263.579     15.5953  66.6165    338.324     0           0           
1 1 1 30 2  14 o 9  193.946 2.80417 667.9       26.5769  667.527     27.916   127.818    146.943     24.6831     326.943     
1 1 1 30 2  15 o 1  222.878 2.87979 879.388     31.413   884.48      32.9045  209.688    18.4811     98.588      18.4811     
1 1 1 30 2  16 o 11 58.8387 3.37002 60.8341     10.026   63.0083     9.66467  17.3332    353.897     0.0983395   353.897     
1 1 1 30 2  17 o 13 117.386 2.62995 235.376     15.0796  254.477     15.8262  81.4601    316.52      0.436182    316.52      
1 1 1 30 2  18 o 11 159.381 2.81669 457.258     21.8006  445.17      23.1323  125.619    200.35      24.5139     200.35      
1 1 1 30 2  19 o 19 237.786 2.95811 1002.19     34.4291  1006.35     36.0555  160.368    304.506     24.8688     124.506     
1 1 1 30 2  20 f 0  54.6682 3.61533 58.4613     9.36513  48.977      10.0605  65.1875    44.4054     0           0           
1 1 1 30 2  21 o 12 146.713 2.65064 381.762     18.9736  382.871     19.9741  110.318    271.436     12.3295     271.436     
1 1 1 30 2  22 o 8  105.347 3.02525 196.852     16.2517  198.196     15.6158  98.8145    5.76606     63.3207     5.76606     
1 1 1 30 2  23 o 9  30.4528 5.41568 12.7477     7.77354  22.0248     8.94534  9.55702    48.7042     39.2078     48.7042     
1 1 1 30 2  24 o 16 283.422 3.15263 1438.16     42.8099  1418.35     46.6351  233.499    228.227     56.3105     228.227     
1 1 1 30 2  25 o 14 261.912 3.07601 1215.19     39.3602  1224.19     41.3698  206.091    234.145     33.4589     234.145     
1 1 1 30 2  26 o 17 45.4119 4.1632  41.7337     8.83231  33.2839     9.4565   3.66802    352.042     61.8822     352.042     
1 1 1 30 2  27 o 7  90.9848 2.78227 154.529     12.0509  140.457     13.159   72.3245    223.709     25.3016     223.709     
1 1 1 30 2  28 o 19 162.105 2.678   473.562     20.1862  460.834     23.1567  135.387    298.224     41.252      298.224     
1 1 1 30 2  29 o 9  175.016 2.73516 576.513     23.2788  513.524     24.5486  137.542    243.878     26.0622     243.878     
1 1 1 30 2  30 o 6  103.844 2.79883 197.688     14.4414  186.523     14.6204  64.8135    183.974     14.0147     3.97445     
1 1 1 30 2  31 o 4  95.9575 2.8344  160.167     13.1652  168.088     14.0362  59.5461    263.482     12.5264     83.4818     
1 1 1 30 2  32 o 2  163.05  3.01209 487.522     23.2358  459.835     25.7991  122.477    194.986     14.0454     194.986     
1 1 1 30 2  33 o 8  94.0703 3.05851 164.196     14.3041  151.89      14.4333  57.8636    144.677     13.2149     324.677     
1 1 1 30 2  34 o 3  73.1292 3.57781 98.4949     12.1356  93.4645     13.8115  17.3983    225.035     64.7632     45.0348     
1 1 1 30 2  35 o 14 39.108  5.13369 25.4627     9.69534  31.5118     9.65136  2.16421    82.4623     39.0683     262.462     
1 1 1 30 2  36 o 16 130.444 2.96035 297.555     19.4012  309.924     19.2429  82.3624    68.2389     17.7909     248.239     
1 1 1 30 2  37 o 3  67.264  3.34349 73.6624     10.6724  89.1992     11.7225  39.2808    131.297     8.02053     311.297     
1 1 1 30 2  38 o 2  95.4334 2.85791 157.777     13.3328  167.751     13.944   56.2385    97.7878     17.915      277.788     
1 1 1 30 2  39 o 4  134.473 2.76053 304.875     18.3425  341.131     18.803   91.0553    218.787     5.46694     38.7873     
1 1 1 30 2  40 o 13 77.0257 3.21618 112.269     13.1402  100.818     11.5862  51.0975    359.962     0.852066    179.962     
1 1 1 30 2  41 o 18 84.3577 2.90089 126.644     11.6549  128.164     12.7779  73.0994    146.389     33.6042     146.389     
1 1 1 30 2  42 o 17 28.8996 5.34245 20.5407     7.72023  10.7128     8.43974  5.03748    169.531     44.7156     169.531     
1 1 1 30 2  43 o 11 91.7939 2.82836 148.38      12.8191  153.423     13.141   81.9177    144.053     38.7525     144.053     
1 1 1 30 2  44 o 13 80.1388 3.07706 112.15      11.9169  118.699     12.7081  75.9031    274.217     45.1232     274.217     
1 1 1 30 2  45 o 13 129.454 2.78128 304.385     17.0059  295.915     18.9525  98.8677    128.983     18.1511     128.983     
1 1 1 30 2  46 o 2  18.5472 5.35639 -8.75272    9.29308  7.59222     8.31481  6.26359    173.503     28.7554     173.503     
1 1 1 30 2  47 o 4  99.3236 3.20909 172.855     16.8202  182.797     14.9127  85.5944    86.9049     35.7774     86.9049     
1 1 1 30 2  48 o 13 96.7249 3.26445 162.977     16.7235  174.927     14.6644  64.1563    291.344     4.12002     111.344     
1 1 1 30 2  49 o 7  31.2917 6.13718 21.2575     10.0867  16.7736     9.9114   15.1487    285.303     0.679191    285.303     
1 1 1 30 2  50 o 1  100.521 3.18733 177.055     16.2717  188.063     15.7247  64.7619    289.636     7.76326     109.636     
1 1 1 30 2  51 o 15 105.527 3.12432 201.815     16.6205  200.416     16.3513  86.0858    29.3325     28.8022     29.3325     
1 1 1 30 2  52 o 15 48.886  4.5953  46.887      10.8932  42.5014     11.0287  26.3114    353.642     10.8421     173.642     
1 1 1 30 2  53 o 5  41.9725 5.07584 40.984      9.70064  26.7112     10.4874  22.7847    277.802     7.31711     97.8017     
1 1 1 30 2  54 o 1  81.9804 3.50929 123.063     12.9753  121.891     15.5736  54.041     73.6484     2.04625     253.648     
1 1 1 30 2  55 o 14 28.624  6.52705 13.138      9.50329  18.6933     11.8258  10.2597    259.118     12.4917     79.1175     
1 1 1 30 2  56 o 12 62.7099 3.92124 73.7876     12.03    71.592      12.3511  52.3943    192.025     22.8991     192.025     
1 1 1 30 2  57 o 5  75.53   3.61318 100.154     13.2584  109.682     13.9343  58.6833    286.928     17.1196     286.928     
1 1 1 30 2  58 o 16 111.101 3.15697 209.262     17.5315  241.433     17.4739  81.4683    5.06244     13.9181     5.06245     
1 1 1 30 2  59 o 4  52.8249 4.9079  53.3973     12.9443  53.9765     12.3987  31.8677    324.07      4.97384     144.07      
1 1 1 30 2  60 o 14 22.1088 6.26116 5.50401     10.6359  7.48646     10.4624  2.6495     80.4454     19.4297     260.445     
1 1 1 30 2  61 o 4  72.4805 3.87998 96.947      13.5156  99.7316     14.4545  55.2625    168.873     15.6806     168.873     
1 1 1 30 2  62 o 6  33.8458 6.44618 22.1739     11.1884  26.0815     11.2165  23.2849    92.1235     11.0652     92.1235     
1 1 1 30 2  63 o 3  28.7506 6.27218 8.55016     11.0513  24.3667     10.3858  11.8992    253.073     8.86484     73.0734     
1 1 1 30 2  64 o 13 20.8762 6.17783 7.27957     11.7114  1.32766     10.01    3.03784    16.4547     1.49136     196.455     
1 1 1 30 2  65 o 17 53.1585 5.47001 61.109      14.7676  52.3284     13.5272  31.9479    274.11      3.123       94.1096     
1 1 1 30 2  66 f 0  63.5208 4.69697 89.6987     14.2738  67.3844     14.7573  41.1691    4.07862     0           0           
1 1 1 30 2  67 o 7  32.5129 7.31605 30.6044     14.823   16.2976     12.442   17.5592    74.4363     2.0974      254.436     
1 1 1 30 2  68 o 14 45.3409 7.16285 44.7996     15.9036  45.3142     15.8262  32.6843    73.4628     10.4171     73.4628     
1 1 1 30 2  69 o 4  29.5429 7.66194 24.5671     15.2955  12.8303     15.0238  16.1565    4.26279     0.980731    4.26279     
1 1 1 30 2  70 o 5  27.2897 7.55078 16.0797     15.074   14.2645     14.9182  12.1771    66.9475     4.70364     246.947     
1 1 1 30 2  71 o 19 23.6938 6.83329 21.3821     14.8832  -12.8056    14.4198  7.86482    207.297     0.0366364   27.2974     
1 1 1 30 2  72 o 6  22.7511 7.04799 4.33316     15.3558  6.84356     15.3605  4.33467    214.362     0.995015    34.3623     
1 1 1 30 2  73 o 3  28.6093 7.62652 29.8884     16.0041  7.78209     15.8407  11.9682    23.6741     1.38748     203.674     
1 1 1 30 2  74 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 3  0  o 4  154.588 2.46394 424.353     19.0664  424.353     19.0664  75.4149    1.14977e-05 79.0157     180         
1 1 1 30 3  1  f 0  240.586 2.73262 1030.03     32.9352  1024.57     32.9577  145.939    5.26789     0           0           
1 1 1 30 3  2  o 2  228.452 2.64685 917.884     30.3152  934.547     30.2887  175.486    254.091     17.6359     254.091     
1 1 1 30 3  3  o 1  187.113 2.65815 616.944     24.9184  625.748     24.9318  102.265    275.528     67.7893     95.5283     
1 1 1 30 3  4  o 17 232.793 2.77993 969.516     31.7866  954.327     33.0521  156.962    26.805      26.7202     206.805     
1 1 1 30 3  5  o 1  209.879 2.66343 792.193     27.4096  771.386     28.5858  156.455    322.272     7.59        322.272     
1 1 1 30 3  6  o 8  179.585 2.59101 581.816     22.7796  562.917     23.8236  117.76     113.561     24.4803     293.561     
1 1 1 30 3  7  o 6  127.763 2.61651 294.33      16.2232  285.566     17.214   65.3912    186.913     50.705      6.91319     
1 1 1 30 3  8  o 4  129.472 2.52686 305.806     16.3565  289.695     16.3924  88.8387    320.773     4.39262     140.773     
1 1 1 30 3  9  f 0  51.3916 3.47491 48.5415     8.37393  46.1929     9.25132  45.6526    175.192     0           0           
1 1 1 30 3  10 o 6  107.714 2.52277 211.823     13.2476  200.509     13.9157  52.8742    300.938     44.7281     120.938     
1 1 1 30 3  11 o 19 34.9903 4.63889 18.2392     7.60699  27.1685     8.02802  5.24485    114.213     26.0076     114.213     
1 1 1 30 3  12 o 17 162.487 2.5204  465.859     20.4336  471.313     20.6134  143.49     356.167     55.9521     356.167     
1 1 1 30 3  13 o 2  96.6464 2.62246 167.895     12.5416  164.208     12.8086  75.1536    149.385     23.9722     149.385     
1 1 1 30 3  14 o 17 108.341 2.66361 211.901     13.5751  205.381     15.227   67.3492    57.3337     16.0472     237.334     
1 1 1 30 3  15 o 13 235.169 2.86212 982.924     33.1815  981.409     34.2706  140.204    174.758     63.4652     354.758     
1 1 1 30 3  16 o 11 124.059 2.58711 280.481     15.8882  266.53      16.2268  90.6563    194.661     6.6623      194.661     
1 1 1 30 3  17 o 15 189.376 2.6443  644.431     24.2287  629.139     25.9109  161.657    1.22375     50.0676     1.22375     
1 1 1 30 3  18 o 19 69.0871 3.1277  89.0873     10.0269  81.3437     11.3868  23.9432    17.174      43.4889     197.174     
1 1 1 30 3  19 o 4  254.127 3.02621 1134.45     38.6731  1160.94     38.3992  200.256    187.368     30.2616     187.368     
1 1 1 30 3  20 o 1  159.352 2.61188 453.977     20.8314  447.964     20.8836  78.0034    268.022     74.0933     88.0221     
1 1 1 30 3  21 o 16 202.181 2.74048 720.777     27.7367  731.668     27.7962  135.317    97.4559     22.3444     277.456     
1 1 1 30 3  22 o 19 115.348 3.01363 230.61      17.8882  243.197     16.8383  75.4393    217.123     11.1098     37.1228     
1 1 1 30 3  23 o 12 30.0199 5.66388 17.8709     7.99757  15.4121     9.45473  9.18991    221.625     39.2838     221.625     
1 1 1 30 3  24 o 15 99.8353 2.83916 163.688     13.6591  191.791     14.6882  64.865     9.83915     8.11758     189.839     
1 1 1 30 3  25 o 8  37.4755 4.87718 25.221      8.38403  26.6065     9.25881  3.23909    217.297     10.6151     37.2967     
1 1 1 30 3  26 o 6  60.5336 3.4546  73.6918     9.57105  58.1523     10.8701  22.5405    62.3018     32.3845     242.302     
1 1 1 30 3  27 o 10 203.983 2.77772 753.093     27.3396  726.891     29.3707  166.579    79.7032     40.1603     79.7032     
1 1 1 30 3  28 o 8  195.819 2.68522 688.873     24.8238  674.882     27.7622  163.302    34.5005     46.1072     34.5005     
1 1 1 30 3  29 o 19 97.9324 2.9652  180.292     14.7054  162.023     14.3188  72.5993    20.9375     11.2497     20.9375     
1 1 1 30 3  30 o 12 116.52  2.87362 240.992     15.9631  242.959     17.5144  90.1283    329.384     17.9704     329.384     
1 1 1 30 3  31 o 13 19.2952 5.59304 5.00565     8.00761  -1.92462    9.77095  16.4893    307.554     43.4579     307.554     
1 1 1 30 3  32 o 12 21.5488 5.50955 -5.25637    8.53355  13.8681     9.06491  20.124     338.603     56.6259     338.603     
1 1 1 30 3  33 o 19 178.999 3.06665 582.45      27.3928  560.408     27.6128  118.579    115.785     17.8442     295.785     
1 1 1 30 3  34 o 2  137.202 2.80124 337.503     18.5301  333.957     19.917   115.08     267.542     38.3064     267.542     
1 1 1 30 3  35 o 1  120.634 2.8735  271.421     16.364   248.405     18.1718  116.856    15.1925     69.6211     15.1925     
1 1 1 30 3  36 o 2  48.6887 4.04381 34.9431     9.36201  52.1675     9.69981  10.952     272.411     4.82067     272.411     
1 1 1 30 3  37 o 11 113.492 2.73599 238.246     14.9722  221.783     16.0312  74.1903    328.585     9.49593     148.585     
1 1 1 30 3  38 o 9  91.7428 2.75797 142.136     12.1873  158.945     13.1202  73.1671    356.496     21.8733     356.496     
1 1 1 30 3  39 o 14 44.7431 4.21515 40.942      8.80629  32.6369     9.41318  25.6528    164.298     0.62578     164.298     
1 1 1 30 3  40 o 15 179.787 2.7391  569.937     23.0527  584.331     26.2367  145.564    197.903     37.4958     197.903     
1 1 1 30 3  41 o 12 102.416 2.92323 178.781     14.9309  197.179     14.9889  60.351     324.309     22.3364     144.309     
1 1 1 30 3  42 o 16 45.6112 4.48357 32.4002     9.22378  44.9009     10.6971  34.5984    231.548     20.116      231.548     
1 1 1 30 3  43 o 19 107.629 3.06253 198.277     15.5398  217.959     17.4366  63.6993    47.8291     22.5611     227.829     
1 1 1 30 3  44 o 18 121.428 3.01821 255.306     18.4554  274.409     18.191   96.9785    84.3414     25.2538     84.3414     
1 1 1 30 3  45 o 13 140.836 2.86038 353.439     20.4078  358.302     19.9194  119.853    262.39      43.9135     262.39      
1 1 1 30 3  46 o 9  132.579 2.82298 290.627     17.8537  341.486     19.6255  82.486     148.02      19.3701     328.02      
1 1 1 30 3  47 o 6  88.4345 3.07965 134.797     12.9578  147.424     14.2615  64.8685    264.454     8.83907     264.454     
1 1 1 30 3  48 o 13 63.6682 3.60834 74.2779     10.8426  73.4237     11.9507  46.4072    74.4058     8.00818     74.4058     
1 1 1 30 3  49 o 1  58.9311 4.08021 60.7766     11.3439  67.1056     12.4547  38.7867    63.8389     0.601218    243.839     
1 1 1 30 3  50 o 18 44.5796 4.69928 31.187      9.93237  43.9989     10.2209  30.4266    82.4265     5.00869     82.4265     
1 1 1 30 3  51 o 12 39.2829 5.04523 28.8329     9.41282  30.0174     9.72098  25.1       114.137     2.6174      114.137     
1 1 1 30 3  52 o 17 52.1609 4.29817 50.5549     11.114   50.591      10.9352  28.6552    129.603     11.2799     309.603     
1 1 1 30 3  53 o 9  30.3193 6.2108  16.7284     10.793   19.24       9.29711  13.9316    69.1938     6.76851     249.194     
1 1 1 30 3  54 o 5  60.8042 4.03722 68.273      12.7451  68.542      11.5278  44.0352    230.664     7.73927     230.664     
1 1 1 30 3  55 o 8  88.9769 3.19654 142.378     14.5155  145.809     13.8797  63.0916    128.552     6.19714     128.552     
1 1 1 30 3  56 o 19 20.0253 5.79002 4.39311     9.32113  3.50935     9.12319  2.01093    205.682     16.919      25.6819     
1 1 1 30 3  57 o 5  19.4202 5.75938 -3.22385    10.4004  6.14051     9.22153  2.152      354.746     15.3981     174.746     
1 1 1 30 3  58 o 14 77.3063 3.5117  104.079     13.7293  116.671     13.2622  54.4976    144.113     6.04741     144.112     
1 1 1 30 3  59 o 18 55.0469 4.34012 58.3913     11.9341  56.7205     11.6051  30.1774    85.6255     11.8187     265.626     
1 1 1 30 3  60 o 19 25.3028 6.5411  12.4904     10.9192  11.3821     10.7009  8.66009    264.734     3.21369     264.734     
1 1 1 30 3  61 o 8  58.7116 4.52089 60.61       12.3976  71.9898     13.7854  51.3235    108.267     27.9797     108.267     
1 1 1 30 3  62 o 11 56.7026 4.82108 60.7779     12.2891  64.3008     14.4907  23.656     198.037     26.4915     18.0371     
1 1 1 30 3  63 o 7  34.1723 6.33636 15.0273     10.9289  35.1511     12.0559  12.4044    307.959     16.6681     127.959     
1 1 1 30 3  64 f 0  29.3096 6.92399 16.3119     11.8084  20.1794     12.1386  19.6599    329.633     0           0           
1 1 1 30 3  65 o 12 71.7484 4.93512 104.071     16.9418  97.1711     17.9989  60.2183    129.259     28.6131     129.259     
1 1 1 30 3  66 o 7  35.6088 7.7365  16.8423     14.6546  41.2027     17.0131  18.1682    287.671     6.24192     107.671     
1 1 1 30 3  67 o 18 24.926  7.06589 7.95442     14.4255  12.066      12.6726  11.4702    5.31112     1.06451     185.311     
1 1 1 30 3  68 o 15 30.4809 7.72654 23.7875     15.1066  17.7324     15.0414  18.1247    170.295     4.41025     170.295     
1 1 1 30 3  69 o 2  30.2863 7.84254 21.4177     15.7037  20.7709     15.389   16.4885    253.704     8.80214     253.704     
1 1 1 30 3  70 o 6  28.2449 7.46318 27.0542     15.1483  6.3366      15.244   12.2301    270.229     5.60715     90.2286     
1 1 1 30 3  71 o 2  23.5111 7.14316 9.54157     15.065   6.30774     15.2859  4.97206    153.482     0.320584    333.482     
1 1 1 30 3  72 o 18 18.5946 5.95221 -14.7214    15.108   4.74223     10.8291  0.671544   349.398     11.0253     169.398     
1 1 1 30 3  73 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 4  0  o 14 258.663 2.97925 1187.81     38.596   1187.81     38.596   200.854    180         16.63       180         
1 1 1 30 4  1  o 18 59.6589 3.04768 73.2924     8.96565  54.5026     8.97105  24.1313    148.613     16.449      328.613     
1 1 1 30 4  2  o 9  209.075 2.65892 783.51      27.8892  768.476     27.8278  129.671    31.3145     47.2492     211.314     
1 1 1 30 4  3  o 1  28.942  5.15476 13.8054     7.63704  17.2278     7.36002  22.8466    291.941     67.4304     291.941     
1 1 1 30 4  4  o 2  196.469 2.57106 692.148     25.3001  678.19      25.3263  160.632    139.165     35.3564     139.165     
1 1 1 30 4  5  o 6  122.648 2.53911 263.338     14.8915  271.139     16.2744  92.3732    124.114     12.4543     124.114     
1 1 1 30 4  6  o 10 157.703 2.54429 435.795     20.4917  447.13      19.7038  125.504    343.395     24.2674     343.395     
1 1 1 30 4  7  o 14 171.456 2.54622 522.711     22.2513  520.905     21.4996  150.621    165.384     54.3816     165.384     
1 1 1 30 4  8  o 13 152.813 2.50198 422.643     18.7553  406.411     19.5367  136.934    17.4685     56.1994     17.4685     
1 1 1 30 4  9  o 5  140.9   2.48409 365.248     17.472   339.963     17.5721  84.354     2.07609     34.3804     182.076     
1 1 1 30 4  10 o 9  97.4865 2.65987 164.287     12.8847  173.748     13.0523  33.5025    57.2681     70.7965     237.268     
1 1 1 30 4  11 o 3  58.2427 3.23585 64.6522     9.07082  56.796      9.58884  15.9167    28.1333     41.4095     208.133     
1 1 1 30 4  12 o 14 212.614 2.63493 796.819     27.4596  808.489     28.6851  191.769    254.742     74.0112     254.742     
1 1 1 30 4  13 o 18 49.4249 3.93348 46.1801     8.52596  41.9398     10.3781  7.68169    39.8853     42.5191     219.885     
1 1 1 30 4  14 o 12 76.5168 2.88972 102.898     10.4326  105.731     11.6299  31.2916    259.982     41.2548     79.9815     
1 1 1 30 4  15 o 1  47.8757 3.71815 41.4515     8.47203  41.115      9.06084  3.46237    304.805     66.2317     304.805     
1 1 1 30 4  16 o 6  38.7125 4.61847 28.6793     8.35394  26.2774     8.89235  13.5198    338.967     71.2322     338.967     
1 1 1 30 4  17 o 7  53.8608 3.48594 56.6441     8.92916  47.6567     9.54611  19.1606    240.932     24.6924     60.9321     
1 1 1 30 4  18 o 5  101.89  2.66778 194.125     12.8349  175.478     14.2268  48.5554    90.9022     46.6163     270.902     
1 1 1 30 4  19 o 6  38.1773 4.67911 27.4706     8.03979  26.0721     9.16107  2.83645    69.0851     22.9974     249.085     
1 1 1 30 4  20 o 9  158.198 2.57919 461.162     20.3528  428.364     20.5154  93.1742    169.915     42.1667     349.915     
1 1 1 30 4  21 o 4  32.2772 5.06781 24.3525     7.71281  14.5479     8.3846   21.5098    61.89       78.0932     61.89       
1 1 1 30 4  22 o 13 71.2562 3.02861 91.2964     10.6665  89.9936     10.8609  44.2633    321.637     3.28132     141.637     
1 1 1 30 4  23 o 9  95.1556 2.86234 163.07      14.1085  159.574     13.1192  75.7343    354.328     22.7004     354.328     
1 1 1 30 4  24 o 4  140.923 2.69911 349.496     19.0624  357.231     19.0238  127.966    142.774     57.1259     142.774     
1 1 1 30 4  25 o 1  66.5589 3.19797 76.4963     10.4263  82.061      10.7804  38.5415    297.204     8.40241     117.204     
1 1 1 30 4  26 f 0  76.978  3.34715 107.538     12.4318  104.485     13.2394  37.108     272.748     0           0           
1 1 1 30 4  27 o 3  81.7662 3.28591 110.446     12.9714  129.022     13.8383  37.8605    66.1926     36.9307     246.193     
1 1 1 30 4  28 o 6  162.543 3.23977 483.403     26.5264  459.55      26.1958  151.077    163.273     71.2403     163.273     
1 1 1 30 4  29 o 17 51.777  4.30759 52.4127     10.3492  45.1047     11.3864  24.018     260.395     13.5762     80.3948     
1 1 1 30 4  30 f 0  70.5982 3.63165 94.8179     12.55    84.4214     12.9097  49.0334    167.154     0           0           
1 1 1 30 4  31 o 7  177.433 2.97479 552.999     24.4139  570.069     28.3689  159.798    296.475     67.1437     296.475     
1 1 1 30 4  32 o 3  143.099 2.64649 364.224     18.2639  365.743     19.6383  137.837    333.956     75.6381     333.956     
1 1 1 30 4  33 o 5  121.61  2.75624 264.925     15.7838  262.841     17.7029  65.7966    167.57      40.0158     347.57      
1 1 1 30 4  34 o 19 40.1438 4.43638 27.8551     8.17115  31.5585     9.10317  11.9133    135.09      14.3558     315.09      
1 1 1 30 4  35 o 15 39.0291 4.77667 30.9455     8.2252   25.6548     9.59896  6.55251    275.292     31.3754     95.2922     
1 1 1 30 4  36 o 3  56.0382 3.82743 64.7821     9.2896   49.494      11.3217  10.2637    253.588     54.6489     73.5884     
1 1 1 30 4  37 o 3  45.3179 4.13783 32.9839     8.45377  42.4604     9.91729  8.65712    270.508     41.6498     90.5082     
1 1 1 30 4  38 o 15 122.982 2.95876 278.626     16.9928  262.878     19.2689  87.5289    5.62999     1.87248     5.62996     
1 1 1 30 4  39 o 8  49.2471 4.5972  43.0871     10.2359  46.2629     11.8813  33.8569    236.444     4.59826     236.444     
1 1 1 30 4  40 o 1  71.438  3.51603 90.7845     11.6095  93.5407     13.3652  42.7467    60.0842     12.8176     240.084     
1 1 1 30 4  41 o 10 19.3907 5.52861 -1.18223    7.98143  7.03456     8.98168  2.6528     143.791     19.6165     143.791     
1 1 1 30 4  42 o 2  138.977 2.93487 331.191     18.8549  362.112     21.9676  119.137    255.481     43.5449     255.481     
1 1 1 30 4  43 f 0  104.137 3.06971 192.144     14.2573  197.996     17.5757  52.5847    271.439     0           0           
1 1 1 30 4  44 f 0  39.3431 5.12132 29.4427     9.60171  29.1917     9.84746  22.3578    249.079     0           0           
1 1 1 30 4  45 o 5  86.0616 2.95479 125.138     11.9784  141.9       13.4449  53.7438    111.499     11.2168     291.499     
1 1 1 30 4  46 f 0  58.0145 3.58394 56.6206     9.70948  66.2959     10.933   39.1932    339.727     0           0           
1 1 1 30 4  47 o 2  63.3034 3.5463  72.9079     10.7167  73.0899     11.5812  46.1438    61.3032     7.52566     61.3032     
1 1 1 30 4  48 o 11 69.4068 3.35282 86.3755     11.1507  88.6257     12.025   55.6213    273.12      18.147      273.12      
1 1 1 30 4  49 o 4  60.7769 3.61087 56.296      10.4755  79.6837     11.1492  48.3084    304.16      16.3748     304.16      
1 1 1 30 4  50 o 17 23.4513 5.98356 9.09814     9.1091   9.26656     8.90014  5.91277    337.381     3.52699     157.381     
1 1 1 30 4  51 o 12 117.495 2.95091 231.886     17.8244  267.271     16.6973  77.3269    222.312     6.66819     42.3121     
1 1 1 30 4  52 o 18 70.1811 3.6096  84.1356     12.7898  96.379      12.3359  49.7636    111.048     5.16608     111.048     
1 1 1 30 4  53 o 5  48.2291 4.65656 41.8234     10.9089  46.1357     10.9914  22.8207    284.473     18.1019     104.473     
1 1 1 30 4  54 o 7  100.034 3.11144 182.706     16.0378  181.233     15.0689  74.4633    8.52069     13.0698     8.5207      
1 1 1 30 4  55 o 16 93.6247 3.3279  153.943     16.1446  166.882     14.8756  69.2563    328.791     11.9084     328.791     
1 1 1 30 4  56 o 1  19.7999 5.65195 9.25079     9.14297  -3.73955    9.36227  0.711242   233.983     23.6566     233.983     
1 1 1 30 4  57 o 6  62.9077 3.80889 65.293      11.5095  82.7926     12.208   37.0492    233.817     9.63251     53.8166     
1 1 1 30 4  58 o 9  42.8479 5.03258 32.6236     10.0688  39.5147     10.7757  28.6083    335.661     2.82784     335.661     
1 1 1 30 4  59 o 16 21.9794 6.17669 7.05525     10.4936  6.85064     9.84923  4.93501    308.864     13.5973     128.864     
1 1 1 30 4  60 f 0  74.5531 3.72125 106.268     13.6073  101.624     14       55.5372    355.125     0           0           
1 1 1 30 4  61 o 2  26.1806 6.51701 16.8661     11.1641  10.2654     10.2511  8.50235    303.944     12.2825     123.944     
1 1 1 30 4  62 o 13 29.1747 6.52576 10.9413     10.7235  24.6901     11.5031  8.80649    79.1368     16.5775     259.137     
1 1 1 30 4  63 o 5  30.3575 6.7357  21.9382     12.0045  17.7067     10.8318  16.3159    287.947     6.81475     287.947     
1 1 1 30 4  64 o 2  22.4605 6.50402 8.64858     11.3357  4.33025     12.1586  5.76989    188.19      11.2046     8.19002     
1 1 1 30 4  65 o 17 39.0311 7.09178 37.2652     14.3945  29.8528     13.5693  20.2812    339.608     7.58369     159.608     
1 1 1 30 4  66 o 9  26.3306 7.22554 18.3638     13.9816  6.38481     14.0567  6.11615    135.095     3.25705     135.095     
1 1 1 30 4  67 o 6  20.4226 6.45088 -11.7307    13.6207  7.23214     14.3192  4.69485    195.34      10.6        15.34       
1 1 1 30 4  68 o 10 19.489  6.35627 -1.6192     14.4048  -8.01922    14.6058  3.16883    88.1843     12.3505     268.184     
1 1 1 30 4  69 o 7  20.7968 6.55787 9.66299     14.5378  -13.4822    14.8304  4.01445    60.2685     11.229      240.268     
1 1 1 30 4  70 o 5  31.8071 8.0288  23.3594     15.7706  28.7274     16.6079  15.1083    121.691     4.30462     301.691     
1 1 1 30 4  71 o 16 20.9243 6.53917 3.43016     15.2958  3.75551     11.6999  3.27669    285.494     7.96999     105.494     
1 1 1 30 4  72 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 5  0  o 17 351.029 3.44773 2188.57     60.6245  2188.57     60.6245  348.804    360         174.321     360         
1 1 1 30 5  1  o 7  105.335 2.59    191.848     13.8471  202.704     13.4324  77.6289    94.5713     8.14595     94.5713     
1 1 1 30 5  2  o 14 245.314 2.78745 1084.74     34.2815  1053.12     34.2497  170.618    188.747     20.9329     8.74726     
1 1 1 30 5  3  o 1  58.2074 3.33073 65.2271     9.70055  56.2046     9.53275  13.6145    306.233     47.672      126.233     
1 1 1 30 5  4  o 5  111.863 2.51347 224.374     14.0361  220.394     14.107   55.5445    217.355     49.1583     37.3551     
1 1 1 30 5  5  o 8  64.7232 3.01454 79.988      9.75635  69.7084     9.65979  23.671     288.754     37.4582     108.754     
1 1 1 30 5  6  o 6  143.666 2.52549 361.416     17.8735  371.539     18.4928  112.554    232.305     18.2075     232.305     
1 1 1 30 5  7  o 15 119.21  2.46496 257.502     14.7018  247.574     14.7139  87.7854    37.2208     6.2721      37.2208     
1 1 1 30 5  8  o 17 163.379 2.56664 481.866     21.3945  466.186     20.6362  152.291    174.37      69.378      174.37      
1 1 1 30 5  9  o 7  24.9761 5.40956 12.6682     7.29791  9.56152     7.61733  6.76771    126.059     20.8155     126.059     
1 1 1 30 5  10 o 16 116.866 2.5736  246.41      15.0627  239.188     15.0436  94.7048    123.188     25.0538     123.188     
1 1 1 30 5  11 o 18 57.7871 3.18172 63.4487     9.11225  56.1419     9.14009  23.0063    239.101     25.1484     59.1008     
1 1 1 30 5  12 o 9  107.225 2.52421 205.664     13.5607  203.17      13.529   66.4604    131.772     18.8238     311.772     
1 1 1 30 5  13 o 14 37.2132 4.3996  26.3702     7.91326  24.3893     7.91042  2.17972    292.405     20.2836     112.405     
1 1 1 30 5  14 o 4  32.0842 4.90724 17.986      7.68704  20.2502     7.63767  5.59717    215.99      34.1189     215.99      
1 1 1 30 5  15 o 11 181.54  2.65875 597.919     24.5655  573.384     23.8137  135.22     22.1237     6.1555      22.1238     
1 1 1 30 5  16 o 5  54.5371 3.53519 58.3738     8.95874  48.6649     9.94696  15.8693    147.28      36.4961     327.28      
1 1 1 30 5  17 o 12 41.1673 4.27384 34.0358     8.13101  27.89       8.81366  6.07313    254.786     27.7238     74.7865     
1 1 1 30 5  18 o 4  184.936 2.56512 618.276     23.202   597.28      24.3069  126.557    312.942     16.12       132.942     
1 1 1 30 5  19 o 7  124.231 2.52149 276.434     15.2577  272.509     16.0882  111.323    344.597     48.2936     344.597     
1 1 1 30 5  20 o 10 115.547 2.70571 253.974     15.1035  221.84      16.0531  90.1221    161.86      17.4996     161.86      
1 1 1 30 5  21 o 8  144.659 2.52473 372.727     17.7893  371.403     18.7852  97.9908    346.796     12.2344     166.796     
1 1 1 30 5  22 o 3  40.8823 4.7315  28.1666     9.66458  33.3404     8.93974  10.1949    335.975     11.7167     155.975     
1 1 1 30 5  23 o 11 138.318 2.85953 346.355     20.0983  335.239     19.5033  123.349    304.134     50.4136     304.134     
1 1 1 30 5  24 o 13 214.023 3.11938 814.025     33.3576  818.183     33.5568  153.275    334.36      4.3987      154.36      
1 1 1 30 5  25 o 15 94.4761 3.10704 163.633     14.0696  155.222     15.2081  54.6388    192.886     23.0382     12.8858     
1 1 1 30 5  26 o 17 22.5818 5.85983 12.2551     9.21527  0.371192    9.23509  9.78187    241.428     31.45       241.428     
1 1 1 30 5  27 o 3  83.5391 3.27966 126.074     13.6977  123.757     13.6545  75.5452    254.104     44.7671     254.104     
1 1 1 30 5  28 o 2  107.412 2.89723 201.191     14.9729  210.712     16.1589  68.6692    25.6577     13.931      205.658     
1 1 1 30 5  29 o 18 51.2966 3.94393 45.5248     9.8905   49.9218     10.0483  23.501     108.05      14.8862     288.05      
1 1 1 30 5  30 o 15 43.7495 4.37253 37.5592     8.8105   32.656      9.68703  12.2585    134.156     26.0112     314.156     
1 1 1 30 5  31 o 11 93.4492 2.99069 152.824     13.2337  159.569     14.6927  85.8553    102.986     47.7107     102.986     
1 1 1 30 5  32 o 2  34.6058 5.29333 24.417      7.85959  20.5026     9.94775  10.2615    240.479     61.4628     240.479     
1 1 1 30 5  33 o 2  141.115 2.71085 347.178     17.6019  363.731     20.6435  119.535    343.743     39.5146     343.743     
1 1 1 30 5  34 o 15 79.1739 3.27857 130.529     11.7949  95.8918     13.5156  44.6672    153.299     19.9227     333.299     
1 1 1 30 5  35 o 12 28.3812 6.05911 15.7483     7.95353  13.6438     10.9982  1.36308    148.561     32.6562     148.561     
1 1 1 30 5  36 o 16 78.5175 3.42367 119.261     12.0437  102.976     14.4058  37.4048    55.7167     34.9201     235.717     
1 1 1 30 5  37 o 11 64.0995 3.79605 80.8315     11.0597  68.3188     12.7886  50.243     175.97      14.0129     175.97      
1 1 1 30 5  38 o 18 29.6287 6.10845 13.3552     9.06052  19.9877     10.3131  4.58302    67.2687     0.766238    67.2687     
1 1 1 30 5  39 o 7  86.9493 3.1064  132.559     13.2484  139.334     13.7369  69.111     339.005     17.5012     339.005     
1 1 1 30 5  40 o 8  55.4296 3.76517 56.5723     9.76782  55.3437     10.8425  39.7443    202.401     5.89449     202.401     
1 1 1 30 5  41 o 1  50.1685 4.09863 45.8952     9.66602  46.5586     10.5462  26.4821    115.916     13.9859     295.916     
1 1 1 30 5  42 o 9  94.0601 2.93725 154.068     13.0706  164.257     14.5481  74.9226    116.122     19.2818     116.122     
1 1 1 30 5  43 o 14 77.8047 3.17347 103.207     11.6968  115.677     12.9551  58.3115    91.5022     9.74296     91.5022     
1 1 1 30 5  44 o 6  49.4926 4.22883 46.6612     9.91325  43.9534     10.5873  14.5072    156.428     37.8479     336.428     
1 1 1 30 5  45 o 4  18.5515 5.20032 8.10892     7.52793  -5.04144    8.34365  3.00226    159.511     22.3524     159.511     
1 1 1 30 5  46 o 7  27.1197 5.78581 16.9421     8.35067  10.7816     9.02376  10.333     135.736     6.26608     315.736     
1 1 1 30 5  47 o 11 44.1907 4.62114 32.0537     9.41827  41.5893     10.4064  22.9475    185.753     11.79       5.75293     
1 1 1 30 5  48 o 11 36.7246 5.28077 30.4723     8.93521  21.6728     9.79216  16.7754    265.648     12.7213     85.6476     
1 1 1 30 5  49 o 17 111.982 2.89099 225.239     16.3489  227.299     16.0412  86.5136    146.615     18.6866     146.615     
1 1 1 30 5  50 o 10 28.8002 5.9432  14.2461     8.86543  18.1995     9.40435  12.5034    39.453      7.85762     219.453     
1 1 1 30 5  51 o 5  101.597 3.05843 181.372     15.9677  192.867     15.0471  86.3173    18.1182     33.7385     18.1182     
1 1 1 30 5  52 o 11 17.4021 5.38472 0.296353    8.70148  -2.08508    9.22061  4.37613    54.7689     27.4501     54.7689     
1 1 1 30 5  53 o 14 60.8271 3.98221 72.0618     11.7964  65.6209     12.1559  38.4596    74.0716     4.75074     254.072     
1 1 1 30 5  54 o 4  82.3733 3.51271 124.181     13.9623  125.571     14.8919  59.879     257.168     8.23165     257.168     
1 1 1 30 5  55 o 7  36.5352 5.70299 36.7296     10.3559  17.7972     10.3576  18.3062    125.329     9.92882     305.329     
1 1 1 30 5  56 o 11 23.1092 6.11614 9.52117     9.17778  8.62579     9.94822  9.49142    271.189     0.316686    271.189     
1 1 1 30 5  57 o 9  17.8316 5.17168 8.51561     8.03041  -11.4183    9.22903  2.5049     213.532     10.3869     33.5319     
1 1 1 30 5  58 o 5  64.8234 3.78106 61.774      11.5289  97.6916     12.4705  40.5848    195.677     4.88698     15.6768     
1 1 1 30 5  59 o 8  21.2125 6.01477 4.48898     9.23083  7.88467     10.2553  2.97405    125.444     16.7149     305.444     
1 1 1 30 5  60 o 10 38.0271 5.88681 33.355      9.92383  26.4025     11.919   28.2224    146.864     12.8096     146.864     
1 1 1 30 5  61 o 3  19.2712 5.77299 1.29997     8.71356  4.54649     10.5382  0.0764369  113.074     18.6017     293.074     
1 1 1 30 5  62 o 9  19.7819 5.91165 3.82609     9.4079   2.57614     10.7855  0.346994   162.734     19.4147     342.734     
1 1 1 30 5  63 o 4  100.611 3.66456 184.429     17.5261  194.541     19.2934  72.4452    153.791     11.9416     153.791     
1 1 1 30 5  64 o 1  30.4241 7.40926 22.9683     13.7901  17.2343     13.7478  18.0715    261.153     2.52561     261.153     
1 1 1 30 5  65 o 19 27.4763 7.41277 14.7018     14.559   15.6091     13.83    10.5443    129.919     10.4588     309.919     
1 1 1 30 5  66 o 19 22.4071 6.91432 4.06998     14.1208  3.49965     15.1763  7.04143    287.462     0.887091    287.462     
1 1 1 30 5  67 o 19 17.4878 5.89167 -18.155     15.7055  -7.38415    13.2326  2.5137     3.474       7.579       183.474     
1 1 1 30 5  68 o 2  23.8687 7.31493 3.48819     14.9625  11.8629     17.3295  8.42091    196.865     4.62183     16.8654     
1 1 1 30 5  69 o 15 38.6902 8.40555 35.0272     16.4447  45.3094     19.3156  24.6256    180.67      5.87672     180.67      
1 1 1 30 5  70 f 0  29.609  7.5738  36.6308     17.113   7.21452     13.8181  18.4453    312.336     0           0           
1 1 1 30 5  71 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 6  0  o 9  169.988 2.53828 513.293     21.6013  513.293     21.6013  122.98     180         7.80171     8.6815e-06  
1 1 1 30 6  1  o 10 58.5644 3.3334  67.1533     9.91039  55.9411     9.46179  32.6758    330.998     6.12889     330.998     
1 1 1 30 6  2  o 13 109.027 2.62251 209.802     14.285   213.029     14.3307  65.6985    288.069     24.3783     108.069     
1 1 1 30 6  3  o 12 157.963 2.51784 450.96      19.5161  435.49      20.3202  109.535    161.836     11.5772     341.836     
1 1 1 30 6  4  o 19 160.146 2.4817  459.662     19.9278  451.369     19.9054  118.028    44.0585     2.42168     44.0585     
1 1 1 30 6  5  o 2  93.3338 2.65823 166.517     12.639   143.942     12.1573  68.4119    90.9927     8.08524     90.9927     
1 1 1 30 6  6  o 12 127.902 2.54614 288.041     15.9397  293.624     16.6656  107.604    6.93943     32.704      6.93943     
1 1 1 30 6  7  f 0  75.4623 2.80314 99.6813     10.5683  103.319     10.5558  41.7096    216.664     0           0           
1 1 1 30 6  8  o 3  67.165  2.93887 81.8943     9.86685  79.1447     9.81873  29.0953    100.919     31.4092     280.919     
1 1 1 30 6  9  f 0  134.133 2.60464 322.262     17.4164  317.568     17.5649  104.327    151.573     0           0           
1 1 1 30 6  10 o 8  80.0447 2.8481  115.846     11.2285  112.556     11.539   44.3996    32.2144     21.0193     212.214     
1 1 1 30 6  11 o 9  207.755 2.68132 759.325     27.3278  774.932     28.5026  198.924    341.122     94.3184     341.122     
1 1 1 30 6  12 o 11 150.277 2.48273 408.788     18.4161  393.708     18.9596  130.654    24.6773     44.5958     24.6773     
1 1 1 30 6  13 o 1  159.169 2.48724 450.561     19.8105  449.702     19.8688  129.356    253.829     27.8095     253.829     
1 1 1 30 6  14 o 16 60.6282 3.1266  65.9473     9.44371  65.5823     9.42496  14.1147    136.96      53.0482     316.96      
1 1 1 30 6  15 o 5  115.813 2.55457 247.122     15.4238  230.261     14.1968  87.4144    138.303     10.1954     138.303     
1 1 1 30 6  16 o 5  59.0094 3.30236 69.2049     9.68723  55.9656     9.60237  25.1315    290.515     25.8173     110.515     
1 1 1 30 6  17 o 6  158.269 2.52089 446.838     19.5567  443.672     20.4195  77.0955    149.867     76.7911     329.867     
1 1 1 30 6  18 o 10 60.2155 3.22565 71.4208     9.91461  58.8075     9.38077  27.8131    112.17      22.5115     292.17      
1 1 1 30 6  19 o 4  18.3956 5.24077 7.86828     8.24264  -8.45891    8.40243  5.13594    162.924     13.191      162.924     
1 1 1 30 6  20 o 16 87.3781 3.03988 134.598     13.2701  138.042     13.269   63.0714    343.316     5.92543     343.316     
1 1 1 30 6  21 o 11 176.1   2.98423 558.573     26.2633  546.217     26.4048  154.07     116.43      53.1327     116.43      
1 1 1 30 6  22 o 5  91.6165 3.27685 149.64      15.1875  150.535     14.8007  81.1848    284.686     38.6609     284.686     
1 1 1 30 6  23 o 16 50.5933 4.40883 50.2436     10.8348  43.078      10.9709  25.8514    249.565     6.22517     69.5651     
1 1 1 30 6  24 o 2  107.527 3.01183 207.332     15.194   205.559     17.1313  89.6563    149.646     28.8143     149.646     
1 1 1 30 6  25 o 2  103.847 3.04553 210.543     14.278   175.579     16.8912  86.174     295.446     27.7007     295.446     
1 1 1 30 6  26 o 9  63.4657 3.38803 68.3664     9.78198  76.518      11.6079  36.3831    122.772     10.2551     302.772     
1 1 1 30 6  27 o 6  83.7679 2.87393 118.13      11.3068  132.95      12.7609  45.8035    98.1937     24.693      278.194     
1 1 1 30 6  28 o 6  83.0372 2.86542 120.316     11.2166  126.289     12.5481  61.3957    56.9714     10.0825     56.9714     
1 1 1 30 6  29 o 2  56.0148 3.67055 55.2838     9.59951  58.1319     10.7622  20.4899    173.75      32.2577     353.75      
1 1 1 30 6  30 f 0  115.312 2.70877 228.477     15.1873  246.472     16.0802  100.753    212.353     0           0           
1 1 1 30 6  31 o 15 44.6085 4.68479 33.8836     9.05458  39.642      11.2584  10.3888    140.28      36.0581     320.28      
1 1 1 30 6  32 o 6  27.4687 5.85339 17.9097     8.92518  9.67843     8.95064  5.19994    80.107      39.4554     80.107      
1 1 1 30 6  33 o 12 67.2474 3.47496 79.98       11.7743  83.1028     11.4733  20.8233    130.375     52.2028     310.375     
1 1 1 30 6  34 o 8  139.254 2.97483 342.363     21.7129  352.02      19.6745  108.785    317.641     18.5661     317.641     
1 1 1 30 6  35 o 7  82.7534 3.35536 121.694     14.0547  124.886     13.6479  33.9742    201.385     49.1556     21.3854     
1 1 1 30 6  36 o 9  131.504 2.91612 314.985     19.083   304.817     19.2969  108.229    226.279     29.4083     226.279     
1 1 1 30 6  37 o 2  29.9034 5.91044 12.6971     8.99737  21.4696     9.69032  3.88745    210.196     1.03046     210.196     
1 1 1 30 6  38 o 11 91.5942 3.15224 145.354     13.0205  156.806     15.7821  84.1608    205.408     41.0693     205.408     
1 1 1 30 6  39 o 6  74.1803 3.27258 91.6551     11.1475  107.442     13.0814  69.1329    124.775     37.6519     124.775     
1 1 1 30 6  40 o 17 17.4173 5.31315 1.00231     7.45446  -1.82989    9.52477  9.54109    236.484     35.967      236.484     
1 1 1 30 6  41 o 12 49.3249 4.22984 44.4539     9.43961  45.4534     10.985   29.5885    28.3088     6.40774     208.309     
1 1 1 30 6  42 o 13 69.2546 3.63781 83.6051     12.2851  91.1753     12.7841  47.5378    31.4705     0.0681444   211.471     
1 1 1 30 6  43 f 0  33.5051 5.74958 19.4067     8.97716  24.3939     10.162   27.9237    285.675     0           0           
1 1 1 30 6  44 o 2  103.674 3.09892 199.144     15.8861  189.211     16.2228  71.9945    278.191     0.733202    98.1907     
1 1 1 30 6  45 o 11 32.5413 5.63735 23.6811     8.88547  17.565      9.4825   13.1581    253.522     13.5079     73.5221     
1 1 1 30 6  46 o 9  94.944  3.14221 171.092     14.2439  155.363     15.4561  65.2896    231.037     1.0673      51.0367     
1 1 1 30 6  47 o 5  78.2028 3.32229 106.408     12.5607  116.054     13.3639  47.2173    42.6919     13.2206     222.692     
1 1 1 30 6  48 o 8  41.027  5.04508 30.1337     9.33279  34.3325     10.6695  21.0719    106.201     11.1929     286.201     
1 1 1 30 6  49 o 10 32.617  5.75555 30.1431     9.4796   11.5184     10.4757  21.0466    263.635     10.3952     263.635     
1 1 1 30 6  50 o 7  77.8153 3.41419 112.86      12.4088  108.531     13.9931  70.7797    93.331      36.132      93.331      
1 1 1 30 6  51 o 9  59.7548 3.97893 73.6117     10.6518  59.4342     12.4378  44.54      187.62      8.81298     187.62      
1 1 1 30 6  52 o 1  32.0274 6.20071 19.0653     9.69149  22.6378     10.8059  17.592     303.691     3.99386     123.691     
1 1 1 30 6  53 f 0  22.3726 6.00494 7.2005      8.5414   8.91512     10.0029  14.6376    300.292     0           0           
1 1 1 30 6  54 o 9  25.427  6.27984 11.1189     9.46352  13.5763     10.2396  13.1717    334.485     1.44808     334.485     
1 1 1 30 6  55 o 10 23.0067 6.02615 0.489074    9.46556  15.7034     10.3295  6.33697    346.425     13.2379     166.425     
1 1 1 30 6  56 o 17 58.5336 4.48529 77.2565     12.3707  54.887      12.9684  37.2137    36.3083     3.40244     216.308     
1 1 1 30 6  57 o 18 27.8838 5.38743 30.3627     9.9184   -5.81564    10.8383  13.7582    73.2068     4.69648     253.207     
1 1 1 30 6  58 f 0  32.6861 6.42498 16.4663     10.6201  29.2562     11.6516  20.5752    319.185     0           0           
1 1 1 30 6  59 o 14 46.5302 5.40572 46.3417     10.9965  40.694      13.0377  28.3248    309.04      2.91378     129.04      
1 1 1 30 6  60 o 12 24.3959 6.21244 6.95446     9.04777  15.9066     10.6594  6.99336    321.514     11.8412     141.514     
1 1 1 30 6  61 f 0  57.9968 4.41927 63.5163     12.3737  66.2931     12.9113  45.9467    326.993     0           0           
1 1 1 30 6  62 o 16 34.7157 6.31454 18.9137     10.6718  32.9356     11.8235  21.3412    6.50667     1.16433     6.50666     
1 1 1 30 6  63 o 7  54.7323 5.59676 56.0647     12.6561  65.5391     17.0106  37.4247    7.4715      4.2099      7.47149     
1 1 1 30 6  64 o 2  30.9268 7.35991 17.4287     13.1031  25.508      14.0753  20.0082    8.59435     9.65366     8.59435     
1 1 1 30 6  65 o 19 27.0744 7.20768 17.2245     11.9955  12.4383     15.219   8.44087    311.045     14.7351     131.045     
1 1 1 30 6  66 o 10 18.8173 6.14091 -1.53373    13.9478  -7.38266    13.083   3.90531    323.304     5.25122     143.304     
1 1 1 30 6  67 o 17 41.339  7.76127 59.6424     16.7067  25.6727     19.8222  22.3928    286.832     5.57114     106.832     
1 1 1 30 6  68 f 0  24.4147 6.93506 6.00623     15.2538  15.5718     11.9226  3.72692    117.113     0           0           
1 1 1 30 6  69 o 18 22.0953 7.07453 14.3746     20.158   -3.76923    12.3788  4.37379    11.5493     5.91933     191.549     
1 1 1 30 6  70 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 7  0  o 6  10.1845 4.85458 -3.19229    7.15109  -3.19229    7.15109  5.82622    2.3473e-05  12.3199     2.3473e-05  
1 1 1 30 7  1  o 18 43.8726 4.03203 32.6127     8.81978  37.3102     8.41231  12.7873    236.258     16.475      56.2575     
1 1 1 30 7  2  o 8  167.06  2.50307 491.033     20.9243  500.835     20.9866  133.712    50.0965     22.7828     50.0966     
1 1 1 30 7  3  o 1  165.242 2.49161 490.891     20.6544  479.499     20.6098  117.559    263.726     7.3616      83.7256     
1 1 1 30 7  4  o 14 72.3056 2.85457 92.229      10.2718  94.3157     10.333   28.2263    306.802     43.5205     126.802     
1 1 1 30 7  5  o 2  88.5534 2.71353 146.862     12.2443  132.677     11.7783  61.7917    17.7208     0.686577    17.7209     
1 1 1 30 7  6  o 7  46.8468 3.70234 39.3605     8.5458   39.87       8.54073  7.3474     97.0133     75.9673     97.0133     
1 1 1 30 7  7  o 2  78.3    2.79362 105.823     10.9457  112.853     10.8969  52.7548    119.125     0.644205    299.125     
1 1 1 30 7  8  o 11 99.7251 2.54299 174.302     12.7047  179.703     12.6687  50.6825    268.528     41.5015     88.5282     
1 1 1 30 7  9  o 13 95.9536 2.70019 162.175     12.8821  165.795     13.0345  48.8813    261.709     39.181      81.7093     
1 1 1 30 7  10 o 7  145.753 2.60009 376.71      18.3115  378.93      19.6348  127.639    266.604     44.3867     266.604     
1 1 1 30 7  11 o 15 156.827 2.47957 443.008     19.4079  431.349     19.5623  152.789    117.744     79.0377     117.744     
1 1 1 30 7  12 o 14 22.8936 5.4147  7.76047     7.37851  9.96836     7.27981  9.84631    141.301     30.6125     141.301     
1 1 1 30 7  13 o 5  88.1841 2.81058 128.475     12.4727  149.217     12.2306  83.3516    66.0526     55.1896     66.0526     
1 1 1 30 7  14 o 10 105.206 2.80507 200.218     14.2863  194.307     15.2075  74.1547    249.601     1.45396     69.6012     
1 1 1 30 7  15 o 5  125.564 2.77806 289.973     17.7194  271.901     17.1989  95.1982    285.984     9.574       285.984     
1 1 1 30 7  16 o 19 44.4515 4.50895 36.7261     9.78655  35.5321     9.72635  4.76129    226.632     0.952481    226.632     
1 1 1 30 7  17 o 6  28.4032 5.73809 12.9292     8.92613  16.8159     8.34859  27.8853    177.103     88.8484     177.103     
1 1 1 30 7  18 o 1  82.9047 3.08757 123.396     12.8515  122.314     12.7139  74.2036    202.39      39.5418     202.39      
1 1 1 30 7  19 o 2  112.023 2.9059  222.466     15.9054  225.321     16.6619  72.5354    109.649     15.5817     289.649     
1 1 1 30 7  20 o 11 53.4192 3.74215 54.4543     9.66951  48.6943     10.0452  16.5703    26.5462     36.8815     206.546     
1 1 1 30 7  21 o 17 12.9408 4.27739 -6.79359    6.61503  -6.40349    7.13347  14.107     240.325     31.7719     240.325     
1 1 1 30 7  22 o 18 57.039  3.78466 59.8941     10.8626  57.638      10.5222  37.82      89.9385     9.42597     89.9385     
1 1 1 30 7  23 o 18 28.9995 5.22093 7.25612     8.07055  24.1367     8.25652  3.5529     176.016     30.0571     176.016     
1 1 1 30 7  24 o 18 56.3219 3.67144 56.2929     10.4058  58.2881     10.0737  33.2454    278.117     3.30792     98.1174     
1 1 1 30 7  25 o 14 108.794 2.96385 222.66      14.7005  200.76      17.2771  80.5627    153.83      7.13259     153.83      
1 1 1 30 7  26 o 7  167.605 2.74087 515.193     23.037   486.992     22.9936  143.737    229.47      45.7646     229.47      
1 1 1 30 7  27 o 7  131.487 2.66471 300.623     16.9833  316.558     18.1001  100.908    131.289     13.5008     131.289     
1 1 1 30 7  28 o 10 26.0323 5.94058 10.4042     9.00595  13.7473     8.73975  0.713265   34.1932     15.4612     34.1932     
1 1 1 30 7  29 o 16 117.423 2.93174 250.436     16.9667  242.913     17.4683  89.0026    0.23205     10.3736     0.23205     
1 1 1 30 7  30 o 8  67.2914 3.67061 76.1185     11.4122  87.697      13.1681  47.1685    342.332     2.34794     342.332     
1 1 1 30 7  31 o 12 17.87   5.42462 -6.36856    8.16632  4.295       9.75666  5.62029    199.519     21.9509     199.519     
1 1 1 30 7  32 o 4  67.9436 3.79582 83.3934     11.7813  83.835      13.773   59.3791    350.638     26.0514     350.638     
1 1 1 30 7  33 o 5  122.313 2.90849 262.801     17.5575  273.363     18.0487  95.9677    356.852     16.8743     356.852     
1 1 1 30 7  34 o 1  128.018 3.00029 283.738     18.6657  304.467     19.783   120.411    113.14      58.4192     113.14      
1 1 1 30 7  35 o 7  145.252 2.80554 351.535     19.7082  405.531     21.0947  109.111    264.283     10.0929     264.283     
1 1 1 30 7  36 o 14 120.227 3.03816 250.339     18.4264  269.407     18.0912  83.3224    324.684     4.79977     144.684     
1 1 1 30 7  37 o 10 45.2203 4.71624 38.2437     10.096   38.0605     10.6283  36.5919    231.253     22.1182     231.253     
1 1 1 30 7  38 o 14 159.279 2.74076 449.409     21.4886  460.363     22.2655  150.325    35.6535     73.9745     35.6535     
1 1 1 30 7  39 o 2  81.996  3.14056 113.59      12.4859  129.522     13.2236  55.5021    62.3691     3.8365      242.369     
1 1 1 30 7  40 o 15 40.0849 4.85858 23.8461     8.8022   37.6241     9.94302  25.3147    55.3599     0.143385    55.3608     
1 1 1 30 7  41 f 0  47.5779 4.29521 41.6        9.42487  42.4759     10.5602  24.6982    238.238     0           0           
1 1 1 30 7  42 o 3  50.9454 4.24287 38.7578     9.52983  58.4978     11.6993  38.7071    312.601     10.2775     312.601     
1 1 1 30 7  43 o 16 68.8125 3.72823 91.7508     11.3699  81.5803     13.8029  52.3167    306.123     10.2979     306.123     
1 1 1 30 7  44 o 10 66.3171 3.83746 85.8834     10.9087  75.5856     13.8874  56.7353    99.9665     23.7423     99.9665     
1 1 1 30 7  45 o 5  70.4635 3.75049 93.5736     11.6125  88.4096     14.3995  43.7918    228.877     9.51653     48.8768     
1 1 1 30 7  46 o 9  71.6515 3.86109 95.2715     11.9537  93.4425     15.2789  43.5712    33.8327     11.6137     213.833     
1 1 1 30 7  47 o 4  48.0803 4.55087 40.8721     9.37256  46.2274     11.9552  44.3527    143.437     30.0893     143.437     
1 1 1 30 7  48 o 11 14.7915 4.81468 -5.23803    7.5653   -5.10075    8.82884  0.191274   55.4246     4.76332     55.4246     
1 1 1 30 7  49 o 15 20.4186 5.62796 10.0878     8.5817   -1.89141    9.23     5.81773    151.317     6.68869     331.317     
1 1 1 30 7  50 o 15 16.9029 5.05463 6.39704     7.95571  -12.6886    8.93522  1.10098    152.703     12.5304     332.703     
1 1 1 30 7  51 o 13 24.2234 6.13782 6.9018      8.8408   14.289      10.2881  11.3169    4.33545     1.55572     184.335     
1 1 1 30 7  52 o 6  53.2972 4.21138 53.5897     10.5651  53.8358     11.5195  32.5538    52.0785     6.51583     232.078     
1 1 1 30 7  53 o 16 21.5141 5.8677  3.07194     8.27126  11.021      9.89591  6.31632    98.0763     10.2634     278.076     
1 1 1 30 7  54 o 15 26.7313 6.24122 11.1611     9.05648  17.7884     10.4898  13.1624    236.69      3.86537     56.6896     
1 1 1 30 7  55 o 10 28.6148 6.04693 22.2207     9.24504  10.7601     10.4669  6.86536    193.313     21.9333     13.3135     
1 1 1 30 7  56 o 5  27.6853 6.12771 23.251      10.0056  6.66377     10.6815  5.4601     46.076      3.17873     46.076      
1 1 1 30 7  57 o 4  26.3909 6.42816 10.894      9.93256  17.3057     10.8351  12.5642    73.283      1.90378     253.283     
1 1 1 30 7  58 o 7  36.1907 6.46233 29.0503     11.7463  27.1034     11.7044  21.8716    142.19      15.1647     142.19      
1 1 1 30 7  59 o 19 60.8709 4.43992 73.4556     12.7823  69.6474     13.834   38.6736    169.162     2.79325     349.162     
1 1 1 30 7  60 o 9  71.7495 3.80377 96.1197     12.8303  98.0917     14.2888  47.1299    119.787     0.949471    299.788     
1 1 1 30 7  61 o 3  20.6649 6.00701 9.38217     9.99746  -1.78449    10.9381  6.56054    248.284     6.14825     68.2845     
1 1 1 30 7  62 o 12 19.9892 5.97981 -1.1144     9.50637  7.77742     11.3462  4.25423    167.687     12.2456     347.687     
1 1 1 30 7  63 o 14 30.4798 7.4073  19.5632     11.9946  22.5423     15.4343  17.6589    184.796     0.659356    184.796     
1 1 1 30 7  64 o 12 39.1992 7.93792 41.1171     17.682   33.6103     15.1106  29.0622    177.418     12.03       177.418     
1 1 1 30 7  65 o 13 38.0276 7.55809 26.0065     16.7292  43.8573     14.7916  19.4557    149.966     7.66922     329.966     
1 1 1 30 7  66 o 18 28.6117 7.59783 11.9815     16.6149  25.4491     14.4384  13.6795    114.654     2.33905     294.655     
1 1 1 30 7  67 o 1  20.7352 6.65122 4.35533     15.9284  -2.13872    13.9223  2.12458    57.2189     1.6196      237.219     
1 1 1 30 7  68 f 0  56.2117 6.85027 86.3874     19.4417  61.8561     17.6626  21.1361    203.161     0           0           
1 1 1 30 7  69 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 8  0  o 3  84.9608 2.92145 129.102     12.3714  129.102     12.3714  90.6934    180         57.9337     180         
1 1 1 30 8  1  f 0  172.141 2.76048 544.741     24.8423  510.101     22.7892  106.087    100.323     0           0           
1 1 1 30 8  2  o 14 48.0883 3.95569 40.716      9.61471  43.0494     9.058    16.7196    245.336     24.766      65.3365     
1 1 1 30 8  3  o 18 232.063 2.77573 971.338     32.2438  945.419     32.3123  182.699    59.3343     21.0806     59.3343     
1 1 1 30 8  4  o 15 135.002 2.63218 319.227     17.3923  329.698     18.1903  131.757    129.507     69.5377     129.507     
1 1 1 30 8  5  o 19 28.4778 5.25357 6.79807     7.96598  23.1697     8.31341  1.91816    10.603      16.2956     10.603      
1 1 1 30 8  6  f 0  154.899 2.81178 424.227     22.3552  430.233     21.2547  87.6013    350.778     0           0           
1 1 1 30 8  7  o 11 136.07  2.82346 333.949     18.722   325.821     19.715   118.881    256.687     40.5383     256.687     
1 1 1 30 8  8  o 17 104.264 2.79148 190.723     14.5629  196.867     14.5528  84.4183    107.362     20.6637     107.362     
1 1 1 30 8  9  o 16 62.0156 3.53291 69.7757     11.2423  68.4161     10.5251  45.2688    309.742     21.2658     309.742     
1 1 1 30 8  10 o 2  54.3163 4.24053 57.3835     12.1022  49.7057     10.614   33.5382    133.304     7.4892      133.304     
1 1 1 30 8  11 o 6  152.154 2.90246 410.262     22.616   415.102     21.5876  101.265    282         20.7593     102         
1 1 1 30 8  12 o 4  122.093 3.01494 269.696     19.3054  262.32      17.5098  83.3953    49.8003     10.4202     229.8       
1 1 1 30 8  13 o 4  48.3911 4.39263 42.8183     10.6017  42.5461     10.2091  24.7649    282.358     2.96013     102.358     
1 1 1 30 8  14 o 15 48.3019 4.64643 52.8106     11.5126  33.6347     10.1944  10.6093    61.5444     41.1896     241.544     
1 1 1 30 8  15 o 16 82.6903 3.34129 120.781     13.8271  124.218     13.7464  71.718     155.712     32.3543     155.712     
1 1 1 30 8  16 o 9  43.8626 4.40616 31.0353     9.41227  39.683      9.26294  13.6723    6.10572     86.0083     6.10572     
1 1 1 30 8  17 o 5  56.1325 3.55731 52.2771     9.57721  61.5071     10.2143  35.4729    83.2051     2.85143     83.2051     
1 1 1 30 8  18 o 9  42.5048 4.28532 39.4899     8.76557  27.2495     8.71719  14.0582    128.064     0.391089    128.064     
1 1 1 30 8  19 o 11 33.0036 5.22183 20.9395     8.15477  19.9891     8.68781  0.549218   234.205     30.5865     54.2047     
1 1 1 30 8  20 o 15 62.1367 3.24732 68.0064     10.0171  70.7538     10.0615  37.1531    170.997     7.43816     350.997     
1 1 1 30 8  21 o 1  46.8928 4.0339  36.2056     9.41392  44.1038     9.00915  9.15392    278.651     41.9722     98.6513     
1 1 1 30 8  22 o 11 22.5589 5.72947 2.33898     8.14743  12.4848     9.04166  6.85412    337.471     24.4055     337.471     
1 1 1 30 8  23 f 0  112.241 2.75349 226.578     15.9022  223.441     15.0195  78.2404    312.746     0           0           
1 1 1 30 8  24 o 7  101.252 3.02341 197.014     15.1255  170.485     15.4027  50.1351    40.8315     45.1454     220.831     
1 1 1 30 8  25 o 11 141.799 3.03069 379.147     22.5709  340.876     20.4674  116.183    307.367     27.3698     307.367     
1 1 1 30 8  26 o 3  31.6664 5.95431 20.8043     9.20956  17.1795     10.1116  5.08008    175.513     23.6278     355.513     
1 1 1 30 8  27 o 17 115.152 3.05021 228.194     16.5334  247.128     18.608   101.078    306.695     37.245      306.695     
1 1 1 30 8  28 o 19 30.0187 5.94314 12.5252     9.09626  21.6551     9.80445  8.38587    78.0488     15.4176     258.049     
1 1 1 30 8  29 f 0  78.2931 3.41402 105.869     13.4376  115.14      13.1906  74.471     59.2365     0           0           
1 1 1 30 8  30 o 7  75.0617 3.19088 96.5175     11.1415  106.421     12.7555  53.3135    341.374     0.633154    341.374     
1 1 1 30 8  31 o 18 86.9966 3.19882 134.399     12.5662  138.012     15.1347  55.9344    155.249     12.2498     335.249     
1 1 1 30 8  32 o 1  117.317 2.79674 243.28      15.3899  250.135     17.4095  77.6406    160.722     13.5116     340.722     
1 1 1 30 8  33 o 10 17.8077 5.22706 -0.787207   7.33945  4.05659     8.13193  5.60983    301.848     26.3469     301.848     
1 1 1 30 8  34 o 10 62.4533 3.38563 71.3481     10.2984  70.0059     10.7222  53.4795    229.409     22.0275     229.409     
1 1 1 30 8  35 o 7  152.587 2.73129 413.696     20.5522  421.541     21.1848  136.43     33.241      53.9978     33.241      
1 1 1 30 8  36 o 2  93.1133 3.1281  151.841     14.6069  161.086     14.4886  76.1356    160.541     20.6942     160.541     
1 1 1 30 8  37 o 14 75.7715 3.19701 103.037     12.1323  104.698     12.0351  61.0731    299.353     16.4736     299.353     
1 1 1 30 8  38 o 10 108.771 2.77202 208.597     14.8418  216.981     15.3306  94.6354    170.654     35.3291     170.654     
1 1 1 30 8  39 o 3  53.4444 3.93321 60.1898     10.0933  45.4254     10.4084  32.0121    203.968     8.9664      23.9677     
1 1 1 30 8  40 o 11 89.9194 2.99944 146.565     13.2428  145.504     13.707   60.049     157.439     6.57016     337.439     
1 1 1 30 8  41 o 6  60.0529 3.60983 68.8245     10.2647  63.1591     11.1696  49.4758    342.824     17.6331     342.824     
1 1 1 30 8  42 o 19 56.0845 3.71273 51.0554     9.78108  64.821      10.8287  35.1072    204.791     6.41725     24.7913     
1 1 1 30 8  43 o 4  87.9815 2.98805 146.022     12.4719  134.133     13.6937  61.0429    22.6606     0.987262    202.661     
1 1 1 30 8  44 o 18 46.8913 4.66881 34.0913     10.0826  49.5645     11.1077  42.5586    318.557     29.397      318.557     
1 1 1 30 8  45 o 9  22.5261 5.90059 10.8908     8.6818   4.46921     9.45283  5.34223    262.058     38.4702     262.058     
1 1 1 30 8  46 o 14 82.9769 3.35529 119.961     13.2639  131.554     14.5315  61.2697    196.718     7.30628     196.718     
1 1 1 30 8  47 o 9  28.5464 5.85262 8.07499     8.88793  24.0344     9.93004  12.1289    87.0332     7.09793     87.0332     
1 1 1 30 8  48 o 16 31.8805 6.32339 17.269      9.8475   24.2512     11.2627  18.8214    93.9812     1.42722     273.981     
1 1 1 30 8  49 o 1  27.3237 6.23659 10.0788     8.56791  19.9333     11.1013  13.7551    281.425     4.41129     101.425     
1 1 1 30 8  50 o 14 22.9492 5.93337 -2.89704    8.51071  18.5454     11.2408  6.208      243.497     14.2601     63.4971     
1 1 1 30 8  51 o 13 20.2613 5.92177 3.56249     8.32428  5.05362     11.1789  3.20294    100.047     0.0230606   280.047     
1 1 1 30 8  52 o 15 31.1027 6.43828 11.1015     9.48203  30.557      12.7304  10.5736    307.922     18.389      127.922     
1 1 1 30 8  53 o 3  45.3931 5.05532 43.0974     10.3719  38.2692     11.6863  31.9212    356.536     4.52907     356.536     
1 1 1 30 8  54 o 17 31.2339 6.35671 21.9185     9.78714  19.2374     11.3422  19.2251    45.6133     1.98397     45.6133     
1 1 1 30 8  55 o 5  50.3984 4.64882 45.852      10.9001  53.1884     12.0321  29.8775    275.518     6.89365     95.5175     
1 1 1 30 8  56 o 4  55.0086 4.42634 57.5951     11.2113  59.3355     12.7126  40.3005    267.491     8.37878     267.491     
1 1 1 30 8  57 o 17 23.1213 6.06493 15.0611     9.43108  0.82277     11.0684  7.9541     47.0252     4.42029     227.025     
1 1 1 30 8  58 o 14 37.8187 6.72339 32.49       12.9219  29.7915     12.5408  28.2962    19.9307     12.7715     19.9307     
1 1 1 30 8  59 o 10 47.5461 5.81623 66.4965     12.403   29.1047     13.1592  33.7673    312.291     6.42446     312.291     
1 1 1 30 8  60 o 18 31.7926 6.48101 33.1003     11.9404  9.57401     12.2102  12.7152    273.225     14.1913     93.2245     
1 1 1 30 8  61 o 9  34.3393 7.37361 28.2484     15.3295  25.7982     12.3583  22.7309    27.1516     4.79293     27.1516     
1 1 1 30 8  62 o 11 26.1903 7.25043 21.3736     15.1058  4.38895     13.5224  8.46892    0.208819    13.7025     180.209     
1 1 1 30 8  63 o 1  23.8307 6.74941 24.4207     15.3593  -14.7828    13.1163  10.3737    84.473      1.21893     84.473      
1 1 1 30 8  64 o 1  17.591  5.98105 -34.8328    17.7615  -4.33627    14.906   2.09084    317.982     5.20365     137.982     
1 1 1 30 8  65 o 4  33.0797 8.09918 28.1393     16.1996  29.9896     16.5233  18.5384    182.681     0.543758    182.681     
1 1 1 30 8  66 o 7  16.815  5.66346 -3.86623    14.5954  -12.1423    10.9735  0.24743    28.7124     3.66858     208.712     
1 1 1 30 8  67 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 8  68 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 9  0  o 16 22.9713 7.22723 13.674      8.80485  13.674      8.80485  9.32945    2.21016e-05 33.1947     2.21016e-05 
1 1 1 30 9  1  o 15 148.607 2.96226 397.401     22.5653  390.544     21.5073  99.2713    286.997     20.5666     106.996     
1 1 1 30 9  2  o 6  116.964 2.90291 232.402     17.7958  256.091     16.0139  89.7244    136.938     9.72256     136.938     
1 1 1 30 9  3  o 8  30.2713 5.50907 11.8125     8.90672  22.3809     8.38739  0.682406   57.6391     5.4622      237.639     
1 1 1 30 9  4  o 17 150.155 2.73732 405.908     21.0732  397.808     20.085   148.67     278.755     78.6901     278.755     
1 1 1 30 9  5  o 2  88.7522 3.10235 148.2       13.7474  133.689     13.7357  67.3963    150.88      9.75406     150.88      
1 1 1 30 9  6  o 14 107.22  2.95006 199.204     16.1112  211.413     15.4949  92.412     200.997     31.6618     200.997     
1 1 1 30 9  7  o 4  132.069 2.87279 326.508     20.4055  296.238     17.574   96.8948    266.154     0.630892    266.154     
1 1 1 30 9  8  o 14 51.0221 4.31891 39.6923     11.118   55.7747     9.93606  18.8888    256.603     28.2887     76.603      
1 1 1 30 9  9  o 6  126.417 2.78868 284.13      17.7416  286.037     17.5481  113.372    92.8371     44.0089     92.8371     
1 1 1 30 9  10 o 13 78.9379 3.16682 114.837     12.6312  108.413     12.3204  25.6586    14.3601     61.6068     194.36      
1 1 1 30 9  11 o 10 111.482 2.77607 215.92      15.9182  227.752     15.0044  98.7142    52.8912     38.1381     52.8912     
1 1 1 30 9  12 o 4  101.232 2.79542 174.705     13.6985  191.438     14.615   75.6111    145.047     6.39444     145.047     
1 1 1 30 9  13 o 15 95.6166 2.63467 167.214     12.4372  159.126     12.7478  90.9144    87.5259     50.0926     87.5259     
1 1 1 30 9  14 o 13 18.0776 5.1314  2.71032     7.07491  3.12135     7.10897  13.4026    268.96      35.4696     268.96      
1 1 1 30 9  15 o 16 92.8014 2.70391 161.186     12.7483  146.576     12.3422  59.8881    43.7813     12.539      223.781     
1 1 1 30 9  16 o 19 119.458 2.57388 252.944     14.9753  256.125     15.7995  120.802    302.502     72.7159     302.502     
1 1 1 30 9  17 o 14 57.5158 3.30943 66.6336     9.32233  52.8853     9.46319  25.4887    299.68      25.8945     119.68      
1 1 1 30 9  18 o 1  42.5694 4.09675 27.1733     8.37431  39.7492     8.36567  17.8086    257.709     1.20751     257.709     
1 1 1 30 9  19 o 17 23.0902 5.40057 11.7912     7.35864  6.43098     7.45896  4.54776    47.7203     20.6739     47.7203     
1 1 1 30 9  20 o 2  73.2942 3.12147 99.1052     11.8742  93.7507     10.9503  27.3179    334.635     49.4364     154.635     
1 1 1 30 9  21 o 10 104.964 2.99907 197.626     15.6122  196.888     15.8725  88.901     110.876     27.62       110.876     
1 1 1 30 9  22 o 12 44.4083 4.43074 34.7276     9.73968  37.8977     9.3941   20.3494    60.6194     11.1959     60.6194     
1 1 1 30 9  23 o 13 35.1141 5.45835 22.1782     9.19272  24.5627     9.49826  4.21216    219.873     35.9556     39.8731     
1 1 1 30 9  24 o 16 34.6397 5.74689 19.0569     10.2371  26.6792     9.49754  15.7416    7.52128     6.5321      187.521     
1 1 1 30 9  25 o 4  113.804 2.75283 228.275     15.385   235.181     15.9691  107.597    102.056     51.0121     102.056     
1 1 1 30 9  26 o 5  49.1542 4.09096 47.3229     9.92914  41.2231     9.80329  26.851     149.089     13.6697     329.089     
1 1 1 30 9  27 o 1  75.1456 3.09567 101.528     11.1106  101.631     12.0823  64.2292    159.572     22.5919     159.572     
1 1 1 30 9  28 o 14 30.3008 5.27841 17.3878     7.96789  17.6162     7.95657  3.26825    202.558     31.9682     22.5576     
1 1 1 30 9  29 o 1  42.9086 4.34421 34.9723     8.78084  33.202      9.33519  33.0428    231.939     14.2753     231.939     
1 1 1 30 9  30 o 10 19.0087 5.34142 5.93959     7.48672  0.938372    8.00983  0.151815   152.676     9.53755     152.676     
1 1 1 30 9  31 o 13 113.633 2.83649 225.206     15.3005  238.552     16.9486  91.1867    268.755     18.7825     268.755     
1 1 1 30 9  32 o 14 20.0358 5.48223 5.85717     7.47626  4.30331     8.24089  0.485148   156.797     13.714      336.797     
1 1 1 30 9  33 o 2  22.2442 5.64352 6.4698      7.54767  9.74034     8.48612  0.87784    242.126     21.0171     62.126      
1 1 1 30 9  34 o 11 82.4643 2.98565 121.293     12.0686  124.01      12.526   57.5922    352.886     1.92757     172.886     
1 1 1 30 9  35 o 11 115.285 2.74565 238.38      14.9025  239.462     16.7258  81.6963    196.004     1.9232      16.0036     
1 1 1 30 9  36 o 16 61.9432 3.536   70.3709     10.0691  69.5642     11.62    43.6382    296.157     1.2637      296.157     
1 1 1 30 9  37 o 11 61.716  3.4793  66.9365     10.1629  72.0071     11.1824  41.5976    178.98      2.56199     358.98      
1 1 1 30 9  38 o 15 71.6782 3.22376 84.9865     10.9861  101.882     12.0542  44.9417    37.7925     10.8522     217.792     
1 1 1 30 9  39 o 14 38.487  5.06156 25.6593     9.09805  31.1609     9.70971  19.2173    89.7893     12.0291     269.789     
1 1 1 30 9  40 o 1  63.5149 3.62356 68.4671     11.41    79.4238     11.4055  64.6651    75.7363     45.569      75.7363     
1 1 1 30 9  41 o 13 102.795 2.92581 185.835     15.1441  196.139     14.9227  76.2869    122.286     7.26536     122.286     
1 1 1 30 9  42 o 7  45.5861 4.74593 42.5096     10.2112  36.295      10.7074  22.9242    340.486     15.9189     160.486     
1 1 1 30 9  43 o 15 49.1143 4.49279 43.5132     10.4571  47.2709     11.1453  21.0161    229.31      25.3918     49.3103     
1 1 1 30 9  44 o 13 100.878 3.04937 184.563     14.4411  184.976     16.2612  84.9268    59.9768     28.2656     59.9768     
1 1 1 30 9  45 o 15 64.7089 3.83149 71.1504     11.3842  84.2268     13.2582  47.8683    181.825     6.34193     181.825     
1 1 1 30 9  46 f 0  20.3928 5.66021 9.432       8.34962  -1.17322    9.63708  22.9695    127.204     0           0           
1 1 1 30 9  47 o 6  49.3711 4.5923  42.8094     10.1759  50.4902     12.015   38.6368    351.778     11.1589     351.778     
1 1 1 30 9  48 o 17 33.9481 5.84947 29.9089     9.46486  16.9415     10.8068  22.3049    312.058     2.01526     312.058     
1 1 1 30 9  49 o 15 59.3977 4.14221 66.7903     11.6622  66.5808     12.6461  44.1882    11.3399     7.46407     11.3399     
1 1 1 30 9  50 o 11 18.8472 5.53458 7.18395     8.47992  -4.37255    9.85693  4.39735    33.2621     2.67234     213.262     
1 1 1 30 9  51 o 2  28.686  6.13771 21.7487     9.34697  11.604      10.7024  16.5871    212.107     0.0589032   32.1071     
1 1 1 30 9  52 o 14 22.0877 6.06621 4.83517     8.83327  10.9059     10.4956  5.96101    171.002     12.4464     351.002     
1 1 1 30 9  53 o 17 28.6671 6.59992 10.3956     9.44245  24.9986     12.7538  9.68601    97.7185     15.8187     277.719     
1 1 1 30 9  54 o 10 20.7292 6.08638 7.08732     9.00509  0.683674    12.4553  5.50576    293.267     6.5148      113.267     
1 1 1 30 9  55 o 4  80.8878 3.75499 116.131     13.4635  130.641     16.7626  41.1018    136.497     27.8633     316.497     
1 1 1 30 9  56 o 16 40.4638 5.99995 29.9415     10.2967  38.9446     13.2928  25.3577    127.922     0.559059    307.923     
1 1 1 30 9  57 o 16 35.3225 6.48333 28.8472     10.2679  24.7973     13.1825  21.5682    243.988     0.352315    63.9884     
1 1 1 30 9  58 o 10 28.896  6.91374 20.4396     12.0855  15.354      11.8539  15.4978    207.446     8.99438     207.446     
1 1 1 30 9  59 o 11 48.2541 5.72781 56.4061     13.5885  40.1114     12.9665  33.9323    67.422      5.17489     67.422      
1 1 1 30 9  60 o 4  31.7127 7.1465  36.4026     14.9847  9.05114     12.9142  18.5549    174.288     0.677486    354.288     
1 1 1 30 9  61 o 18 24.7424 7.09933 15.9253     14.766   5.83776     12.9207  7.76489    285.882     3.41954     285.882     
1 1 1 30 9  62 o 16 38.7542 8.06126 39.938      16.5031  35.8386     16.9869  25.173     127.945     3.29442     127.945     
1 1 1 30 9  63 o 8  24.293  6.98763 23.1324     14.9678  -11.2979    15.9221  5.39466    225.514     1.36931     225.514     
1 1 1 30 9  64 o 11 30.4047 7.67586 46.0882     19.4831  3.26944     12.8413  16.4058    330.099     4.19206     330.099     
1 1 1 30 9  65 o 7  24.0828 6.81975 -7.5807     17.2011  20.4388     12.5861  2.98952    170.109     0.0488025   170.109     
1 1 1 30 9  66 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 10 0  o 17 85.0182 3.03916 129.542     12.8728  129.542     12.8728  93.7348    180         61.8833     180         
1 1 1 30 10 1  o 14 77.2909 3.09177 105.362     11.6969  108.72      12.1571  18.1815    130.489     75.0515     310.489     
1 1 1 30 10 2  o 17 113.961 2.66025 229.41      14.5864  234.074     15.7455  109.692    22.6669     56.4224     22.6669     
1 1 1 30 10 3  o 9  31.1959 5.56027 18.0233     8.60271  18.7209     8.77527  9.50889    62.0806     54.2237     62.0806     
1 1 1 30 10 4  o 11 42.598  4.64417 32.8186     9.67075  34.1098     9.51424  9.3078     295.087     34.0589     115.087     
1 1 1 30 10 5  o 17 79.8569 3.21737 118.47      13.2068  110.319     12.4418  52.5979    315.402     7.32384     135.402     
1 1 1 30 10 6  o 9  22.9781 5.5446  14.3631     8.38735  1.19528     8.26872  5.44206    93.9203     20.9826     93.9203     
1 1 1 30 10 7  o 7  67.7741 3.24526 81.6754     11.2043  83.3328     10.6974  33.5312    129.791     27.3596     309.791     
1 1 1 30 10 8  o 9  16.9698 5.13627 -1.20707    8.25093  0.835124    7.35279  26.0456    243.358     64.6214     243.358     
1 1 1 30 10 9  f 0  124.502 2.65223 273.058     16.3237  280.209     16.7355  107.747    174.343     0           0           
1 1 1 30 10 10 o 19 80.8798 2.86388 124.64      11.4707  109.699     11.6231  55.7595    153.207     2.24673     333.207     
1 1 1 30 10 11 o 17 100.703 2.7394  189.424     13.7273  173.12      13.8432  80.5193    7.86112     16.6831     7.86112     
1 1 1 30 10 12 o 4  93.5332 2.78669 152.757     13.23    160.081     12.8166  69.3821    332.156     4.93558     332.156     
1 1 1 30 10 13 o 13 131.527 2.53068 317.316     16.9215  300.005     16.4094  109.032    279.44      25.8752     279.44      
1 1 1 30 10 14 o 13 20.3489 5.49376 4.49113     7.78239  6.21754     7.83187  3.24749    218.294     11.9033     218.294     
1 1 1 30 10 15 o 4  73.2104 3.24966 101.809     12.8245  90.9921     10.9009  54.9086    154.641     7.88363     154.641     
1 1 1 30 10 16 o 8  97.26   2.98509 166.752     15.4142  172.119     13.5152  80.5911    144.89      21.4903     144.89      
1 1 1 30 10 17 o 6  42.2739 4.79369 34.8164     10.3538  31.5602     9.27622  22.3851    149.401     9.45845     149.401     
1 1 1 30 10 18 o 11 86.9912 3.23252 148.474     15.2239  123.963     12.8891  80.8613    218.117     38.7613     218.117     
1 1 1 30 10 19 o 9  112.581 2.9957  220.237     17.726   234.051     15.8934  74.5423    172.748     15.6417     352.748     
1 1 1 30 10 20 o 1  28.1641 6.20009 14.8408     10.1211  14.5155     9.25453  1.73965    168.341     29.7805     348.341     
1 1 1 30 10 21 o 3  67.7059 3.32155 76.6021     11.2443  88.9149     11.091   43.5015    25.8182     9.767       205.818     
1 1 1 30 10 22 o 12 55.6231 3.68057 55.3334     10.7559  57.0259     9.44756  34.8123    81.6932     8.22056     261.693     
1 1 1 30 10 23 o 13 95.7659 3.01133 169.371     14.5439  160.038     14.2852  66.0558    135.291     7.09303     315.291     
1 1 1 30 10 24 o 16 87.2427 2.96409 150.773     13.0484  123.344     12.7231  77.2977    315.121     29.4969     315.121     
1 1 1 30 10 25 o 14 66.8156 3.12473 86.1346     10.52    75.0428     10.2647  53.3284    287.445     12.5336     287.445     
1 1 1 30 10 26 o 18 171.314 2.64673 540.447     23.6115  510.171     21.8359  154.155    307.94      57.5308     307.94      
1 1 1 30 10 27 o 14 43.2436 4.32408 37.8111     8.96428  31.6436     9.1634   8.71438    348.911     42.6635     168.911     
1 1 1 30 10 28 o 13 15.2679 4.77513 -0.670138   7.13418  -3.39435    7.33478  7.54686    79.3255     26.7262     79.3255     
1 1 1 30 10 29 o 13 65.4232 3.18893 75.2706     10.4854  79.62       10.2828  53.6892    100.353     15.8513     100.353     
1 1 1 30 10 30 o 5  44.5645 4.13859 41.6577     9.03891  32.1657     8.87608  37.0519    309.061     18.9883     309.061     
1 1 1 30 10 31 o 1  66.7124 3.42907 85.1014     11.079   76.7532     11.6269  44.2795    29.6502     5.80893     209.65      
1 1 1 30 10 32 o 1  38.3704 4.97574 29.7343     8.76615  26.2847     9.60534  21.7823    282.183     6.32423     102.183     
1 1 1 30 10 33 o 15 41.2917 4.87154 36.815      9.37252  27.9755     9.89274  12.2146    125.725     32.1076     305.725     
1 1 1 30 10 34 o 3  53.5058 3.98833 53.2875     9.73572  52.2926     11.2398  32.1896    156.731     9.85182     336.731     
1 1 1 30 10 35 o 8  91.8422 3.02269 156.7       13.3793  148.287     14.315   57.0365    11.242      17.3943     191.242     
1 1 1 30 10 36 o 17 22.3182 5.95951 7.17021     9.19041  7.7759      9.03357  0.119834   209.575     25.1315     29.5744     
1 1 1 30 10 37 o 19 48.1475 4.34377 43.7339     9.57684  42.8064     10.8332  36.0621    255.273     7.57075     255.273     
1 1 1 30 10 38 o 3  19.3899 5.4904  -1.98377    7.84507  8.55721     9.02374  2.39213    285.371     7.19964     105.371     
1 1 1 30 10 39 f 0  81.849  3.16025 117.319     12.3963  126.079     13.4344  55.7753    311.838     0           0           
1 1 1 30 10 40 o 14 51.9141 4.25757 56.3498     10.1861  44.5634     11.2075  40.7977    256.24      11.1931     256.24      
1 1 1 30 10 41 o 17 31.1413 5.86319 19.2741     8.65007  19.1992     10.0027  9.34661    308.338     21.8675     128.338     
1 1 1 30 10 42 o 13 40.5043 5.23809 25.3511     9.84058  39.0605     10.5677  26.3503    230.599     1.10224     50.5995     
1 1 1 30 10 43 o 3  55.8585 4.09298 50.9343     10.7713  66.2364     11.7569  48.9334    329.837     21.8242     329.837     
1 1 1 30 10 44 o 12 80.0421 3.41816 108.702     13.4052  127.113     13.8536  53.2012    310.299     6.00796     130.299     
1 1 1 30 10 45 o 7  50.945  4.67171 53.7705     10.7125  45.7608     12.2453  42.87      316.593     17.1688     316.593     
1 1 1 30 10 46 o 1  24.062  6.07144 14.6471     9.26496  5.3368      10.0295  9.59597    62.9173     8.75591     242.917     
1 1 1 30 10 47 o 18 26.6803 6.12808 16.8153     8.91885  11.2232     10.2644  15.8642    183.354     4.93983     183.354     
1 1 1 30 10 48 o 8  39.2858 5.54797 23.5603     10.1511  39.6755     10.958   23.8685    267.454     4.05215     87.4544     
1 1 1 30 10 49 o 16 25.1214 6.20877 12.2063     8.97169  12.5331     10.3028  7.84689    157.344     14.6865     337.344     
1 1 1 30 10 50 o 10 26.3653 6.0537  19.4287     9.14521  7.26395     10.5151  9.19461    343.648     13.7618     163.648     
1 1 1 30 10 51 o 12 19.3988 5.73893 5.22861     8.70891  1.04867     10.2299  4.76327    172.382     5.06372     352.382     
1 1 1 30 10 52 o 14 43.272  5.57102 55.1888     10.5961  23.4285     11.8732  33.2166    195.079     11.2177     195.079     
1 1 1 30 10 53 o 3  50.3463 4.9769  43.8987     11.8789  57.0285     12.4176  29.4527    356.558     8.13094     176.558     
1 1 1 30 10 54 o 18 19.4178 5.58318 -10.2984    8.78706  12.8797     10.4483  3.06059    268.27      12.164      88.2702     
1 1 1 30 10 55 o 2  25.0941 6.71478 3.63534     10.7426  19.6071     13.2436  9.20816    313.893     10.0491     133.893     
1 1 1 30 10 56 o 8  17.2793 5.54886 -1.77929    10.1937  -4.78092    10.7738  1.83588    169.164     1.57031     349.164     
1 1 1 30 10 57 o 13 25.4915 6.7926  5.38283     11.9956  18.6111     12.5423  11.9928    181.423     4.89135     1.42308     
1 1 1 30 10 58 o 8  34.1709 7.37535 15.2755     12.842   39.8594     15.9874  21.1352    333.268     0.416881    333.268     
1 1 1 30 10 59 o 11 30.3325 7.62065 6.74964     12.4327  37.4246     18.1984  19.1088    7.53741     4.25552     7.5374      
1 1 1 30 10 60 o 17 28.8484 7.64947 10.3194     15.223   27.2788     15.8298  4.38992    300.049     2.78727     300.049     
1 1 1 30 10 61 o 9  34.189  8.17238 19.0055     19.2768  40.9786     16.8724  22.8907    289.751     12.1285     289.751     
1 1 1 30 10 62 o 9  20.9153 6.57393 9.13352     15.4373  -2.02109    12.0429  4.73193    54.6205     3.33705     234.62      
1 1 1 30 10 63 o 18 26.4309 7.48904 20.7837     16.9013  12.9502     13.179   10.5665    177.862     3.89789     357.862     
1 1 1 30 10 64 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 10 65 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 11 0  o 1  16.9869 6.8696  6.79828     9.22475  6.79828     9.22475  29.2395    2.23118e-05 76.0955     2.23118e-05 
1 1 1 30 11 1  o 10 64.55   4.11191 72.8355     12.0192  78.4946     14.2651  35.2925    276.829     19.9969     96.829      
1 1 1 30 11 2  o 18 87.5289 3.02921 134.553     13.7561  140.073     12.688   64.3801    180.394     2.743       180.394     
1 1 1 30 11 3  o 18 38.3004 4.99309 26.8729     9.86549  27.9501     8.54842  16.2725    141.188     6.42111     321.188     
1 1 1 30 11 4  o 1  27.562  5.65351 10.9531     8.38723  17.2978     8.38547  1.6551     252.958     6.6996      72.9584     
1 1 1 30 11 5  o 7  51.8443 4.20008 50.1952     11.2221  47.951      10.2012  34.599     131.265     2.82028     131.265     
1 1 1 30 11 6  o 11 60.0768 3.43816 68.0105     10.2098  62.2997     10.2944  33.6494    338.369     16.2665     158.369     
1 1 1 30 11 7  o 13 61.0122 3.52589 66.7455     10.4343  67.7051     10.9359  52.2905    322.71      26.1274     322.71      
1 1 1 30 11 8  o 2  80.2263 2.97791 118.183     11.9682  112.643     11.8896  40.9818    302.377     34.4667     122.377     
1 1 1 30 11 9  o 4  27.069  5.57702 15.4298     8.06917  11.9138     8.06089  21.9495    265.765     78.6311     265.765     
1 1 1 30 11 10 o 4  53.0406 3.96656 54.6016     10.4835  47.9418     10.2585  40.5835    182.144     12.7034     182.144     
1 1 1 30 11 11 o 10 83.1195 3.39501 121.617     14.8239  127.092     13.2476  59.221     196.971     1.76055     16.9714     
1 1 1 30 11 12 o 18 109.577 3.0103  219.417     16.8374  211.009     16.1626  108.43     19.9101     57.6295     19.9101     
1 1 1 30 11 13 o 3  38.8137 5.65046 22.5331     10.6831  35.0609     10.5814  16.4147    57.6347     17.2714     237.635     
1 1 1 30 11 14 o 19 126.916 3.14999 292.76      20.2845  285.272     19.7239  105.828    264.17      24.3785     264.17      
1 1 1 30 11 15 o 6  46.4285 4.869   40.1991     11.4232  39.8545     10.5306  37.5859    146.775     24.2703     146.775     
1 1 1 30 11 16 o 12 63.9164 3.62146 73.2054     11.2513  74.7488     11.7531  59.9822    81.6262     31.5587     81.6262     
1 1 1 30 11 17 o 1  33.5534 5.43855 22.9203     8.59965  19.9645     9.31878  8.26956    297.708     27.511      117.708     
1 1 1 30 11 18 o 11 129.888 2.8276  309.224     19.0282  295.398     17.7383  110.925    347.056     30.4461     347.056     
1 1 1 30 11 19 o 18 79.5311 3.32445 103.751     13.0322  124.912     13.2805  41.5764    312.781     32.831      132.781     
1 1 1 30 11 20 o 1  107.944 2.80856 215.198     14.9957  202.805     15.3163  74.1318    148.819     10.2428     328.819     
1 1 1 30 11 21 o 9  29.2053 5.67511 16.7536     8.48279  15.8631     8.64644  11.0755    309.18      11.1629     129.18      
1 1 1 30 11 22 o 11 71.5162 3.47099 96.1219     12.228   89.1976     12.4748  60.8843    246.036     20.0082     246.036     
1 1 1 30 11 23 o 13 111.091 3.0469  235.85      16.7959  208.674     17.0014  81.0121    340.72      0.604635    160.72      
1 1 1 30 11 24 o 10 130.429 2.87979 322.581     18.4253  289.115     19.0869  124.883    160.144     59.1673     160.144     
1 1 1 30 11 25 o 11 34.3063 5.36364 27.4458     9.0937   18.0307     8.95367  8.21596    127.488     29.3147     307.488     
1 1 1 30 11 26 o 13 120.176 2.73779 265.976     17.116   252.898     15.8165  94.763     123.258     14.0321     123.258     
1 1 1 30 11 27 o 6  71.3397 3.37287 100.607     12.1033  84.4526     11.8233  56.4804    195.495     11.3624     195.495     
1 1 1 30 11 28 o 12 50.22   3.87241 47.5973     9.55744  45.2034     9.61051  30.0406    254.312     9.76526     74.3116     
1 1 1 30 11 29 o 3  50.4238 3.853   49.9919     9.57393  43.6715     9.54846  20.5014    6.3918      30.0008     186.392     
1 1 1 30 11 30 o 4  122.902 2.65645 278.156     16.2767  264.872     16.3967  105.316    166.678     32.2371     166.678     
1 1 1 30 11 31 o 18 98.1372 2.9997  168.105     13.9214  179.917     15.5114  88.238     220.894     35.4176     220.894     
1 1 1 30 11 32 o 7  86.6277 2.96451 146.91      12.6608  124.76      12.9099  59.1414    64.0047     6.27294     244.005     
1 1 1 30 11 33 f 0  17.7703 5.24924 4.20645     7.80497  -1.6268     8.11317  28.7847    225.846     0           0           
1 1 1 30 11 34 o 10 28.7122 5.49326 22.4494     8.51349  9.43293     8.48488  2.47673    276.227     43.0145     276.227     
1 1 1 30 11 35 o 9  20.4396 5.73131 6.45045     8.37645  3.14632     9.25082  1.17248    113.831     1.04784     293.831     
1 1 1 30 11 36 o 18 52.2251 4.13884 53.4078     10.0148  48.0749     11.1278  37.8374    293.611     3.78328     293.611     
1 1 1 30 11 37 f 0  33.6068 5.71704 19.8632     8.98599  24.8441     10.0645  34.0758    272.254     0           0           
1 1 1 30 11 38 o 2  60.7761 3.74814 68.1348     10.878   68.0768     11.7057  58.8311    210.684     34.6313     210.684     
1 1 1 30 11 39 o 1  94.0392 3.10954 165.872     13.9237  155.862     15.2158  84.1716    105.827     34.7698     105.827     
1 1 1 30 11 40 o 3  63.7914 3.76529 79.271      11.3309  71.4132     12.3959  53.2618    72.3564     17.476      72.3564     
1 1 1 30 11 41 o 5  62.8038 3.75289 77.3024     11.207   69.0642     12.0797  44.3729    113.957     0.730999    113.957     
1 1 1 30 11 42 o 10 33.2262 5.60581 32.5063     9.34867  11.9857     10.201   8.90534    198.2       26.8748     18.1997     
1 1 1 30 11 43 o 13 63.4763 3.8133  69.2751     11.4979  81.3342     12.535   56.8132    130.831     25.8252     130.831     
1 1 1 30 11 44 o 10 32.0247 5.94352 16.4236     9.17147  26.0316     10.3468  19.1475    100.668     2.56028     280.668     
1 1 1 30 11 45 o 9  18.6096 5.29578 10.1964     8.3691   -13.894     10.0749  4.91174    294.387     6.86136     114.387     
1 1 1 30 11 46 o 1  73.9112 3.65476 114.216     13.3128  90.525      13.4137  63.1985    131.23      23.7476     131.23      
1 1 1 30 11 47 o 6  76.6182 3.68498 103.944     14.1475  116.132     13.9274  57.196     35.6821     7.74036     35.6821     
1 1 1 30 11 48 o 15 54.9806 4.71694 68.8734     11.4866  49.4774     13.117   45.2896    80.9439     16.2905     80.9439     
1 1 1 30 11 49 o 6  39.1608 5.77181 34.7127     10.491   28.7108     11.4121  31.6241    283.434     14.7918     283.434     
1 1 1 30 11 50 o 15 26.4333 5.93471 22.1536     9.32952  3.16961     11.017   13.8797    333.218     3.58175     333.218     
1 1 1 30 11 51 o 16 44.7503 5.43211 37.3173     11.5048  44.2358     11.9618  30.8395    258.538     3.15583     258.538     
1 1 1 30 11 52 o 10 20.4862 6.0652  2.50722     10.4238  6.17602     10.5594  3.34674    182.889     1.03437     2.88922     
1 1 1 30 11 53 o 8  46.6245 5.7424  47.6491     12.2629  41.9767     13.4592  28.722     167.644     4.34604     347.644     
1 1 1 30 11 54 o 10 27.4803 6.868   14.1732     11.1191  17.6201     12.4865  10.8247    57.7827     11.7658     237.783     
1 1 1 30 11 55 o 4  22.1632 6.53465 6.91311     11.9047  5.34903     12.2362  8.3002     306.35      7.34602     126.35      
1 1 1 30 11 56 o 15 31.2422 7.28479 22.015      13.3251  22.5329     13.1391  8.65401    118.174     22.6236     298.174     
1 1 1 30 11 57 o 19 35.1269 7.32524 32.9912     14.1669  24.9915     13.548   22.9531    119.854     2.5895      119.854     
1 1 1 30 11 58 o 5  54.2887 5.71125 57.6777     14.5477  66.5392     15.5811  45.3635    287.51      19.8026     287.51      
1 1 1 30 11 59 o 6  22.0176 6.73975 -0.273233   15.102   9.49447     13.0087  3.35103    90.9247     0.484253    90.9247     
1 1 1 30 11 60 o 17 34.1257 7.72999 25.7225     15.8398  34.4303     14.6612  22.9368    170.596     9.69717     170.596     
1 1 1 30 11 61 o 4  29.734  7.77425 25.869      16.3949  20.8791     14.2722  15.6891    239.43      3.3329      239.43      
1 1 1 30 11 62 o 2  31.0181 8.15344 29.5877     19.4519  24.7517     14.6156  10.9784    128.353     5.33202     128.353     
1 1 1 30 11 63 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 12 0  o 6  47.3003 4.25842 41.9176     9.64796  41.9176     9.64796  2.07596    1.29638e-05 67.1618     180         
1 1 1 30 12 1  o 16 94.4286 3.12691 153.774     14.1801  166.674     15.338   77.7514    240.794     16.5338     240.794     
1 1 1 30 12 2  o 9  119.583 3.35659 260.903     17.8309  253.41      22.0165  101.768    77.3993     25.9783     77.3993     
1 1 1 30 12 3  o 3  124.044 3.33783 278.356     19.2813  274.919     22.025   111.24     140.686     38.2803     140.686     
1 1 1 30 12 4  o 11 57.8336 3.98297 67.5803     11.3305  54.6074     11.3425  24.3211    259.91      35.0929     79.9097     
1 1 1 30 12 5  o 2  19.917  5.78193 2.77253     8.65223  3.04121     9.82151  4.97946    147.322     29.8701     147.322     
1 1 1 30 12 6  o 16 32.9568 5.86514 19.7959     9.54842  21.8261     9.81576  2.20643    196.403     49.4407     196.403     
1 1 1 30 12 7  o 12 30.0418 5.83958 19.9595     9.71051  14.5724     8.47621  13.6121    17.8678     2.54832     197.868     
1 1 1 30 12 8  o 1  75.6912 3.33408 101.4       12.8294  105.217     12.319   61.0827    175.79      12.2346     175.79      
1 1 1 30 12 9  o 12 19.5043 5.56225 2.97146     8.90041  3.95101     7.87126  14.4651    46.8519     52.0782     46.8519     
1 1 1 30 12 10 o 1  54.3305 3.91906 47.4145     10.4138  60.6978     10.4869  51.8909    83.2964     33.3867     83.2964     
1 1 1 30 12 11 o 17 93.9604 2.93579 165.092     13.1044  152.034     14.3703  71.1952    309.887     3.99322     309.887     
1 1 1 30 12 12 f 0  54.7921 3.74893 52.3364     10.0592  57.0559     10.2637  45.5994    61.4536     0           0           
1 1 1 30 12 13 o 7  17.7413 5.15604 -2.96505    7.51082  5.54565     7.78575  2.83358    158.345     17.9933     158.345     
1 1 1 30 12 14 o 14 24.9441 5.6793  11.3499     8.09495  11.3323     8.03622  2.88264    131.125     0.837306    311.125     
1 1 1 30 12 15 o 11 72.2461 3.07154 91.2394     10.6458  96.9196     11.4943  40.175     303.234     25.1198     123.234     
1 1 1 30 12 16 f 0  71.7251 3.03892 95.9269     10.6698  89.5381     11.048   39.8436    241.009     0           0           
1 1 1 30 12 17 o 18 56.9066 3.418   62.9494     9.59691  54.7601     9.66649  16.1711    142.631     50.0715     322.631     
1 1 1 30 12 18 o 19 116.463 2.72454 237.444     15.7088  249.314     16.05    98.5209    99.7305     25.3738     99.7305     
1 1 1 30 12 19 o 1  57.6561 3.47291 63.2828     9.7169   57.6567     10.1156  37.3499    184.372     7.44639     4.37193     
1 1 1 30 12 20 o 1  69.1911 3.04298 82.6628     10.4339  90.2796     10.553   55.6047    1.01941     11.9424     1.01941     
1 1 1 30 12 21 o 17 75.8382 3.112   106.505     11.8326  101.336     11.7174  63.7642    124.57      18.252      124.57      
1 1 1 30 12 22 o 17 86.9937 2.85647 142.426     12.248   130.263     12.5539  60.7789    50.9546     5.40456     230.954     
1 1 1 30 12 23 o 17 57.1146 3.69571 60.4271     10.4367  58.9172     10.4828  41.1622    194.465     1.64447     194.465     
1 1 1 30 12 24 o 10 35.1259 5.17099 26.4753     8.51635  20.9738     9.08775  12.2439    343.277     22.6289     163.277     
1 1 1 30 12 25 o 7  34.9171 5.43857 26.5969     8.82328  20.6155     9.72781  12.0624    296.033     22.6388     116.033     
1 1 1 30 12 26 f 0  42.2675 4.58229 39.3885     8.93987  28.1988     9.52631  30.8704    326.84      0           0           
1 1 1 30 12 27 o 19 62.0334 3.52949 73.097      10.9134  67.5044     10.8343  59.8974    358.973     34.0351     358.973     
1 1 1 30 12 28 f 0  81.4629 3.08797 123.502     11.8053  116.884     13.2204  65.8652    353.129     0           0           
1 1 1 30 12 29 o 14 50.4279 3.98227 46.9652     9.53975  47.129      10.2295  30.6835    358.906     9.22409     178.906     
1 1 1 30 12 30 o 8  86.2778 3.0149  140.145     13.0325  129.395     12.9449  53.0065    1.17657     18.9564     181.177     
1 1 1 30 12 31 o 3  30.8653 5.64711 18.7526     8.54942  18.6087     9.05678  13.672     103.523     11.6658     283.523     
1 1 1 30 12 32 o 15 30.508  5.78401 18.168      8.82301  18.4773     9.22507  14.9952    187.183     7.68781     7.18313     
1 1 1 30 12 33 o 6  36.6835 5.17434 28.7775     8.99984  23.3953     9.33599  18.3318    45.1293     12.3858     225.129     
1 1 1 30 12 34 o 5  49.6024 4.13823 47.3973     9.91478  44.3933     10.2338  36.3044    293.563     4.11516     293.563     
1 1 1 30 12 35 o 16 52.1394 4.13504 51.614      10.5379  49.8051     10.6912  32.782     136.421     7.4824      316.422     
1 1 1 30 12 36 o 1  23.7773 5.55221 17.2766     8.52317  0.655993    8.8797   10.487     184.047     3.85904     4.04661     
1 1 1 30 12 37 o 3  46.4854 4.74745 41.0407     10.0135  41.5064     11.4103  32.6159    212.657     1.17668     212.657     
1 1 1 30 12 38 o 7  29.8672 6.18939 15.2137     9.08258  21.0057     10.6898  9.51971    78.0018     20.4036     258.002     
1 1 1 30 12 39 o 2  41.4803 5.30111 38.1785     9.66219  29.5722     11.2911  30.8385    242.34      5.93143     242.34      
1 1 1 30 12 40 o 16 24.3552 6.19751 10.7185     8.97248  10.9538     10.3524  11.8565    297.389     3.51676     117.389     
1 1 1 30 12 41 o 11 31.2856 6.4171  15.1789     10.4511  25.6477     11.2278  13.1353    8.56389     14.9005     188.564     
1 1 1 30 12 42 o 5  23.6489 6.05997 15.2613     9.30856  2.16186     10.7493  11.6813    145.122     2.06729     325.122     
1 1 1 30 12 43 o 12 52.4338 4.60756 56.4585     10.906   49.8145     12.5012  28.5836    261.147     15.8506     81.1475     
1 1 1 30 12 44 o 6  49.7633 4.88348 48.0632     10.794   49.0504     12.7969  36.3296    359.662     4.57491     359.662     
1 1 1 30 12 45 o 15 16.3158 5.22055 -8.46463    8.51012  1.51081     9.98082  1.79122    171.338     3.73844     351.338     
1 1 1 30 12 46 o 7  52.9826 4.55981 50.3917     11.4609  58.8915     12.2439  51.7614    260.058     33.6777     260.058     
1 1 1 30 12 47 o 9  45.6283 5.1435  39.6219     10.7898  43.7218     11.9485  31.1303    281.002     1.03826     281.002     
1 1 1 30 12 48 o 19 51.2663 4.8723  49.7266     12.2054  54.2168     12.1682  35.3703    263.055     1.36833     263.055     
1 1 1 30 12 49 o 8  19.5102 6.02534 2.75747     10.9144  -0.329272   11.4413  2.0347     65.0392     15.6271     245.039     
1 1 1 30 12 50 o 4  31.9102 7.06398 19.4421     12.552   26.0882     12.746   13.9925    113.366     9.13913     113.366     
1 1 1 30 12 51 o 6  37.7701 6.75686 44.4769     13.7479  19.415      13.1657  26.7722    111.856     6.04148     111.856     
1 1 1 30 12 52 o 4  38.2922 6.67263 31.2736     12.2825  32.8791     13.1609  27.0507    278.885     5.25164     278.885     
1 1 1 30 12 53 o 5  33.1272 7.04049 21.5798     12.1885  27.9288     13.154   20.3485    341.632     0.7808      161.632     
1 1 1 30 12 54 o 16 20.5505 6.22948 7.07156     11.1575  -1.59073    12.3396  7.70402    203.81      1.68847     23.81       
1 1 1 30 12 55 o 17 53.3769 5.51385 62.5912     13.8107  55.2666     14.6507  40.5439    334.187     9.8985      334.187     
1 1 1 30 12 56 o 16 23.6031 6.7861  8.04514     11.9502  11.581      13.208   9.42103    332.778     3.07564     332.778     
1 1 1 30 12 57 f 0  19.6074 6.33093 5.93386     14.4013  -13.4446    14.2326  9.207      169.932     0           0           
1 1 1 30 12 58 o 18 24.7488 7.44066 21.4243     18.1165  1.28042     14.573   10.2689    161.716     3.38582     341.716     
1 1 1 30 12 59 o 2  20.2725 6.64661 7.38128     19.589   -4.44193    10.9733  3.41685    25.539      2.88411     205.539     
1 1 1 30 12 60 o 6  21.0425 6.67189 -18.0487    19.0391  11.4506     13.8599  2.38744    344.194     1.56488     164.194     
1 1 1 30 12 61 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 13 0  o 10 62.5886 3.46134 71.262      10.6997  71.262      10.6997  46.7962    180         0.950493    8.6514e-06  
1 1 1 30 13 1  o 11 49.5918 4.19481 50.4019     10.6075  40.4208     9.79861  35.7768    237.292     2.40131     237.292     
1 1 1 30 13 2  o 17 16.1133 5.12952 -3.48131    9.29762  -3.83072    8.06906  6.07072    327.506     24.5587     327.506     
1 1 1 30 13 3  o 2  60.6884 3.70874 59.7479     11.8677  74.7094     10.0092  48.0021    32.543      9.15324     32.543      
1 1 1 30 13 4  o 10 30.0832 5.72669 17.3233     9.05108  17.4426     8.5999   4.02451    230.818     48.9464     230.818     
1 1 1 30 13 5  o 7  56.9628 3.81998 57.2925     10.3161  61.1934     11.2339  56.429     253.738     36.6815     253.738     
1 1 1 30 13 6  o 19 29.1753 6.0134  18.6846     8.52058  13.2541     10.542   10.1049    158.233     15.0469     338.233     
1 1 1 30 13 7  o 11 100.373 2.98998 191.417     14.5329  171.309     15.3802  81.914     73.8315     15.0672     73.8315     
1 1 1 30 13 8  o 9  104.076 2.97611 185.384     14.2741  204.516     16.7005  90.636     345.485     27.1131     345.485     
1 1 1 30 13 9  o 8  73.634  3.2854  99.7331     11.8804  96.366      12.2305  34.0223    54.5658     40.5675     234.566     
1 1 1 30 13 10 o 8  86.2018 3.03461 138.65      12.8809  129.194     13.2266  58.2612    169.858     10.8088     349.858     
1 1 1 30 13 11 o 5  75.037  3.2981  96.1349     12.0654  107.766     12.6105  48.1109    159.975     13.9398     339.975     
1 1 1 30 13 12 o 9  33.6918 5.26105 17.8131     8.8716   25.8617     8.49015  3.56623    74.1555     54.1156     74.1555     
1 1 1 30 13 13 o 2  19.4403 5.53662 4.18024     8.00969  3.17339     8.57926  1.89544    200.38      22.2669     200.38      
1 1 1 30 13 14 o 8  55.8723 3.89417 56.979      11.4519  57.4834     10.0007  46.0321    336.172     13.5172     336.172     
1 1 1 30 13 15 o 16 64.1446 3.5123  78.75       10.3875  71.0744     11.8491  33.7487    78.2322     25.9773     258.232     
1 1 1 30 13 16 o 7  65.9053 3.2705  84.4097     10.3967  73.3268     10.9704  60.851     168.366     27.9347     168.366     
1 1 1 30 13 17 f 0  53.7541 3.73163 56.302      9.86293  49.6905     9.94013  57.6794    20.729      0           0           
1 1 1 30 13 18 o 3  48.2574 4.11463 38.5627     9.06172  47.8948     10.4526  42.9271    197.374     32.9255     197.374     
1 1 1 30 13 19 o 12 76.2354 2.96997 103.275     11.24    106.711     11.3651  59.7156    359.784     8.47952     359.784     
1 1 1 30 13 20 o 9  30.3845 5.56366 24.8353     9.16047  11.3036     8.52219  11.8713    308.017     14.8547     128.017     
1 1 1 30 13 21 o 2  36.0508 4.86321 23.409      8.40856  26.1983     8.51953  14.1653    289.13      20.7068     109.13      
1 1 1 30 13 22 o 3  74.7285 3.00555 104.476     11.2357  97.6369     11.1744  73.3751    171.677     39.8386     171.677     
1 1 1 30 13 23 o 18 61.2158 3.57033 70.3354     10.7546  66.7578     10.9432  46.8207    47.3996     6.19713     47.3996     
1 1 1 30 13 24 o 16 90.0539 2.8946  153.542     13.1745  139.56      12.8733  71.6354    216.581     11.7761     216.581     
1 1 1 30 13 25 o 16 35.4684 5.2339  23.7423     8.69507  24.9295     9.30949  17.1154    123.114     13.1922     303.114     
1 1 1 30 13 26 o 8  55.0568 3.66635 56.9066     10.1602  54.4877     9.83425  39.5811    201.729     1.2619      201.729     
1 1 1 30 13 27 o 2  15.8348 4.93602 -2.51334    7.62288  -0.553385   7.67368  11.7799    326.573     41.2953     326.573     
1 1 1 30 13 28 o 6  92.8783 2.94917 152.27      14.0193  159.957     13.33    66.1482    181.072     3.08387     1.07173     
1 1 1 30 13 29 o 9  95.7945 2.89448 174.918     14.1789  157.291     13.5446  72.3484    213.507     5.23679     213.507     
1 1 1 30 13 30 o 12 20.7779 5.59995 3.73231     8.09689  8.50489     8.27393  4.96612    77.4852     8.89103     257.485     
1 1 1 30 13 31 o 17 20.413  5.54762 1.83265     8.06359  9.08421     8.33271  2.5687     308.334     17.1936     128.334     
1 1 1 30 13 32 o 14 67.0222 3.30421 88.1099     11.0072  76.3408     11.0016  50.2928    157.184     4.63217     157.184     
1 1 1 30 13 33 o 5  60.7951 3.52323 66.889      10.5962  69.159      10.6828  41.7897    31.4452     3.15554     211.445     
1 1 1 30 13 34 o 17 46.1808 4.46668 48.558      10.1887  33.0597     9.69339  38.6579    98.7127     14.0832     98.7127     
1 1 1 30 13 35 f 0  17.8371 5.29232 -0.505917   8.03239  4.00184     8.09964  7.66835    40.1219     0           0           
1 1 1 30 13 36 o 7  50.3907 4.18929 57.8311     10.1439  38.8513     10.1765  37.3141    36.5345     4.13787     36.5346     
1 1 1 30 13 37 o 4  37.3087 5.20533 32.0307     9.37795  23.2983     9.36919  10.413     231.036     30.9991     51.0365     
1 1 1 30 13 38 o 17 50.2402 4.28544 58.1221     10.238   38.7951     10.4055  33.6212    287.017     3.13725     107.017     
1 1 1 30 13 39 o 19 97.5956 2.97168 188.945     13.9748  160.29      14.8503  91.6337    77.8394     43.6845     77.8394     
1 1 1 30 13 40 o 5  17.2048 5.3031  3.69704     8.4055   -6.47733    9.56281  0.501684   129.416     17.6265     309.416     
1 1 1 30 13 41 o 12 78.0675 3.44193 111.396     12.637   115.275     14.1348  79.286     7.1969      48.9322     7.1969      
1 1 1 30 13 42 o 11 19.4914 5.73811 0.53373     8.57887  6.84106     10.0832  1.89738    12.809      0.0926374   192.809     
1 1 1 30 13 43 o 11 42.9234 5.28352 39.3865     10.2753  34.8113     11.4981  35.5406    125.683     14.2934     125.683     
1 1 1 30 13 44 o 11 39.2834 5.88024 43.7111     11.113   21.6992     11.5772  25.3853    334.516     1.42018     154.516     
1 1 1 30 13 45 o 7  26.6153 6.48587 5.2869      10.7324  22.6958     11.7212  14.5319    346.721     4.05415     346.721     
1 1 1 30 13 46 o 14 41.0631 6.36873 25.9079     11.8992  47.7867     13.896   31.8021    147.136     10.9444     147.136     
1 1 1 30 13 47 o 5  56.6555 5.20335 67.88       12.9981  60.9164     15.4092  41.1415    100.79      4.92385     100.79      
1 1 1 30 13 48 o 3  20.6713 6.25447 6.43379     10.7334  -0.918278   12.8454  4.47893    28.7421     0.923294    208.742     
1 1 1 30 13 49 o 1  54.7839 5.53869 61.664      13.897   60.718      15.5455  43.6495    290.33      13.1466     290.33      
1 1 1 30 13 50 o 10 60.7434 5.05036 77.042      13.649   69.871      16.0987  44.7614    43.2048     6.18771     43.2048     
1 1 1 30 13 51 o 10 73.5395 4.55262 98.8528     15.5497  112.579     17.6825  58.84      138.721     16.2013     138.721     
1 1 1 30 13 52 o 16 19.0992 6.09462 -5.44855    11.6625  2.23853     13.1218  5.60073    11.6112     1.68646     191.611     
1 1 1 30 13 53 o 16 36.1161 7.16994 39.2756     13.5323  21.5374     14.9141  17.1388    130.387     12.9052     310.387     
1 1 1 30 13 54 o 18 20.927  6.63856 2.21        12.9291  0.020116    16.0365  7.3483     197.999     0.431937    17.9987     
1 1 1 30 13 55 o 17 23.8246 7.1159  -7.49245    13.5962  22.7422     17.229   9.69941    271.36      5.81713     91.3596     
1 1 1 30 13 56 o 2  31.2108 8.15417 30.9491     16.4696  21.0558     18.1222  18.8115    88.5372     8.60485     88.5372     
1 1 1 30 13 57 o 17 42.2981 9.5907  71.7556     32.8839  47.4217     16.3411  31.2214    132.043     11.9002     132.043     
1 1 1 30 13 58 o 5  20.5979 6.96918 -12.7213    30.4339  -0.062753   11.5556  2.01253    317.862     1.61674     137.861     
1 1 1 30 13 59 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 13 60 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 14 0  o 3  31.3683 6.49108 21.8503     8.86185  21.8503     8.86185  5.37162    180         58.1586     180         
1 1 1 30 14 1  o 9  110.978 2.9783  216.997     16.3249  226.941     16.7434  98.3801    358.695     31.2511     358.695     
1 1 1 30 14 2  o 18 62.2954 3.66158 68.6908     10.6732  73.0196     11.9742  46.549     339.609     2.68859     339.609     
1 1 1 30 14 3  o 8  74.7687 3.43119 104.272     11.6167  98.7872     13.7788  48.2011    173.096     14.0566     353.096     
1 1 1 30 14 4  o 7  70.9713 3.3755  86.4545     11.0862  96.5828     12.7898  47.8735    237.033     8.68167     57.0333     
1 1 1 30 14 5  o 16 65.139  3.3348  75.2232     10.4753  78.9153     11.1502  53.5648    143.082     12.6893     143.082     
1 1 1 30 14 6  o 4  62.132  3.44289 78.3917     10.3361  62.5634     10.7558  51.4694    269.779     13.3779     269.779     
1 1 1 30 14 7  o 19 36.519  5.03662 29.0934     8.60795  21.9954     9.10726  3.14778    298.595     2.24211     298.595     
1 1 1 30 14 8  o 16 83.6442 2.94511 131.127     11.9224  121.442     12.6349  70.216     180.951     17.0925     180.951     
1 1 1 30 14 9  o 5  33.7576 5.11442 34.4175     8.50976  10.4955     8.97724  4.81968    246.273     37.1432     66.2732     
1 1 1 30 14 10 f 0  19.6075 5.37453 -1.57739    7.59004  9.50305     8.37496  44.9325    315.615     0           0           
1 1 1 30 14 11 o 19 51.7134 3.94568 57.9431     9.60128  41.3104     10.1223  38.1372    309.279     2.94391     309.279     
1 1 1 30 14 12 o 11 18.9821 4.86736 -12.2175    7.24823  13.3897     8.08636  5.9954     290.919     33.6895     290.919     
1 1 1 30 14 13 o 4  47.5503 4.11398 43.8565     9.21057  40.0349     9.90701  32.9695    224.389     0.884034    44.3886     
1 1 1 30 14 14 o 14 30.6969 5.60666 11.4901     9.25765  25.0892     8.86526  10.8059    155.651     18.5506     335.651     
1 1 1 30 14 15 o 15 37.1269 5.49463 32.2716     9.41901  21.4107     10.3709  26.8414    194.267     6.7279      194.267     
1 1 1 30 14 16 o 4  53.0808 3.90949 56.134      10.537   47.9554     9.94372  53.0756    339.728     35.6204     339.728     
1 1 1 30 14 17 o 2  18.3121 5.44335 3.87323     8.69943  -1.05894    8.4083   2.02477    20.6426     21.9995     20.6426     
1 1 1 30 14 18 o 4  81.0734 3.14926 124.678     12.8444  113.851     12.6355  65.6122    319.409     12.3411     319.409     
1 1 1 30 14 19 o 3  47.8557 4.34892 47.012      10.177   38.7751     10.1113  28.1481    238.62      11.6146     58.6195     
1 1 1 30 14 20 o 18 55.9827 3.74369 67.2668     10.0976  48.749      10.3543  50.0393    304.524     21.4136     304.524     
1 1 1 30 14 21 o 13 38.9681 5.18698 34.1081     9.14168  24.6188     10.1961  17.9652    211.91      18.0788     31.9098     
1 1 1 30 14 22 o 2  23.6048 5.88662 7.89787     8.15283  11.6222     9.22206  8.29182    144.655     5.27217     324.655     
1 1 1 30 14 23 o 12 73.7256 3.53569 96.4453     13.7759  102.399     12.0598  81.5604    185.698     59.4388     185.698     
1 1 1 30 14 24 o 8  101.006 2.93951 194.637     14.6194  174.868     15.0158  95.2747    4.55953     42.5819     4.55953     
1 1 1 30 14 25 o 12 19.2    5.49436 3.86611     8.13807  3.63084     8.26725  5.3639     120.913     33.6861     120.913     
1 1 1 30 14 26 o 8  21.2022 5.77525 6.46134     8.19542  6.34615     9.14169  4.3942     327.196     13.751      147.196     
1 1 1 30 14 27 o 15 23.1244 5.67098 14.4225     8.54345  3.18287     8.51066  7.746      158.513     10.3904     338.513     
1 1 1 30 14 28 o 1  27.2814 5.88979 9.79226     9.46868  18.7021     8.75714  7.80228    22.3176     19.9443     202.318     
1 1 1 30 14 29 o 19 69.1287 3.51073 83.7826     11.5171  91.9452     12.6517  48.2284    77.7746     3.68084     257.775     
1 1 1 30 14 30 o 8  23.9731 6.06927 9.63682     8.70307  10.8757     9.78166  11.5506    316.73      2.51888     136.73      
1 1 1 30 14 31 o 7  36.4792 5.30909 23.7393     9.29155  28.8388     9.47812  27.361     359.114     6.21226     359.114     
1 1 1 30 14 32 o 7  18.2854 5.39619 5.34569     8.30795  -1.74471    8.58279  1.7122     182.369     25.3581     182.369     
1 1 1 30 14 33 o 8  25.7904 5.96434 16.1736     9.0596   9.6281      9.00346  9.67919    118.084     13.6329     298.084     
1 1 1 30 14 34 o 16 57.5947 3.84408 62.7881     10.8784  61.442      11.0449  43.0316    275.424     4.01924     275.424     
1 1 1 30 14 35 o 16 22.4988 5.94189 6.98998     8.88983  10.2563     9.18421  10.4524    276.571     3.23745     96.5715     
1 1 1 30 14 36 o 14 32.6066 5.72649 23.7577     9.29693  19.8852     9.37778  19.8377    194.385     3.5504      14.3852     
1 1 1 30 14 37 o 16 14.0112 4.628   -4.60293    8.007    -8.24101    8.12902  3.67614    315.372     21.5349     315.372     
1 1 1 30 14 38 o 5  42.7831 4.92561 41.3756     10.0989  31.2282     10.14    38.7349    12.6281     20.7859     12.6281     
1 1 1 30 14 39 o 10 62.6568 3.77004 79.2136     11.2994  68.9661     12.0189  45.9777    271.226     3.15297     271.226     
1 1 1 30 14 40 o 6  20.361  5.87169 2.32186     10.1162  7.35203     9.08467  5.88797    328.941     10.2446     148.941     
1 1 1 30 14 41 o 9  36.0498 6.3595  32.8028     12.0806  23.2916     10.947   23.4427    180.281     17.9143     180.281     
1 1 1 30 14 42 o 18 20.178  6.09272 1.32319     10.2136  5.15087     11.5704  6.13555    295.549     5.32034     115.549     
1 1 1 30 14 43 o 4  43.5666 6.1555  54.2005     12.2911  27.4698     13.5371  8.07006    194.979     44.3297     14.979      
1 1 1 30 14 44 o 10 36.9374 6.45218 34.6896     11.4446  24.7227     12.6272  21.1317    141.18      6.20147     321.18      
1 1 1 30 14 45 o 15 25.4185 6.67909 7.58316     11.2338  17.5871     11.9564  7.58295    319.569     15.585      139.569     
1 1 1 30 14 46 o 8  44.1081 6.28166 38.4414     12.3821  44.8132     14.4391  35.4067    195.94      12.8154     195.94      
1 1 1 30 14 47 o 18 26.3349 6.76433 6.45736     12.1087  20.5425     12.1216  13.6852    20.9287     6.04208     20.9287     
1 1 1 30 14 48 o 3  38.8578 6.81287 34.2642     12.3479  32.6724     14.1153  27.3814    187.801     3.79448     187.801     
1 1 1 30 14 49 o 9  49.3126 6.00319 52.572      13.8634  49.8594     14.6906  37.3755    242.142     7.97872     242.142     
1 1 1 30 14 50 o 3  35.1313 7.1208  37.5736     13.0654  18.8971     15.2436  26.6087    302.596     9.70282     302.596     
1 1 1 30 14 51 f 0  28.2815 7.27439 9.85555     12.5427  26.417      14.8864  14.3149    17.3212     0           0           
1 1 1 30 14 52 o 11 22.6433 6.82785 6.04575     12.696   8.26955     14.5728  9.59394    194.022     4.59528     14.0223     
1 1 1 30 14 53 o 5  22.1468 6.89562 6.30724     15.4318  3.996       14.268   8.09781    276.281     5.86416     96.2813     
1 1 1 30 14 54 o 3  28.0448 7.87225 14.5936     18.0507  23.9234     15.8501  14.6296    198.286     4.8881      198.286     
1 1 1 30 14 55 o 7  41.2026 7.59133 35.5086     19.7722  52.6159     14.2152  30.1719    321.095     9.34911     321.095     
1 1 1 30 14 56 o 4  31.1681 8.90694 41.1888     27.6592  23.5852     15.9732  13.7173    255.955     6.36788     255.955     
1 1 1 30 14 57 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 14 58 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 15 0  o 1  82.9516 2.88465 123.826     11.9252  123.826     11.9252  50.5159    180         24.7724     8.65146e-06 
1 1 1 30 15 1  o 13 115.735 2.71009 231.529     15.9026  250.947     15.4481  115.434    193.22      57.923      193.22      
1 1 1 30 15 2  o 15 38.6646 4.81526 30.4948     9.27256  26.46       8.70846  24.8199    131.494     3.05652     311.494     
1 1 1 30 15 3  o 18 45.8671 4.35109 37.9781     9.56979  40.6892     9.92886  29.985     32.7089     5.04659     212.709     
1 1 1 30 15 4  o 6  23.2942 5.73742 7.2119      8.35257  11.5506     8.25564  5.46105    153.493     15.0472     333.493     
1 1 1 30 15 5  o 6  19.356  5.46802 3.48839     8.09231  4.70805     7.94992  6.12329    108.95      35.2774     108.95      
1 1 1 30 15 6  o 3  35.2296 5.24426 25.8914     8.95616  22.1601     8.97921  17.3262    125.148     13.2972     305.148     
1 1 1 30 15 7  o 3  33.0573 5.25552 27.208      8.50194  15.5205     8.69164  22.3922    49.926      5.18611     49.926      
1 1 1 30 15 8  o 19 73.1069 3.17944 89.9781     11.4278  104.384     11.7256  38.6781    73.1074     31.2268     253.107     
1 1 1 30 15 9  o 13 70.7785 3.26077 102.192     11.1116  80.6444     11.6761  59.8754    70.3251     15.9942     70.3251     
1 1 1 30 15 10 o 18 15.8686 4.71678 6.3022      7.31086  -16.3761    8.05111  5.7614     344.486     26.8564     344.486     
1 1 1 30 15 11 o 11 22.0816 5.66473 10.6373     7.94127  4.57608     8.65922  4.8643     53.1747     2.3101      233.175     
1 1 1 30 15 12 o 13 50.963  3.99229 47.0085     9.68678  49.2542     10.3634  38.0374    283.075     3.38189     283.075     
1 1 1 30 15 13 o 17 22.7335 5.48902 15.0725     8.03027  -0.729457   9.09048  6.75719    316.955     2.75103     136.955     
1 1 1 30 15 14 o 6  14.1383 4.63223 -3.9147     7.75966  -8.41675    7.9477   6.6281     310.949     25.2642     310.949     
1 1 1 30 15 15 o 18 19.0391 5.57859 5.07806     7.97977  -1.26515    9.92573  2.40486    62.7263     8.77796     242.726     
1 1 1 30 15 16 o 12 60.3179 3.9544  66.4538     10.8632  68.0051     12.7023  40.0087    250.43      7.87591     70.4304     
1 1 1 30 15 17 o 17 15.5467 4.97961 -1.12484    7.48976  -8.11717    9.57875  0.185124   50.6979     4.0298      50.6978     
1 1 1 30 15 18 o 1  53.9598 4.11937 57.8808     10.5705  50.5264     11.2309  47.7736    93.7838     19.3841     93.7838     
1 1 1 30 15 19 o 15 28.3093 5.90507 20.2834     9.0847   10.7543     9.39806  9.4523     279.457     17.852      99.4569     
1 1 1 30 15 20 o 9  98.0296 2.97386 163.389     14.4548  185.281     14.6634  78.2255    134.268     11.3016     134.268     
1 1 1 30 15 21 o 12 46.2959 4.6318  50.6203     10.9723  31.6659     9.70493  34.2076    347.919     3.36293     347.919     
1 1 1 30 15 22 o 10 56.48   3.9608  60.0729     10.9984  58.3888     11.1232  47.3458    133.579     13.87       133.579     
1 1 1 30 15 23 o 16 21.123  5.82705 8.77611     9.75793  3.5198      8.1288   2.14739    340.54      31.0018     340.54      
1 1 1 30 15 24 o 6  56.5449 3.93459 59.7315     11.1651  59.1574     10.8437  51.4916    141.243     22.5363     141.243     
1 1 1 30 15 25 o 2  36.4875 5.18143 35.5134     9.12024  17.5993     9.17686  26.5725    151.882     4.08638     151.881     
1 1 1 30 15 26 o 8  80.2851 3.21508 117.341     12.8209  118.448     12.9447  79.9623    62.7983     43.137      62.7983     
1 1 1 30 15 27 o 18 21.0129 5.81183 7.45608     8.67465  4.7222      9.1758   7.50546    355.774     0.326677    175.774     
1 1 1 30 15 28 o 10 38.0729 5.11691 31.8715     9.39389  25.1906     9.38691  26.0404    209.64      0.402267    29.6406     
1 1 1 30 15 29 o 9  17.247  5.36023 0.991437    9.27645  -2.61624    8.64679  1.14711    118.15      22.2238     118.15      
1 1 1 30 15 30 o 3  26.7885 6.13116 17.1562     9.04966  10.9994     10.1782  12.6831    163.311     8.99731     343.311     
1 1 1 30 15 31 o 7  24.3879 5.44108 20.1225     8.63826  -0.736411   9.04729  13.0268    353.454     2.82829     173.454     
1 1 1 30 15 32 o 16 53.0543 4.215   60.694      10.5801  46.8553     11.1376  39.8549    268.816     4.0588      268.816     
1 1 1 30 15 33 o 3  40.9823 5.0804  31.4837     9.79595  35.1959     10.3134  27.9772    265.248     1.00911     85.2482     
1 1 1 30 15 34 o 4  44.0707 4.88015 44.011      10.1938  32.7576     10.4236  24.8187    64.2293     12.5334     244.229     
1 1 1 30 15 35 o 8  36.9059 5.56379 22.109      9.80401  34.1778     10.2323  17.5263    36.9696     16.0324     216.97      
1 1 1 30 15 36 o 19 44.7928 4.93979 43.7148     10.3368  35.9874     10.9426  31.0974    170.444     0.212092    350.443     
1 1 1 30 15 37 o 3  26.4164 6.44421 10.9112     10.6316  17.4565     10.4067  15.987     304.962     4.87522     304.962     
1 1 1 30 15 38 o 8  52.9979 4.81845 56.7095     12.4247  54.0765     12.5646  44.4744    133.262     15.1405     133.262     
1 1 1 30 15 39 o 16 39.4917 5.99416 29.4997     11.6931  36.2872     11.3425  33.1412    352.502     25.1914     352.502     
1 1 1 30 15 40 o 2  20.4137 6.01657 10.3099     10.963   -3.79004    10.4799  6.301      67.9213     5.96139     247.921     
1 1 1 30 15 41 o 12 21.1963 6.13252 9.77621     10.7111  1.55601     10.3854  5.11856    359.687     12.8451     179.687     
1 1 1 30 15 42 o 6  26.0936 6.55606 17.1144     10.9674  10.9647     10.7996  12.3925    7.26553     4.97318     187.266     
1 1 1 30 15 43 o 10 39.5389 6.25628 32.9457     12.1615  34.3199     12.0134  34.3094    136.096     20.3787     136.096     
1 1 1 30 15 44 o 1  19.8324 6.14595 -7.69037    11.5684  7.75279     12.5695  5.60185    288.135     1.61987     108.135     
1 1 1 30 15 45 o 2  56.1071 5.78302 70.0508     14.5839  60.1618     16.5387  43.8781    46.7029     10.0783     46.7029     
1 1 1 30 15 46 o 19 50.5439 6.41245 51.6296     14.6166  58.2825     16.6802  32.5478    317.417     4.71617     137.417     
1 1 1 30 15 47 o 17 25.2426 6.90349 19.8107     12.6305  -0.378899   14.8698  6.57102    330.818     18.9103     150.818     
1 1 1 30 15 48 o 14 65.1178 5.63546 95.7994     16.5635  80.682      18.7996  49.6805    68.3142     8.83881     68.3142     
1 1 1 30 15 49 o 12 29.9092 7.58488 6.19059     16.4171  33.1089     15.7174  19.934     56.8478     4.8691      56.8478     
1 1 1 30 15 50 o 15 31.3575 7.99851 30.0996     16.5972  20.3788     15.8775  19.4285    295.422     0.811915    295.422     
1 1 1 30 15 51 o 9  20.6535 6.62727 5.99496     15.0961  -5.7402     15.0516  6.157      148.623     1.84719     328.623     
1 1 1 30 15 52 o 11 27.7448 7.75451 -3.68456    22.9129  29.859      15.8426  11.5496    8.50007     9.64524     188.5       
1 1 1 30 15 53 o 4  27.9142 7.43982 2.10441     22.7733  27.1186     12.9062  14.587     70.0462     1.58949     70.0462     
1 1 1 30 15 54 o 4  30.3028 7.36783 9.65786     19.5975  33.5488     13.2317  16.561     124.896     0.0828148   304.895     
1 1 1 30 15 55 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 15 56 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 16 0  o 3  43.7668 4.44412 36.6517     9.16491  36.6517     9.16491  5.32231    180         77.1608     180         
1 1 1 30 16 1  o 6  44.3531 4.58406 45.6747     9.21727  29.4247     9.94535  20.8247    187.059     22.3771     7.05936     
1 1 1 30 16 2  o 12 19.1208 5.41815 3.16525     7.90267  4.77297     7.90491  1.0971     25.1645     16.9849     205.164     
1 1 1 30 16 3  o 1  45.2607 4.58796 39.2336     10.8345  38.135      9.33193  17.1348    318.79      31.5193     138.79      
1 1 1 30 16 4  o 13 49.7277 4.06572 45.2814     9.56272  46.7219     10.3213  20.5906    342.641     31.6545     162.641     
1 1 1 30 16 5  o 7  67.1084 3.25758 84.7317     10.8343  79.4938     10.9306  63.063     6.2329      28.1491     6.2329      
1 1 1 30 16 6  o 6  30.9273 5.75129 17.6434     9.25229  20.1091     8.84858  4.36325    10.8229     34.2215     190.823     
1 1 1 30 16 7  o 1  107.603 2.78308 216.684     15.365   201.653     14.6028  81.8853    236.719     2.12195     236.719     
1 1 1 30 16 8  o 7  28.5555 5.75806 12.5354     8.80928  19.3919     8.7421   8.1565     336.002     21.7459     156.002     
1 1 1 30 16 9  o 6  40.3478 4.87469 32.5032     9.6301   29.844      9.37357  34.9299    178.144     17.447      178.144     
1 1 1 30 16 10 o 10 55.7072 3.86174 64.0825     10.5686  51.095      10.5827  54.224     98.409      29.6619     98.409      
1 1 1 30 16 11 o 14 29.6488 5.67336 15.4546     8.50791  19.284      8.80911  4.48834    329.083     2.69995     329.083     
1 1 1 30 16 12 o 1  78.6594 3.24705 116.195     11.9974  109.41      13.3901  76.4028    31.2801     37.0198     31.2801     
1 1 1 30 16 13 o 7  60.7259 3.55406 61.6369     10.5362  74.1968     10.8507  47.0198    298.581     5.25475     298.581     
1 1 1 30 16 14 o 14 73.5095 3.40265 102.355     12.4083  95.4645     12.5065  54.1147    358.098     0.616344    178.098     
1 1 1 30 16 15 o 3  86.0734 3.12751 129.63      13.3711  140.129     13.5081  62.7327    103.544     2.7052      283.545     
1 1 1 30 16 16 f 0  24.0486 5.42688 18.5082     8.45582  0.181274    8.58274  44.0616    136.933     0           0           
1 1 1 30 16 17 o 4  27.3291 6.28244 12.7635     9.33978  16.3588     10.3968  3.7291     167.099     29.6271     347.099     
1 1 1 30 16 18 o 18 29.7366 6.03591 17.2671     9.46188  18.1283     9.47312  9.86367    303.474     20.7726     123.474     
1 1 1 30 16 19 o 6  35.3791 5.47286 33.732      9.18286  16.3706     10.01    24.6311    27.2508     1.3572      27.2509     
1 1 1 30 16 20 o 19 36.4045 5.76238 23.3374     9.20127  29.9022     11.3293  23.5472    345.738     3.10721     165.738     
1 1 1 30 16 21 o 19 34.2295 5.86735 17.0394     9.13481  30.9803     11.0621  16.7421    30.242      14.1467     210.242     
1 1 1 30 16 22 o 15 48.6226 4.73968 46.8746     10.0859  43.8254     12.1458  37.1438    278.625     4.58057     278.625     
1 1 1 30 16 23 o 2  52.4861 4.58378 52.9076     11.1341  52.2827     12.4023  25.9595    332.133     24.6944     152.133     
1 1 1 30 16 24 o 5  31.2594 6.17046 26.3841     9.84568  12.9663     11.3309  12.0328    296.023     19.0668     116.023     
1 1 1 30 16 25 f 0  47.7242 4.98491 41.5461     11.0353  47.2776     12.1009  22.6624    248.581     0           0           
1 1 1 30 16 26 o 2  20.5401 5.67826 0.379597    9.08329  9.94265     8.66192  4.67443    167.443     15.5943     347.443     
1 1 1 30 16 27 o 12 32.7131 5.90574 23.4263     10.059   20.7479     9.37663  21.3311    73.1005     1.32327     253.101     
1 1 1 30 16 28 o 16 18.7674 5.70882 0.954531    9.72986  1.99347     9.67212  4.02492    212.266     32.1346     212.266     
1 1 1 30 16 29 o 11 25.9699 6.09821 19.5535     10.2155  7.23498     9.07804  13.9947    318.854     7.3335      318.854     
1 1 1 30 16 30 o 19 19.3536 5.68215 5.09783     8.80537  2.03135     9.42905  6.62882    165.038     5.70669     345.038     
1 1 1 30 16 31 o 16 32.0172 5.8553  23.5689     9.51961  19.3201     9.46836  19.5157    182.944     3.79822     2.94431     
1 1 1 30 16 32 o 18 41.4022 5.11939 37.1235     10.1352  31.7039     10.2883  33.1384    170.864     9.32599     170.864     
1 1 1 30 16 33 o 11 92.4707 3.23586 163.232     15.0083  154.161     14.8824  87.2006    141.495     39.9237     141.495     
1 1 1 30 16 34 f 0  35.5992 6.23373 26.0757     11.2509  28.1971     10.892   33.7997    296.53      0           0           
1 1 1 30 16 35 o 14 43.2878 5.54008 42.2026     11.6702  34.8425     11.4491  38.2445    83.502      18.3574     83.502      
1 1 1 30 16 36 o 19 48.4276 5.28842 59.962      12.4135  36.1675     11.904   33.3531    14.2836     1.19412     194.284     
1 1 1 30 16 37 o 13 44.1412 5.74857 51.1846     12.1822  30.8653     12.0685  40.9549    213.957     24.5261     213.957     
1 1 1 30 16 38 o 1  33.9868 6.76668 21.7538     13.079   29.6479     11.4445  24.2976    264.1       6.39751     264.1       
1 1 1 30 16 39 o 1  23.068  6.54983 10.9318     12.2601  6.65825     10.8666  8.39345    120.779     0.541502    120.779     
1 1 1 30 16 40 o 10 23.7202 6.54951 12.0521     11.5514  8.19149     11.0265  8.44166    214.658     11.0044     34.6583     
1 1 1 30 16 41 o 1  24.5149 6.63198 10.6988     11.7207  12.1876     11.0671  9.37372    240.037     10.9878     60.0373     
1 1 1 30 16 42 o 5  48.2614 5.5859  55.2572     13.4741  41.2673     12.5306  42.9305    1.16668     20.2233     1.16668     
1 1 1 30 16 43 o 18 19.7012 6.08172 2.74962     11.6689  0.975037    11.0034  1.01674    114.874     26.6979     114.874     
1 1 1 30 16 44 o 19 34.0156 7.10277 30.4649     13.4513  23.0838     12.5546  21.7243    214.788     1.10677     34.7875     
1 1 1 30 16 45 o 5  35.9791 7.3896  24.3483     16.6782  36.5928     13.0576  21.244     135.447     5.35375     315.447     
1 1 1 30 16 46 o 3  33.4344 8.11239 33.5058     16.3846  23.1959     17.0199  22.3682    96.3807     2.43584     96.3807     
1 1 1 30 16 47 f 0  27.333  7.65692 24.3856     16.5339  8.63731     15.4291  4.90711    16.8888     0           0           
1 1 1 30 16 48 o 11 38.9843 7.80379 53.2089     17.0883  25.8579     16.7247  31.208     190.666     13.5354     190.666     
1 1 1 30 16 49 o 13 29.8857 7.89949 19.1727     16.4054  28.0531     15.9115  18.7603    238.594     5.56291     238.594     
1 1 1 30 16 50 o 15 22.839  7.11608 8.65504     15.9432  6.82956     15.7658  5.57545    108.764     0.444836    108.764     
1 1 1 30 16 51 o 18 23.2803 7.21951 7.35202     16.5864  11.2169     15.8091  8.0141     179.417     2.5775      359.417     
1 1 1 30 16 52 o 14 25.0833 7.56961 19.3651     17.2129  9.19213     16.6742  7.58333    203.344     0.650968    203.344     
1 1 1 30 16 53 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 17 0  f 0  11.8695 5.46275 -0.184098   7.84493  -0.184098   7.84493  6.5903     360         0           0           
1 1 1 30 17 1  o 17 89.7601 2.89329 151.141     13.0141  141.243     12.9376  69.8533    20.7859     4.78074     20.7859     
1 1 1 30 17 2  o 14 49.7604 4.25216 55.819      9.7568   37.9337     10.4354  25.0042    169.408     23.2285     349.408     
1 1 1 30 17 3  o 7  27.1041 5.80433 15.0708     8.58549  13.7835     8.54597  3.517      143.83      30.1767     323.83      
1 1 1 30 17 4  o 1  52.3408 3.96377 51.2915     9.93975  50.7885     10.5154  41.7612    162.105     7.34819     162.105     
1 1 1 30 17 5  o 18 20.665  5.54462 10.594      8.42286  0.609106    8.19489  2.67688    43.0025     19.5687     223.003     
1 1 1 30 17 6  o 7  43.4703 4.55866 34.5873     9.57178  37.3389     9.6809   22.1293    248.37      18.9168     68.37       
1 1 1 30 17 7  o 12 45.3259 4.48892 47.1488     9.73185  31.4983     9.72231  13.1696    106.52      40.3748     286.52      
1 1 1 30 17 8  o 2  90.6916 2.91407 134.068     13.1456  165.448     13.1568  71.3047    241.523     6.41358     241.523     
1 1 1 30 17 9  o 1  34.0504 5.38997 22.3177     8.91997  23.5155     9.01733  24.4024    178.887     3.05842     178.887     
1 1 1 30 17 10 o 13 57.3044 3.69192 59.6656     10.4864  61.977      10.482   43.394     93.1675     2.44071     93.1675     
1 1 1 30 17 11 o 16 59.5634 3.69666 59.4953     11.1091  72.2109     10.5674  33.9156    40.0121     20.6127     220.012     
1 1 1 30 17 12 o 12 37.9454 5.32562 26.2506     10.1372  30.4781     9.36775  33.2954    60.8126     16.0929     60.8126     
1 1 1 30 17 13 o 3  43.4278 4.94805 33.3386     10.1698  39.7998     10.6107  29.1158    174.786     4.28594     354.786     
1 1 1 30 17 14 o 4  132.4   3.03489 309.537     19.5822  329.522     20.6426  114.061    249.745     28.6884     249.745     
1 1 1 30 17 15 o 12 14.4947 4.78554 -4.33209    9.11892  -9.3019     7.96876  0.651981   313.24      6.89513     133.24      
1 1 1 30 17 16 f 0  26.5904 5.82839 5.436       9.88666  20.6863     8.96257  8.97297    263.166     0           0           
1 1 1 30 17 17 o 19 35.5742 5.53809 30.9513     9.44487  20.0953     9.88274  26.4468    128.649     20.4664     128.649     
1 1 1 30 17 18 o 5  22.1869 5.58138 14.65       8.51255  -0.266097   8.85128  7.85121    71.6532     2.50257     71.6532     
1 1 1 30 17 19 o 8  55.6187 3.98694 56.8108     10.5426  59.6513     11.3741  28.6319    272.439     24.8203     92.4395     
1 1 1 30 17 20 o 18 20.4383 5.65258 8.97476     8.54567  2.19151     8.65853  6.47071    298.196     11.0232     118.196     
1 1 1 30 17 21 o 9  32.0443 5.91355 20.8872     9.20549  21.4719     9.99059  20.4035    299.762     2.69019     119.762     
1 1 1 30 17 22 o 14 44.6907 4.60181 38.0805     9.97648  39.3624     10.0296  16.9221    71.6944     31.3473     251.694     
1 1 1 30 17 23 o 16 75.7975 3.42175 102.723     12.5194  110.671     13.3441  49.8139    151.028     12.7424     331.028     
1 1 1 30 17 24 o 8  23.4349 5.92655 6.99864     8.88039  13.2789     9.04524  9.89645    274.309     4.30345     274.309     
1 1 1 30 17 25 o 17 24.0296 6.12174 8.10145     9.09892  13.7533     9.89603  9.84926    220.747     4.62588     220.747     
1 1 1 30 17 26 o 8  22.4005 5.89076 14.6104     8.90905  -2.90324    11.4004  7.70213    236.432     2.8258      236.432     
1 1 1 30 17 27 o 7  47.4945 5.38761 50.739      10.9048  40.3573     13.2682  42.1525    70.4367     17.5157     70.4367     
1 1 1 30 17 28 o 15 33.8658 6.81414 28.892      11.2527  21.2609     13.5971  27.3404    244.078     17.8483     244.078     
1 1 1 30 17 29 o 19 21.9468 6.59848 7.01807     11.9154  1.91304     13.7358  6.665      56.9304     13.1692     236.93      
1 1 1 30 17 30 o 13 18.43   6.08678 -2.36406    13.787   -15.7296    14.5202  3.77547    330.858     11.669      150.858     
1 1 1 30 17 31 o 12 27.2754 7.0794  16.3661     12.2285  14.638      13.203   15.4015    46.833      7.25353     46.833      
1 1 1 30 17 32 o 19 30.6916 7.03984 23.0035     12.3416  19.0866     12.514   14.8943    52.924      10.8334     232.924     
1 1 1 30 17 33 o 6  24.0332 6.90361 0.0393594   15.8148  14.311      12.0666  3.87104    325.108     22.9895     145.108     
1 1 1 30 17 34 o 10 48.295  6.28571 59.9469     14.7467  40.5388     14.3902  39.0345    185.961     11.1293     185.961     
1 1 1 30 17 35 o 15 44.0962 5.93486 34.4903     12.8914  47.9791     12.2191  31.4442    317.966     2.07627     317.966     
1 1 1 30 17 36 o 3  48.6283 5.5008  54.6073     13.4878  43.1266     12.3924  32.1182    48.9616     4.10818     228.962     
1 1 1 30 17 37 o 4  21.6164 6.30639 9.66241     11.4003  2.60857     10.984   4.91794    160.813     0.833148    160.813     
1 1 1 30 17 38 o 17 54.4644 5.32201 55.8038     14.6186  64.9792     13.3585  38.8462    147.513     0.557367    147.513     
1 1 1 30 17 39 o 13 23.1318 6.40232 -1.58554    11.8263  16.4496     11.5845  9.88657    100.805     7.73597     280.805     
1 1 1 30 17 40 o 1  37.7243 6.98772 32.0601     13.7539  32.6251     12.9926  32.5519    122.018     16.5984     122.018     
1 1 1 30 17 41 o 16 18.6644 6.07189 1.85987     14.7548  -8.27791    10.892   4.58565    127.85      11.2888     307.85      
1 1 1 30 17 42 o 1  19.4104 6.23473 0.952649    14.7323  -3.16697    11.43    6.36013    299.407     0.554251    119.407     
1 1 1 30 17 43 o 13 20.0492 6.33051 9.66965     14.7039  -9.1783     11.5634  7.8249     126.439     1.52725     306.439     
1 1 1 30 17 44 o 18 25.089  7.21973 13.1497     15.7219  12.076      12.8452  13.8424    339.762     0.717134    159.762     
1 1 1 30 17 45 o 4  25.8876 7.37002 18.1946     16.5296  11.8053     12.7509  13.1885    164.135     3.85401     344.135     
1 1 1 30 17 46 o 8  23.4198 7.05824 19.5254     16.9417  0.444173    12.3219  5.81036    125.838     1.86014     125.838     
1 1 1 30 17 47 o 19 22.432  6.86323 -0.883672   16.9976  12.5831     13.0293  4.67211    50.0103     0.67181     50.0103     
1 1 1 30 17 48 o 11 25.3339 7.53608 22.8866     16.6699  4.18738     17.3092  8.26292    221.314     2.28883     221.314     
1 1 1 30 17 49 o 15 18.8296 6.29835 -8.69363    15.8969  -2.47576    15.6523  0.396185   279.533     0.489823    99.5329     
1 1 1 30 17 50 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 17 51 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 18 0  o 10 93.9501 2.8915  159.349     13.555   159.349     13.555   78.8711    180         14.3279     180         
1 1 1 30 18 1  o 3  50.6974 4.08311 49.3192     10.1666  47.6321     10.2072  40.8862    9.94975     7.37151     9.94975     
1 1 1 30 18 2  o 4  48.3773 4.40268 34.2501     10.141   56.1326     10.0402  37.978     52.2009     5.22452     52.2009     
1 1 1 30 18 3  o 17 54.3061 4.10726 56.2027     10.7563  54.9935     11.2365  53.2169    349.449     27.4549     349.449     
1 1 1 30 18 4  o 17 19.9449 5.59884 2.85709     8.41416  7.17876     8.44483  6.31672    149.082     0.157697    329.082     
1 1 1 30 18 5  o 9  43.4944 4.87577 24.0915     9.60129  51.7001     10.1982  37.5612    244.093     13.0667     244.093     
1 1 1 30 18 6  o 19 60.2143 3.73364 71.8534     11.4533  63.4942     10.8478  34.2417    100.01      21.6174     280.01      
1 1 1 30 18 7  o 9  48.3929 4.4895  51.8655     10.1645  38.212      10.7027  30.2983    306.114     10.7291     126.114     
1 1 1 30 18 8  o 19 41.4812 4.84098 35.9439     9.71559  31.1583     9.67743  21.1029    70.4104     18.4154     250.41      
1 1 1 30 18 9  o 6  63.8533 3.53278 72.6511     11.2583  78.768      11.1489  56.6021    288.317     18.424      288.317     
1 1 1 30 18 10 o 4  18.0433 5.37317 -0.67417    8.25655  4.44068     8.48303  2.01205    72.3491     26.8946     72.3491     
1 1 1 30 18 11 o 10 28.7819 5.737   24.028      9.35109  9.65708     8.84561  21.6067    170.363     10.379      170.363     
1 1 1 30 18 12 o 3  25.0244 5.91669 10.5797     8.77965  13.9437     8.75371  13.0142    123.276     6.36056     123.276     
1 1 1 30 18 13 o 2  31.9059 6.05097 19.9747     9.57652  22.3295     10.1777  18.0628    61.7552     8.16651     241.755     
1 1 1 30 18 14 o 2  22.6116 5.90131 7.39971     8.69954  10.6344     9.02842  6.39046    135.156     16.6675     315.155     
1 1 1 30 18 15 o 9  44.5251 4.86761 38.2773     10.7761  39.4649     10.2232  45.4485    282.796     29.7842     282.796     
1 1 1 30 18 16 o 9  34.105  5.70222 23.0198     9.70134  24.8259     9.49055  28.3865    343.861     20.6839     343.861     
1 1 1 30 18 17 o 10 64.8653 3.65573 81.3835     12.1751  76.3491     11.3982  52.7839    96.6503     9.37511     96.6503     
1 1 1 30 18 18 o 11 22.8028 6.04764 8.87131     9.24057  9.54054     9.45184  12.346     272.423     0.520916    272.423     
1 1 1 30 18 19 o 16 47.0137 4.65758 43.7055     10.65    42.6519     10.6932  24.4356    51.3519     20.0599     231.352     
1 1 1 30 18 20 f 0  63.6569 4.02382 86.8232     12.2208  67.79       12.8721  32.3303    172.258     0           0           
1 1 1 30 18 21 o 6  30.566  6.16257 16.0493     10.6315  23.4483     9.59447  18.8088    220.36      3.55944     40.3597     
1 1 1 30 18 22 o 2  37.8712 5.92454 34.5315     10.729   25.7917     11.2339  30.8125    182.537     9.65657     182.537     
1 1 1 30 18 23 f 0  24.699  6.05762 8.87167     9.16592  15.396      9.43094  12.1465    13.2103     0           0           
1 1 1 30 18 24 o 15 32.3145 6.72064 20.7626     12.0889  25.2225     11.2967  20.2183    98.0084     3.18117     278.008     
1 1 1 30 18 25 o 7  68.6428 4.22806 83.5735     14.4005  98.1848     14.2922  64.3311    328.265     28.3121     328.265     
1 1 1 30 18 26 o 12 42.4717 6.24311 33.1919     13.5517  44.03       12.1222  30.0422    306.219     0.163509    306.22      
1 1 1 30 18 27 o 16 40.6478 6.12849 30.8411     12.4536  39.7477     11.7739  33.3945    229.849     11.1001     229.849     
1 1 1 30 18 28 o 14 38.276  6.30306 37.0732     12.3651  26.6831     11.474   28.9989    77.4361     5.95471     77.4361     
1 1 1 30 18 29 o 15 18.8043 5.84035 2.3087      10.9207  -0.586424   10.2884  4.8215     253.668     4.54812     73.6675     
1 1 1 30 18 30 o 19 46.2641 6.21423 46.1565     13.0124  45.4565     14.697   42.3221    244.484     21.6824     244.484     
1 1 1 30 18 31 o 9  48.4699 6.22043 48.41       13.6643  52.221      15.431   43.6641    258.539     20.6726     258.539     
1 1 1 30 18 32 f 0  40.141  7.06826 27.5759     15.1039  46.3847     14.075   41.1313    261.736     0           0           
1 1 1 30 18 33 o 2  67.5136 4.78012 87.3154     15.031   93.7051     16.8652  45.3451    110.981     7.3616      290.981     
1 1 1 30 18 34 o 3  25.7724 7.28336 13.8776     13.5913  11.258      14.98    8.14371    346.668     16.942      166.668     
1 1 1 30 18 35 o 2  58.1793 6.37236 82.4773     17.6999  63.0649     17.8882  44.1974    184.378     5.14901     184.378     
1 1 1 30 18 36 o 18 24.2227 7.31921 -6.10592    19.7714  14.1469     14.4456  11.8383    237.259     4.60672     237.259     
1 1 1 30 18 37 o 9  25.8707 7.92345 4.78245     23.7448  12.4337     15.5005  14.8718    322.807     0.460956    142.807     
1 1 1 30 18 38 f 0  52.4719 7.94351 70.421      22.2484  61.6872     18.2573  29.1787    325.751     0           0           
1 1 1 30 18 39 o 19 32.9343 8.44968 22.007      21.5576  32.7236     16.4332  23.3468    6.51354     4.89707     6.51354     
1 1 1 30 18 40 o 5  24.5925 7.3671  12.5017     16.298   8.16031     15.1309  13.8518    292.087     0.901392    292.087     
1 1 1 30 18 41 o 7  54.3073 7.17193 65.607      18.8936  72.592      18.6768  48.1067    318.866     20.782      318.866     
1 1 1 30 18 42 o 7  26.7632 7.77966 21.3679     16.9549  10.764      17.0436  15.3313    204.299     5.94183     204.299     
1 1 1 30 18 43 o 18 27.0632 7.82125 19.2266     16.8456  16.7896     16.8087  11.8934    296.806     9.47447     116.806     
1 1 1 30 18 44 o 1  27.1744 7.88668 18.0437     17.4616  20.042      16.9598  14.7515    24.4559     0.0226738   24.4565     
1 1 1 30 18 45 o 16 19.0329 6.21535 -7.36221    15.7244  2.44163     12.6966  3.93112    356.738     6.5363      176.738     
1 1 1 30 18 46 o 2  18.5068 6.13106 -6.77445    16.7462  -1.05781    12.1252  1.72014    257.38      2.3835      77.3799     
1 1 1 30 18 47 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 18 48 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 19 0  o 1  13.3191 5.96473 2.08716     8.57611  2.08716     8.57611  0.358247   180         2.27836     7.78139e-05 
1 1 1 30 19 1  o 13 29.1378 5.51733 6.70639     9.12492  27.6673     9.21419  14.4093    136.237     11.8269     316.237     
1 1 1 30 19 2  o 10 84.2041 3.13983 139.192     13.16    122.702     13.1982  65.8134    316.439     4.21031     316.439     
1 1 1 30 19 3  o 4  19.1313 5.56799 1.39618     8.73932  5.9729      8.63722  6.39133    334.147     8.73943     154.147     
1 1 1 30 19 4  o 10 37.3098 5.35738 18.096      9.80102  39.6081     9.6423   32.3549    322.149     12.8854     322.149     
1 1 1 30 19 5  o 19 31.2172 5.78186 16.5816     9.20928  24.0177     9.29223  19.5988    22.0853     4.10897     202.085     
1 1 1 30 19 6  o 8  48.0438 4.54571 50.1687     10.6131  39.7832     10.5773  40.781     221.117     11.3243     221.117     
1 1 1 30 19 7  o 3  34.7952 5.68231 26.8291     9.56432  23.2048     9.87821  21.6552    161.505     6.15677     341.505     
1 1 1 30 19 8  o 4  28.1494 5.91774 11.6757     9.04192  21.2398     9.35796  21.154     20.683      8.93127     20.683      
1 1 1 30 19 9  o 17 22.7958 6.02442 10.4858     8.89648  7.93669     9.73535  9.36222    215.197     10.2868     35.1969     
1 1 1 30 19 10 o 15 40.1914 5.11495 36.7431     9.94941  28.2452     9.83249  29.6553    188.488     1.50254     188.488     
1 1 1 30 19 11 o 11 36.5662 5.46271 18.5954     9.78512  37.165      9.81338  23.7722    190.605     4.62988     10.6049     
1 1 1 30 19 12 o 8  89.3279 3.26469 149.725     14.3513  146.536     14.7686  80.6543    336.711     26.8116     336.711     
1 1 1 30 19 13 o 11 34.9679 5.87866 24.5238     10.58    26.8213     9.74702  30.4812    174.475     14.717      174.475     
1 1 1 30 19 14 o 6  24.0705 6.18335 7.64036     10.2079  14.0824     9.50009  2.79168    231.155     39.2228     231.155     
1 1 1 30 19 15 o 4  42.7212 4.90832 34.7393     10.1317  38.0913     10.1481  30.9558    148.549     0.157227    148.549     
1 1 1 30 19 16 o 13 50.6504 4.34707 43.7825     10.6636  56.2035     10.7864  44.9169    106.629     16.2163     106.629     
1 1 1 30 19 17 o 13 41.6491 5.26834 34.8009     10.719   35.7473     10.4604  26.6916    279.463     6.8032      99.4627     
1 1 1 30 19 18 o 1  30.4764 6.22838 23.0656     10.3435  17.1218     9.87493  15.9089    304.517     10.1101     124.517     
1 1 1 30 19 19 o 5  22.4667 6.28571 11.251      10.7903  5.02949     10.4114  11.2062    244.748     1.54525     64.7477     
1 1 1 30 19 20 o 15 19.1996 5.94049 -3.52195    10.4904  5.21738     11.4956  2.68809    32.1968     17.7114     212.197     
1 1 1 30 19 21 o 9  25.5783 6.84332 17.0784     11.907   7.73275     12.8664  13.6563    218.357     5.60851     218.357     
1 1 1 30 19 22 o 4  40.0463 6.45079 34.1869     13.197   35.7183     12.1255  33.688     24.6302     12.5396     24.6302     
1 1 1 30 19 23 o 13 25.4534 6.5764  19.9679     11.851   5.18419     11.1254  14.2138    191.225     1.17231     11.2246     
1 1 1 30 19 24 o 19 56.2251 5.64065 71.0123     16.7379  60.083      14.1761  48.8291    236.929     16.4942     236.929     
1 1 1 30 19 25 o 16 19.6258 6.03993 -4.03263    11.6449  6.26807     11.1735  5.39189    237.175     2.5564      57.1749     
1 1 1 30 19 26 o 11 38.8897 6.6483  31.6        13.0131  35.8147     12.6544  27.4914    145.9       1.50293     145.9       
1 1 1 30 19 27 o 14 21.3351 6.23696 -0.689161   11.2893  11.0737     11.2257  7.01974    342.593     9.1961      162.593     
1 1 1 30 19 28 o 6  58.4711 5.07252 59.1504     14.135   79.5051     14.716   55.079     290.665     26.4189     290.665     
1 1 1 30 19 29 o 10 31.9994 7.2208  25.1655     13.0105  22.4214     13.1551  20.3646    146.587     1.30354     326.587     
1 1 1 30 19 30 o 7  25.4301 6.73075 3.28974     12.2313  20.7214     12.4956  14.5079    117.981     0.693145    297.981     
1 1 1 30 19 31 f 0  21.8388 6.62334 2.0738      14.809   6.8836      11.5402  8.69789    192.594     0           0           
1 1 1 30 19 32 o 6  41.66   7.33289 50.6091     16.7379  31.0365     14.0783  31.9968    118.316     6.12898     118.316     
1 1 1 30 19 33 o 7  38.1433 7.57703 39.0701     16.4841  30.7586     13.6926  23.4742    309.51      6.12528     129.51      
1 1 1 30 19 34 o 16 51.396  6.63165 56.4106     17.807   60.3655     14.8337  47.7166    90.7429     23.2308     90.7429     
1 1 1 30 19 35 o 19 23.9479 7.18562 16.5395     15.5086  -2.93455    15.9967  11.4422    358.834     6.244       178.834     
1 1 1 30 19 36 o 14 22.0349 6.91396 -4.80185    15.611   9.89375     15.5414  9.94938    1.77344     2.2194      1.77344     
1 1 1 30 19 37 o 11 25.4541 7.5462  8.00939     16.2518  16.7439     16.4574  15.2896    112.394     2.39641     112.394     
1 1 1 30 19 38 o 11 45.3429 8.10213 51.7792     18.1034  54.2062     18.7285  41.5061    277.32      34.1814     277.32      
1 1 1 30 19 39 o 7  29.553  8.32819 43.9835     22.2819  2.35489     17.1958  19.4003    203.972     8.86288     203.972     
1 1 1 30 19 40 o 5  45.2501 8.48006 60.9714     23.6074  53.4671     16.0975  41.2604    163.346     23.9498     163.346     
1 1 1 30 19 41 o 9  18.7901 6.42152 -3.35567    22.2998  -9.01544    11.7244  4.16631    125.022     7.05866     305.022     
1 1 1 30 19 42 o 11 23.4032 7.39181 7.08407     23.1765  10.2362     13.6131  9.06375    159.212     5.59688     339.212     
1 1 1 30 19 43 o 12 23.0404 7.31755 9.03951     23.3219  8.65642     12.8927  6.12962    206.289     0.0803372   26.2889     
1 1 1 30 19 44 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 19 45 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 20 0  o 13 50.0114 4.48591 48.2992     10.7505  48.2992     10.7505  50.7137    180         24.7292     180         
1 1 1 30 20 1  f 0  102.136 3.11492 180.447     16.288   206.813     15.3748  60.196     248.726     0           0           
1 1 1 30 20 2  o 13 30.845  6.11425 16.5722     9.89444  24.435      10.0289  19.7571    92.4565     2.84923     272.457     
1 1 1 30 20 3  f 0  29.4952 6.02881 23.1465     9.42933  13.8964     9.94521  20.3993    145.577     0           0           
1 1 1 30 20 4  o 7  31.4226 6.06498 20.878      9.62562  21.5556     10.0067  25.7434    286.661     15.6963     286.661     
1 1 1 30 20 5  o 2  44.4097 4.91542 38.1808     10.3779  40.7826     10.7852  39.4808    331.388     15.009      331.388     
1 1 1 30 20 6  o 11 26.0415 6.225   16.0699     9.80415  12.2815     9.58295  12.4124    70.3083     9.92457     250.308     
1 1 1 30 20 7  o 16 56.1038 4.31354 65.0462     12.1296  57.3567     11.7164  54.423     198.585     26.3495     198.585     
1 1 1 30 20 8  o 8  16.0949 5.17177 -3.14068    9.55161  -2.6836     8.6352   2.96621    214.836     5.42094     34.8358     
1 1 1 30 20 9  o 4  37.2597 6.15199 25.5931     11.9379  34.1821     10.7845  20.4544    332.564     12.8225     152.564     
1 1 1 30 20 10 o 10 19.7493 5.80835 6.29568     9.39649  2.13514     9.74361  7.65306    317.129     4.15629     137.129     
1 1 1 30 20 11 o 18 25.8913 5.95546 23.6016     10.388   2.23781     9.72087  9.09664    29.3705     17.048      209.37      
1 1 1 30 20 12 o 13 37.6923 5.85024 21.3182     10.8499  39.7791     10.9571  34.1537    132.868     17.6885     132.868     
1 1 1 30 20 13 o 18 34.5315 6.43257 23.7225     11.7158  28.7442     10.9902  29.9676    54.9855     16.9068     54.9855     
1 1 1 30 20 14 o 16 43.579  6.03289 40.9771     12.5671  39.7575     12.8366  29.3273    322.682     4.48748     142.682     
1 1 1 30 20 15 o 15 47.5993 5.54172 47.5106     12.8477  46.1791     12.6715  42.3137    345.585     16.3587     345.585     
1 1 1 30 20 16 f 0  26.551  6.71226 13.7663     11.3904  16.2194     11.2607  21.3539    233.708     0           0           
1 1 1 30 20 17 o 3  68.2028 4.35547 81.5614     14.635   100.322     14.6567  67.257     90.7799     33.8954     90.7799     
1 1 1 30 20 18 o 15 32.8463 6.70043 17.948      12.0008  30.7624     11.9691  20.3096    255.638     4.07451     75.638      
1 1 1 30 20 19 f 0  74.4765 4.23752 102.568     15.9303  112.996     15.3513  42.0101    323.451     0           0           
1 1 1 30 20 20 o 4  27.1908 6.72685 20.1586     11.6348  11.8613     11.3509  15.7092    77.3297     1.7537      257.33      
1 1 1 30 20 21 o 1  21.6222 6.3441  5.56297     11.7077  7.28292     10.9145  4.18462    115.215     18.2926     295.215     
1 1 1 30 20 22 o 3  40.8345 6.50778 39.5057     12.972   34.3252     13.0483  30.6659    222.043     4.19375     222.043     
1 1 1 30 20 23 o 5  39.3711 6.47752 28.7187     12.8461  40.1836     12.429   28.0825    85.3963     1.06277     85.3963     
1 1 1 30 20 24 o 8  34.2444 7.00031 17.8748     15.081   35.312      12.3443  25.3519    36.2396     18.0437     36.2396     
1 1 1 30 20 25 o 8  44.4814 6.5997  54.0747     15.6245  34.5261     12.9968  32.1727    252.711     0.803943    252.711     
1 1 1 30 20 26 o 9  18.2882 6.0344  2.20057     15.446   -13.3424    11.013   5.21774    1.04855     8.04509     181.049     
1 1 1 30 20 27 o 1  22.9497 6.95432 5.55657     16.6539  7.08291     12.1246  10.1141    165.288     7.88969     345.289     
1 1 1 30 20 28 o 4  27.3352 7.53995 22.2718     16.9706  10.6478     12.8426  7.83005    121.242     21.7323     301.242     
1 1 1 30 20 29 o 15 48.322  7.7745  46.0745     20.3219  66.278      17.0271  28.6799    37.1685     12.4709     217.168     
1 1 1 30 20 30 o 18 29.5309 7.88024 27.2027     17.6323  15.1147     14.2954  19.491     272.201     1.03993     272.201     
1 1 1 30 20 31 o 19 17.7149 5.86918 -22.3771    16.3193  -0.214658   11.7718  4.45986    120.464     1.06144     300.464     
1 1 1 30 20 32 o 1  24.5622 7.20183 1.95292     17.1977  16.4352     13.6753  13.5659    235.442     5.62085     235.442     
1 1 1 30 20 33 o 18 29.7142 8.11716 0.629174    19.0023  38.8711     19.5058  19.0913    202.791     0.151802    202.791     
1 1 1 30 20 34 o 9  37.3935 8.31368 39.1521     19.8501  37.1786     15.33    20.2834    95.1499     11.3269     275.15      
1 1 1 30 20 35 o 11 25.1241 7.55219 15.12       19.375   11.3539     13.9143  14.2325    47.5651     2.3921      47.5651     
1 1 1 30 20 36 o 13 20.9542 6.63796 -7.34351    18.2563  8.34827     12.5677  6.99558    164.272     0.0769829   344.272     
1 1 1 30 20 37 o 9  38.4745 8.48185 49.8561     21.4486  37.5915     15.0506  32.3661    201.973     17.7482     201.973     
1 1 1 30 20 38 f 0  21.8362 6.64849 -15.8145    18.771   15.8726     12.7512  10.2352    220.757     0           0           
1 1 1 30 20 39 o 11 21.3079 6.89663 17.8283     19.6064  -6.51693    12.311   5.83841    115.116     1.73844     295.116     
1 1 1 30 20 40 o 3  21.3458 6.97011 -1.93518    19.2099  6.58216     16.2444  6.13998    27.209      5.12533     207.209     
1 1 1 30 20 41 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 20 42 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 21 0  o 7  19.7012 7.57746 11.6641     10.5636  11.6641     10.5636  4.77826    180         0.133656    180         
1 1 1 30 21 1  o 12 68.949  4.17391 81.4022     14.2144  103.536     14.13    61.9858    94.6495     20.4755     94.6495     
1 1 1 30 21 2  o 15 25.8591 6.41369 8.99472     10.5519  18.7754     10.6356  15.387     40.7986     0.356727    220.799     
1 1 1 30 21 3  o 16 49.6544 5.12698 52.5775     12.2181  47.7534     12.4914  44.3262    44.9687     16.3047     44.9687     
1 1 1 30 21 4  o 18 68.1073 4.22195 83.3169     14.0421  97.2932     14.4372  62.5917    174.893     23.1827     174.893     
1 1 1 30 21 5  o 17 23.0834 6.48852 8.45255     12.0542  10.059      10.5008  9.08725    286.353     10.3007     106.353     
1 1 1 30 21 6  o 16 27.0213 6.61578 16.9398     10.9598  14.8987     10.8959  16.053     180.093     7.45104     180.093     
1 1 1 30 21 7  o 7  21.6829 6.19388 2.57416     10.9167  10.9637     10.437   9.36029    64.334      1.58825     244.334     
1 1 1 30 21 8  o 7  42.3555 6.10152 36.6642     11.7917  40.761      13.2344  32.6441    103.447     4.6135      103.447     
1 1 1 30 21 9  o 16 26.753  6.80185 6.65867     12.4142  22.6094     12.3065  8.41035    86.4155     19.4876     266.416     
1 1 1 30 21 10 o 9  38.5548 6.79414 31.5608     12.9631  35.8617     13.2241  29.5284    224.012     5.33376     224.012     
1 1 1 30 21 11 o 8  27.8522 7.36907 13.9273     13.1364  20.7225     14.6553  7.59815    188.287     4.44274     188.287     
1 1 1 30 21 12 o 13 21.605  6.60894 6.68891     14.2766  2.67418     11.9244  0.811443   326.761     26.4295     146.761     
1 1 1 30 21 13 o 12 79.5473 4.369   126.089     16.8636  121.724     17.658   80.2895    218.749     41.6665     218.749     
1 1 1 30 21 14 o 13 23.9529 6.54911 17.3211     12.039   3.19953     11.2997  12.4065    146.402     1.58572     146.402     
1 1 1 30 21 15 o 3  17.4494 5.56793 -10.8065    11.2768  3.2242      10.329   3.51632    291.486     8.98736     111.486     
1 1 1 30 21 16 o 12 29.3326 7.06588 20.215      12.9415  19.2688     11.9387  15.3109    7.32683     8.91552     187.327     
1 1 1 30 21 17 o 12 29.8899 6.91025 28.4982     13.0499  12.3181     11.7447  13.4653    106.946     14.3142     286.946     
1 1 1 30 21 18 o 8  31.263  7.01536 28.2327     12.8733  17.0192     12.3153  8.10236    116.598     28.2313     296.598     
1 1 1 30 21 19 o 16 24.0965 6.98074 -0.251356   14.878   16.3877     13.5857  11.3545    240.021     4.60466     240.021     
1 1 1 30 21 20 o 4  47.1985 6.88557 42.0982     17.424   58.3134     13.8814  38.4335    222.146     8.71899     222.146     
1 1 1 30 21 21 o 11 32.6527 7.73592 36.6004     17.5626  16.667      12.5971  26.8722    351.285     12.915      351.285     
1 1 1 30 21 22 o 15 24.396  7.17773 20.3174     16.9433  -0.707511   12.6283  14.8588    29.26       1.59575     29.26       
1 1 1 30 21 23 o 4  20.8306 6.66392 1.44171     17.8737  0.0717831   11.6264  8.24159    267.165     8.46279     87.1648     
1 1 1 30 21 24 o 4  31.4194 8.02547 29.375      18.791   20.6031     13.6267  17.3382    68.4946     8.49534     248.495     
1 1 1 30 21 25 o 4  41.0985 7.93716 36.9148     20.0508  47.552      15.0044  32.8665    3.63537     8.09196     3.63537     
1 1 1 30 21 26 o 6  19.5672 6.43616 1.78664     18.0185  -6.40198    11.4318  8.04009    210.395     3.85252     30.3949     
1 1 1 30 21 27 o 12 23.2438 6.99545 -1.47399    18.0291  12.9263     12.6686  13.2004    63.0828     2.34828     63.0828     
1 1 1 30 21 28 f 0  56.6197 7.15039 78.5009     22.2137  71.8541     16.4651  32.3812    319.13      0           0           
1 1 1 30 21 29 o 12 30.5277 8.0354  17.7284     20.1951  29.3824     15.0395  23.2918    239.701     10.2845     239.701     
1 1 1 30 21 30 o 13 26.8133 7.51304 10.1068     19.1833  20.9294     13.2036  14.0451    31.7522     6.34938     211.752     
1 1 1 30 21 31 o 4  22.1731 6.99458 6.55451     19.0354  5.32599     12.6221  9.40622    288.874     1.41141     288.874     
1 1 1 30 21 32 o 18 19.9316 6.6173  4.63379     20.0815  -5.33819    12.0144  6.27515    152.454     1.73721     332.454     
1 1 1 30 21 33 o 17 31.1208 8.65184 27.7829     23.2844  32.7983     17.7984  17.2462    32.7205     10.3663     32.7205     
1 1 1 30 21 34 o 2  30.3464 8.44311 35.6385     23.6424  23.6931     14.6367  19.1166    298.146     1.93334     298.146     
1 1 1 30 21 35 o 17 19.5182 6.55657 3.35246     20.1704  -7.54622    13.2839  4.76969    39.2071     5.98559     219.207     
1 1 1 30 21 36 o 17 20.6629 6.75753 -2.77012    20.5718  4.71706     13.4436  3.86809    18.0653     1.35679     198.065     
1 1 1 30 21 37 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 21 38 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 21 39 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 22 0  o 1  13.063  6.09233 -0.254036   10.2502  -0.254036   10.2502  0.0996196  7.61493e-05 2.35666     180         
1 1 1 30 22 1  o 3  151.916 3.38645 423.089     25.7757  446.099     25.7051  155.964    207.219     78.9958     207.219     
1 1 1 30 22 2  o 2  77.1842 4.14079 113.539     15.924   118.023     15.8628  65.4306    317.42      13.7797     317.42      
1 1 1 30 22 3  o 16 56.7349 5.29088 67.3717     13.9903  65.0077     15.263   59.5008    60.4474     36.0342     60.4474     
1 1 1 30 22 4  o 4  19.6608 6.05049 -5.69769    11.7715  7.66715     11.4216  6.43575    213.619     0.451199    33.619      
1 1 1 30 22 5  f 0  45.3258 6.54998 46.0938     14.8959  45.0929     13.8488  30.7402    51.6754     0           0           
1 1 1 30 22 6  o 3  22.7852 6.59071 2.70691     12.5888  12.6895     11.989   10.6129    171.495     6.53931     351.495     
1 1 1 30 22 7  f 0  17.6416 5.67498 3.86746     11.7052  -12.5812    11.0196  6.95894    132.179     0           0           
1 1 1 30 22 8  o 10 25.7983 6.97467 16.798      13.2028  11.0477     12.0131  13.8422    13.4901     5.84802     193.49      
1 1 1 30 22 9  o 14 47.0485 6.94925 45.9919     16.8255  54.4664     14.8428  36.9137    295.59      4.93079     295.59      
1 1 1 30 22 10 o 16 23.4852 7.34594 6.1665      17.0582  4.03947     17.0545  10.0701    51.6805     3.9805      51.6805     
1 1 1 30 22 11 o 7  61.4997 8.55406 86.7919     30.6924  99.7188     18.1415  52.8133    153.565     14.3015     153.565     
1 1 1 30 22 12 o 15 46.5662 7.35346 61.6249     18.5586  40.6609     15.0538  39.8793    128.211     12.2168     128.211     
1 1 1 30 22 13 o 8  86.9718 4.81185 164.137     22.5402  139.126     19.0965  93.4695    37.4877     55.8099     37.4877     
1 1 1 30 22 14 o 9  29.9576 7.64297 16.0171     17.1685  25.2571     13.568   16.9215    152.588     7.56654     332.588     
1 1 1 30 22 15 o 18 48.3573 6.98094 66.3956     18.0564  41.7259     14.7843  50.7224    203.685     33.2976     203.685     
1 1 1 30 22 16 o 3  40.0233 8.43818 33.683      20.2919  49.8723     17.6901  30.0762    343.4       3.23206     343.4       
1 1 1 30 22 17 f 0  28.258  7.87097 18.6334     19.0709  18.1883     14.0886  12.7767    227.918     0           0           
1 1 1 30 22 18 o 11 22.6556 7.05627 2.09257     18.337   7.08681     13.3396  11.1197    91.4047     5.53262     271.405     
1 1 1 30 22 19 o 6  23.5686 7.2644  7.68998     18.3996  7.34599     13.9357  3.07165    145.463     1.65991     145.463     
1 1 1 30 22 20 o 8  20.3154 6.59623 -1.21512    17.665   -0.961952   12.8277  8.29493    54.4805     7.03989     234.481     
1 1 1 30 22 21 o 8  21.6156 6.82253 16.3564     17.6001  -11.5711    12.9283  10.604     189.486     3.57904     9.48561     
1 1 1 30 22 22 o 2  29.3802 7.84466 11.2775     19.427   28.898      15.1253  20.9229    263.641     4.23167     263.641     
1 1 1 30 22 23 o 14 21.0492 6.72613 15.7126     17.7736  -12.835     12.5446  8.99927    121.802     6.86505     301.802     
1 1 1 30 22 24 o 16 23.7573 7.26441 9.34906     18.6043  9.80664     13.4239  13.6346    252.615     1.64427     252.615     
1 1 1 30 22 25 o 15 21.3043 6.88371 8.65027     18.5856  -3.05222    13.6895  9.73654    195.078     1.00198     15.0777     
1 1 1 30 22 26 o 13 27.5564 7.80874 14.1632     19.1125  23.6086     15.1434  16.5617    324.177     1.2665      144.177     
1 1 1 30 22 27 o 5  23.2927 7.25987 9.70764     18.7918  9.03374     14.3785  10.741     219.52      5.31019     39.52       
1 1 1 30 22 28 o 19 54.81   7.91325 81.1992     23.3454  77.469      18.4871  51.5427    174.409     25.2923     174.409     
1 1 1 30 22 29 o 17 23.9267 7.34004 28.9894     19.5097  -5.32157    13.8075  10.296     141.797     2.10029     141.797     
1 1 1 30 22 30 o 15 23.6672 7.27594 6.74482     19.2478  14.8202     14.2513  9.73227    105.803     1.17223     105.803     
1 1 1 30 22 31 o 10 25.1871 7.55537 9.01158     20.5349  20.3745     14.8517  9.05648    314.187     2.82238     314.187     
1 1 1 30 22 32 o 18 15.7818 5.49449 -14.2241    17.4586  -15.934     11.7383  0.495271   342.838     3.57661     162.838     
1 1 1 30 22 33 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 22 34 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 22 35 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 23 0  o 17 22.7664 9.18759 17.3174     16.4513  17.3174     16.4513  10.8181    1.42532e-06 5.40511     1.42532e-06 
1 1 1 30 23 1  f 0  28.9172 7.96568 27.1541     16.9015  11.8563     17.5066  5.14663    57.3681     0           0           
1 1 1 30 23 2  o 1  71.339  6.60688 111.657     22.9813  115.622     23.1189  55.9969    173.046     3.62234     173.046     
1 1 1 30 23 3  o 6  60.8759 7.02787 75.5251     21.9976  93.9424     18.2257  50.3719    286.087     9.14907     286.087     
1 1 1 30 23 4  o 6  81.8331 5.81246 147.607     25.9244  137.875     20.7616  75.6305    46.9179     26.7253     46.9179     
1 1 1 30 23 5  o 16 27.8193 7.80297 20.5163     18.9291  16.005      13.5989  11.9388    212.624     14.8706     32.6245     
1 1 1 30 23 6  o 14 83.2897 5.89221 146.326     26.4074  150.671     21.4025  77.9407    265.519     29.1843     265.519     
1 1 1 30 23 7  o 8  20.9757 6.65221 -5.45081    17.3979  5.80058     12.6971  9.09556    154.927     2.3958      154.927     
1 1 1 30 23 8  o 11 32.1648 8.00417 23.1951     18.1878  29.9445     14.8297  20.8053    193.535     3.23191     13.5354     
1 1 1 30 23 9  o 17 28.3989 8.04078 1.49568     20.8363  30.6251     17.8694  20.5887    34.5074     10.7109     34.5074     
1 1 1 30 23 10 o 16 49.16   9.01548 85.9309     27.6818  50.0156     17.2559  37.7565    323.233     3.28578     323.233     
1 1 1 30 23 11 o 15 24.7898 7.37139 5.54229     19.2336  14.8777     13.4558  10.5924    286.088     12.0837     106.088     
1 1 1 30 23 12 o 19 45.3904 9.04229 66.096      24.7654  50.9442     18.2602  30.0519    267.528     6.41274     87.528      
1 1 1 30 23 13 o 18 19.7902 6.54137 6.96396     18.3837  -12.6314    12.7209  7.64749    295.229     0.818056    295.229     
1 1 1 30 23 14 o 7  63.3761 7.51625 102.579     25.558   92.3613     20.1873  52.7792    333.306     10.655      333.306     
1 1 1 30 23 15 o 4  25.3511 7.62506 13.311      20.1793  13.0553     14.1679  15.4241    252.577     6.93353     252.577     
1 1 1 30 23 16 o 10 34.6823 8.88707 50.4617     21.7842  22.7719     19.5454  24.575     234.07      1.36281     234.07      
1 1 1 30 23 17 o 1  24.8798 7.95532 1.40009     32.0932  12.3842     14.9383  11.728     8.97605     8.54827     188.976     
1 1 1 30 23 18 o 10 21.1332 7.01818 0.404648    19.2133  -5.27103    18.5993  5.7678     314.253     1.49508     314.253     
1 1 1 30 23 19 o 16 26.139  7.75675 19.2278     20.1656  14.568      14.3168  16.3823    154.366     5.0838      154.366     
1 1 1 30 23 20 o 15 17.5141 6.00401 -1.80367    18.2156  -17.7151    12.3003  4.16192    234.728     3.36084     54.7278     
1 1 1 30 23 21 o 6  18.7115 6.29178 -10.5881    19.1559  -3.301      13.3998  5.24459    333.257     2.63468     153.257     
1 1 1 30 23 22 o 17 24.8963 7.62751 17.9324     20.331   11.9465     14.7778  5.99345    165.003     2.7653      165.003     
1 1 1 30 23 23 o 5  20.3463 6.76923 -1.58062    22.2001  0.15469     13.3496  6.86644    284.681     6.37458     104.681     
1 1 1 30 23 24 o 14 17.3691 5.91699 -19.4664    19.0325  -4.54169    12.5703  3.07982    130.799     7.22245     310.799     
1 1 1 30 23 25 o 11 32.3964 8.51819 46.4062     20.852   24.0155     16.2868  22.7273    72.4656     5.58473     72.4656     
1 1 1 30 23 26 o 2  19.6775 6.51919 0.528457    18.2807  -1.09681    13.8548  5.0122     237.055     4.30386     57.055      
1 1 1 30 23 27 f 0  34.669  8.43995 33.3292     21.4286  44.7877     16.7485  16.072     49.3332     0           0           
1 1 1 30 23 28 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 23 29 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 23 30 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 24 0  o 13 19.8817 9.57274 4.55694     29.2429  4.55694     29.2429  5.42057    3.06031e-05 18.1708     180         
1 1 1 30 24 1  o 19 23.6866 8.04101 -17.0637    29.2904  8.40154     27.0512  5.93849    58.9754     20.0038     238.975     
1 1 1 30 24 2  o 14 25.582  8.51811 17.1727     27.7833  -1.57429    29.235   15.51      327.508     3.80437     327.508     
1 1 1 30 24 3  o 1  19.0283 6.70083 -47.8129    25.1835  -19.3721    25.3288  6.39776    18.4077     1.25637     198.408     
1 1 1 30 24 4  o 5  29.3065 9.32359 46.6363     30.3941  3.84952     28.9592  19.1454    230.731     0.903306    230.73      
1 1 1 30 24 5  o 7  35.489  10.8755 66.6391     38.8352  54.4838     32.7886  11.4088    64.1927     28.2248     244.193     
1 1 1 30 24 6  o 5  24.9802 8.74174 -2.19336    37.2361  -18.1241    45.1194  9.11582    87.5229     14.656      267.523     
1 1 1 30 24 7  o 11 29.2482 9.25559 34.6439     37.7048  24.0196     20.9583  14.3995    223.914     10.856      43.9139     
1 1 1 30 24 8  o 7  29.0903 10.023  152.59      95.974   14.0611     19.6535  13.7353    80.167      11.4134     260.167     
1 1 1 30 24 9  o 14 21.8514 7.37592 -15.3117    35.5129  3.13875     14.0279  9.73084    220.071     0.404353    220.071     
1 1 1 30 24 10 o 19 21.6176 6.9675  0.344986    19.5003  6.52726     14.5226  9.4199     97.8051     5.70764     277.805     
1 1 1 30 24 11 o 9  31.7341 8.68622 39.2256     23.1981  27.3282     16.3489  23.7279    29.2888     7.6062      29.2888     
1 1 1 30 24 12 o 10 39.7204 9.22592 56.4718     25.1273  49.1301     18.2957  26.2101    122.159     4.16326     302.159     
1 1 1 30 24 13 o 15 24.9571 7.63509 12.4096     21.9485  16.1252     14.5928  7.87099    166.153     3.63814     166.153     
1 1 1 30 24 14 o 19 48.073  9.10541 71.1542     26.1257  74.1358     19.9491  41.8558    96.4667     15.0462     96.4667     
1 1 1 30 24 15 o 7  21.5659 7.18159 -3.12722    20.376   5.00667     19.8558  7.78792    354.543     0.266463    174.543     
1 1 1 30 24 16 o 8  18.5429 6.33281 2.66363     19.9847  -14.9184    13.4099  3.08783    104.94      1.61921     284.94      
1 1 1 30 24 17 o 16 26.7226 8.03093 23.4729     22.7517  19.4985     15.5468  15.1954    198.591     0.566449    18.5906     
1 1 1 30 24 18 o 9  24.9435 7.69071 17.204      22.2411  15.4916     14.7972  11.7642    100.597     2.51341     100.597     
1 1 1 30 24 19 o 3  27.3446 8.18666 37.8733     22.3427  11.67       16.3187  15.5921    25.9608     3.69496     25.9608     
1 1 1 30 24 20 o 12 19.5634 6.55944 -9.67242    21.0296  1.46194     14.6     4.05572    354.35      2.53004     174.35      
1 1 1 30 24 21 o 8  19.9027 6.72858 2.765       20.5942  -8.13762    16.7198  1.82604    210.346     0.735443    30.3461     
1 1 1 30 24 22 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 24 23 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 24 24 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 24 25 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 25 0  x 15 ?       ?       ?           ?        ?           ?        9.22169    180         0           0           
1 1 1 30 25 1  o 11 25.051  12.4664 8.62463     43.5731  0           0        8.12618    221.854     4.03439     41.8544     
1 1 1 30 25 2  o 8  25.9469 9.08927 22.2883     41.3496  15.0094     48.2147  12.7846    72.8855     2.09405     72.8855     
1 1 1 30 25 3  o 17 23.752  8.37984 7.79675     38.9673  -20.5856    42.7523  10.4559    237.424     4.40804     57.4238     
1 1 1 30 25 4  o 11 21.9553 7.85783 -24.736     40.9198  -46.4999    45.2918  7.99003    304.056     2.28508     124.056     
1 1 1 30 25 5  o 9  30.3949 10.3445 68.7797     44.9063  63.5755     48.517   4.83597    105.366     2.76425     105.366     
1 1 1 30 25 6  o 9  28.5388 9.86946 44.1116     46.1799  55.8685     47.7285  16.3284    227.678     0.335933    227.678     
1 1 1 30 25 7  o 12 26.8943 13.3775 0           0        33.4809     49.9401  9.67834    330.339     4.18846     150.339     
1 1 1 30 25 8  o 8  26.0681 9.1856  2.40785     45.0299  43.6493     49.6883  12.134     267.401     6.25094     87.4007     
1 1 1 30 25 9  o 17 26.6874 9.37301 28.6262     45.6787  34.7528     51.1752  11.2242    103.744     10.662      283.744     
1 1 1 30 25 10 o 10 23.204  8.29932 -58.8039    39.1976  30.1936     46.8377  7.35088    290.72      0.0138262   110.721     
1 1 1 30 25 11 o 4  25.7562 9.08338 20.5051     44.6397  20.2129     50.461   8.42824    118.577     2.20686     118.577     
1 1 1 30 25 12 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 25 13 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 25 14 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 25 15 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 25 16 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 30 25 17 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 0  0  f 0  73.0621 4.06456 96.3999     14.6642  96.3999     14.6642  35.6925    180         0           0           
1 1 1 31 0  1  o 6  128.526 2.52145 293.543     16.2123  293.543     16.2123  129.225    60          102.301     60          
1 1 1 31 0  2  o 3  126.498 2.52958 284.377     16.0068  284.377     16.0068  124.744    120         63.8826     120         
1 1 1 31 0  3  o 18 183.44  2.67049 597.395     24.5261  597.395     24.5261  88.0438    180         96.2313     8.68327e-06 
1 1 1 31 0  4  o 1  78.6068 2.77888 110.383     10.8842  110.383     10.8842  6.66457    240         102.606     60          
1 1 1 31 0  5  o 12 210.948 3.04152 790.151     32.1232  790.151     32.1232  180.024    120         47.031      120         
1 1 1 31 0  6  o 9  269.258 3.23459 1287.03     43.6179  1287.03     43.6179  317.855    180         236.291     180         
1 1 1 31 0  7  o 8  503.177 4.73356 4498.69     119.315  4498.69     119.315  461.815    240         177.481     240         
1 1 1 31 0  8  o 13 188.953 2.67283 633.817     25.2867  633.817     25.2867  108.536    120         63.0057     300         
1 1 1 31 0  9  o 15 129.515 2.5762  298.115     16.6909  298.115     16.6909  76.3096    3.93852e-06 39.2529     180         
1 1 1 31 0  10 o 9  211.418 2.77796 793.431     29.4097  793.431     29.4097  183.907    240         54.7491     240         
1 1 1 31 0  11 o 8  236.31  2.91016 991.23      34.4399  991.23      34.4399  209.233    300         68.746      300         
1 1 1 31 0  12 f 0  255.592 2.99046 1159.58     38.2806  1159.58     38.2806  230.279    180         0           0           
1 1 1 31 0  13 o 2  47.7671 3.73683 41.951      8.66597  41.951      8.66597  2.79145    240         60.9971     240         
1 1 1 31 0  14 o 3  193.995 2.79314 668.238     27.1291  668.238     27.1291  123.943    300         38.6168     120         
1 1 1 31 0  15 o 2  172.159 2.64018 526.323     22.7542  526.323     22.7542  76.9206    180         100.21      8.6929e-06  
1 1 1 31 0  16 o 7  90.6877 2.79784 146.69      12.6602  146.69      12.6602  2.59166    240         128.517     60          
1 1 1 31 0  17 o 1  14.2838 6.13577 3.3024      8.18445  3.3024      8.18445  15.5566    300         33.464      300         
1 1 1 31 0  18 o 4  162.247 2.81403 467.744     22.8494  467.744     22.8494  138.141    180         37.5132     180         
1 1 1 31 0  19 o 13 108.349 2.71161 208.991     14.6816  208.991     14.6816  78.1407    60          2.9489      240         
1 1 1 31 0  20 o 2  230.456 2.97547 943.136     34.3382  943.136     34.3382  140.628    300         57.183      120         
1 1 1 31 0  21 o 5  194.688 2.81046 673.201     27.3948  673.201     27.3948  134.551    180         16.4843     8.64999e-06 
1 1 1 31 0  22 o 12 265.303 3.3346  1250.43     44.3034  1250.43     44.3034  248.143    240         107.577     240         
1 1 1 31 0  23 o 8  132.573 2.69177 312.544     17.8502  312.544     17.8502  87.6248    120         18.7488     300         
1 1 1 31 0  24 o 4  33.5894 5.7195  23.2279     8.34774  23.2279     8.34774  14.0718    180         65.3505     180         
1 1 1 31 0  25 o 7  382.286 3.93843 2598.36     75.4161  2598.36     75.4161  317.455    240         76.9798     240         
1 1 1 31 0  26 o 17 60.9659 3.72105 67.4846     11.1659  67.4846     11.1659  0.367115   120         87.8615     300         
1 1 1 31 0  27 o 3  467.639 4.38014 3891.69     102.609  3891.69     102.609  424.815    180         169.092     180         
1 1 1 31 0  28 o 19 38.4255 5.11428 28.8924     8.82956  28.8924     8.82956  31.3841    240         116.945     240         
1 1 1 31 0  29 o 15 15.125  6.25725 4.83516     7.92686  4.83516     7.92686  8.98595    120         20.4592     120         
1 1 1 31 0  30 o 14 26.3893 6.89677 16.6432     8.45143  16.6432     8.45143  1.2984     180         5.38233     180         
1 1 1 31 0  31 o 19 93.5212 3.16478 156.419     14.7548  156.419     14.7548  72.3557    60          9.54185     60          
1 1 1 31 0  32 o 5  33.3786 6.28677 23.6449     9.08575  23.6449     9.08575  1.32439    300         6.42182     120         
1 1 1 31 0  33 o 12 12.6356 5.67837 0.900424    7.85118  0.900424    7.85118  2.53973    180         5.62911     180         
1 1 1 31 0  34 o 18 89.4184 3.10995 143.115     13.8589  143.115     13.8589  77.594     240         26.7559     240         
1 1 1 31 0  35 o 18 15.6491 6.4932  5.17273     8.57841  5.17273     8.57841  17.0827    300         40.6057     300         
1 1 1 31 0  36 o 14 63.374  3.713   72.956      11.5994  72.956      11.5994  49.483     1.37278e-06 11.5341     1.37278e-06 
1 1 1 31 0  37 o 9  22.0952 7.18941 12.8069     8.72806  12.8069     8.72806  17.0757    60          51.6984     60          
1 1 1 31 0  38 f 0  27.3515 7.07901 17.9057     8.9497   17.9057     8.9497   2.46128    120         0           0           
1 1 1 31 0  39 o 12 27.6643 6.943   18.085      8.76076  18.085      8.76076  0.25103    8.65196e-06 10.5144     8.65196e-06 
1 1 1 31 0  40 o 19 52.2623 4.00572 50.4052     10.1793  50.4052     10.1793  32.6605    240         7.32525     60          
1 1 1 31 0  41 o 2  119.397 2.74641 254.289     16.3936  254.289     16.3936  98.0781    120         26.9139     120         
1 1 1 31 0  42 o 12 13.2871 5.85934 2.0713      7.93702  2.0713      7.93702  11.1653    180         29.0022     180         
1 1 1 31 0  43 o 19 70.2128 3.22454 88.9332     11.2348  88.9332     11.2348  34.7271    60          29.6097     240         
1 1 1 31 0  44 o 15 12.5748 5.6983  0.552062    8.10827  0.552062    8.10827  0.491976   120         1.33746     120         
1 1 1 31 0  45 o 18 57.5612 3.79944 60.7404     10.728   60.7404     10.728   52.0316    180         23.4792     180         
1 1 1 31 0  46 o 8  12.2969 5.64717 -0.304452   8.32024  -0.304452   8.32024  3.80369    60          10.3683     60          
1 1 1 31 0  47 o 15 102.308 2.99817 187.617     15.3117  187.617     15.3117  108.511    120         74.1024     120         
1 1 1 31 0  48 o 17 60.8414 3.97668 68.0286     11.8738  68.0286     11.8738  45.2224    360         5.68001     360         
1 1 1 31 0  49 o 5  27.7593 7.60741 19.2387     10.059   19.2387     10.059   11.2757    240         10.8713     60          
1 1 1 31 0  50 o 12 17.3484 7.06481 7.22005     9.85637  7.22005     9.85637  3.00329    120         19.9996     120         
1 1 1 31 0  51 o 13 67.8631 4.06674 84.5142     13.5933  84.5142     13.5933  60.9339    6.07072e-07 28.0917     6.07072e-07 
1 1 1 31 0  52 o 5  73.4089 3.97505 98.5063     14.4212  98.5063     14.4212  63.8635    60          26.5725     60          
1 1 1 31 0  53 o 15 90.4402 3.34082 147.647     15.0468  147.647     15.0468  66.0608    300         7.85965     300         
1 1 1 31 0  54 o 11 14.5147 6.61957 0.696962    11.1682  0.696962    11.1682  0.134681   1.03209e-05 0.737271    1.03209e-05 
1 1 1 31 0  55 o 1  30.864  7.75935 23.1443     10.9309  23.1443     10.9309  7.33153    60          27.2966     240         
1 1 1 31 0  56 o 13 59.7612 4.21611 66.3907     12.3167  66.3907     12.3167  31.9769    120         17.4175     300         
1 1 1 31 0  57 o 9  121.394 2.98499 264.967     18.1095  264.967     18.1095  102.315    180         39.8536     180         
1 1 1 31 0  58 o 15 18.3633 7.1604  9.11502     9.57057  9.11502     9.57057  4.11821    240         7.68372     60          
1 1 1 31 0  59 o 1  82.3575 3.47652 123.577     14.2303  123.577     14.2303  54.2366    300         2.60113     120         
1 1 1 31 0  60 o 12 15.4475 6.58736 5.03405     9.29067  5.03405     9.29067  0.231015   7.37827e-07 12.4833     180         
1 1 1 31 0  61 o 6  24.3256 8.06815 16.7983     11.0242  16.7983     11.0242  5.93034    60          19.907      240         
1 1 1 31 0  62 f 0  103.741 3.02802 194.735     15.6812  194.735     15.6812  53.8184    120         0           0           
1 1 1 31 0  63 o 15 41.4889 6.03369 35.6785     11.0824  35.6785     11.0824  22.6221    180         9.95255     8.63396e-06 
1 1 1 31 0  64 o 8  29.9114 7.74718 22.6849     10.7147  22.6849     10.7147  14.6541    60          9.48886     240         
1 1 1 31 0  65 o 9  13.4328 6.34952 -2.34256    11.7734  -2.34256    11.7734  0.815633   120         3.85529     120         
1 1 1 31 0  66 o 18 25.147  8.64602 18.7268     12.7828  18.7268     12.7828  7.96741    360         2.63874     360         
1 1 1 31 0  67 o 11 12.4338 5.9623  -4.23344    11.1082  -4.23344    11.1082  2.64893    240         12.6065     240         
1 1 1 31 0  68 o 18 22.9042 8.87645 15.9434     14.61    15.9434     14.61    1.27011    300         0.462394    300         
1 1 1 31 0  69 o 5  119.338 4.04524 262.917     24.0655  262.917     24.0655  102.077    2.90334e-06 48.7975     2.90334e-06 
1 1 1 31 0  70 o 14 20.7271 8.59175 12.5327     14.9944  12.5327     14.9944  6.53782    60          10.0426     240         
1 1 1 31 0  71 o 8  20.2277 8.51874 11.8604     15.1625  11.8604     15.1625  2.093      120         0.598796    300         
1 1 1 31 0  72 o 16 20.8639 8.72911 13.4677     15.7297  13.4677     15.7297  5.09355    180         8.74812     8.60697e-06 
1 1 1 31 0  73 o 2  11.9416 5.97725 -14.2376    14.7452  -14.2376    14.7452  0.597441   240         1.90555     240         
1 1 1 31 0  74 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 1  0  o 9  49.9238 3.60146 45.5833     8.7777   45.5833     8.7777   3.0219     9.63355e-05 5.79658     180         
1 1 1 31 1  1  o 16 200.631 2.74705 717.833     27.6054  710.971     27.6341  147.888    321.99      4.72851     321.99      
1 1 1 31 1  2  o 17 249.116 2.98795 1102.41     37.2982  1101.1      37.3064  225.33     317.724     87.8317     317.724     
1 1 1 31 1  3  o 6  62.7259 3.16334 65.3834     9.91418  75.2339     9.79325  5.05904    343.059     67.5608     163.059     
1 1 1 31 1  4  o 13 212.815 2.93715 784.783     31.3465  823.484     31.288   158.507    275.226     7.48996     275.226     
1 1 1 31 1  5  o 12 288.549 3.38212 1501.76     51.133   1456.54     46.6367  229.276    45.9418     35.0443     45.9418     
1 1 1 31 1  6  o 2  389.091 3.96957 2678.97     75.7048  2705.26     79.078   300.022    36.4338     25.8124     36.4338     
1 1 1 31 1  7  o 9  144.76  2.63769 380.717     18.709   363.431     19.5075  126.164    352.162     50.5632     352.162     
1 1 1 31 1  8  o 6  137.019 2.68823 330.925     19.2475  336.014     17.5829  129.594    261.185     73.5579     261.185     
1 1 1 31 1  9  o 1  64.4629 3.144   77.5334     10.302   70.8434     9.88573  23.5017    264.09      3.92482     264.09      
1 1 1 31 1  10 o 15 125.306 2.55893 283.402     16.0538  274.392     16.0475  69.6203    105.879     37.9249     285.879     
1 1 1 31 1  11 o 2  126.812 2.55001 286.797     16.1856  284.456     16.1922  89.2363    50.1659     0.808663    50.1656     
1 1 1 31 1  12 o 16 321.424 3.53023 1829.09     54.2598  1843.71     59.3725  261.794    15.4368     51.7675     15.4368     
1 1 1 31 1  13 o 1  17.5209 5.12322 -0.778899   7.58236  3.15622     7.23411  35.0172    28.6635     78.3024     28.6635     
1 1 1 31 1  14 o 11 144.911 2.56151 381.368     18.5713  364.414     18.6083  101.432    14.2248     3.712       194.225     
1 1 1 31 1  15 o 14 74.3794 2.92373 99.4649     10.8283  97.6499     10.8809  24.5515    322.774     49.9711     142.774     
1 1 1 31 1  16 o 14 138.185 2.59299 333.623     17.9714  344.852     17.905   109.793    151.228     24.2794     151.228     
1 1 1 31 1  17 o 17 73.8584 3.3702  94.3497     12.0252  100.448     12.7933  20.8939    282.048     57.9562     102.048     
1 1 1 31 1  18 o 2  126.721 2.6736  286.852     17.3166  283.93      16.5984  78.3632    84.3151     23.2718     264.315     
1 1 1 31 1  19 o 19 136.491 2.59042 326.148     17.7036  335.923     17.6989  120.063    186.586     48.6659     186.586     
1 1 1 31 1  20 o 13 68.6703 3.28817 89.3147     11.9749  79.2953     10.5328  29.4009    282.044     30.6046     102.044     
1 1 1 31 1  21 o 19 50.044  3.97354 46.2758     9.80102  44.0747     9.78058  16.8626    25.51       17.0266     205.51      
1 1 1 31 1  22 o 2  105.073 2.89579 204.786     15.5854  188.403     14.8546  84.6112    131.392     26.1183     131.392     
1 1 1 31 1  23 o 18 52.42   4.05617 43.9981     10.1236  55.4715     10.7864  20.0066    96.2627     17.5269     276.263     
1 1 1 31 1  24 o 7  132.461 2.7295  316.639     18.1352  307.517     18.0618  104.618    42.4787     22.8067     42.4787     
1 1 1 31 1  25 o 18 202.312 2.98634 717.688     30.2439  738.181     30.3077  179.647    36.1029     68.9606     36.1029     
1 1 1 31 1  26 o 7  158.645 2.67658 461.7       20.7421  433.458     21.739   91.7547    278.867     43.7932     98.8669     
1 1 1 31 1  27 o 8  92.895  2.83092 162.781     13.4517  144.969     12.8392  51.2419    281.399     25.6093     101.399     
1 1 1 31 1  28 o 3  106.616 2.68557 206.728     14.3669  198.047     14.2817  66.2501    191.551     16.1195     11.5511     
1 1 1 31 1  29 o 11 122.7   2.67534 266.515     16.8396  269.471     16.0065  67.3531    88.6227     38.703      268.623     
1 1 1 31 1  30 f 0  36.2142 5.36447 22.6833     9.83514  26.2352     9.00067  11.683     7.33192     0           0           
1 1 1 31 1  31 o 4  22.752  5.58337 14.9132     8.65276  -3.47629    9.33212  12.7088    346.456     39.1771     346.456     
1 1 1 31 1  32 o 16 18.7805 5.53716 -2.49473    8.78377  4.29934     8.87086  17.3413    248.119     44.8938     248.119     
1 1 1 31 1  33 o 12 74.3769 3.4456  101.19      12.5612  97.2457     12.9667  44.2494    144.614     10.2728     324.614     
1 1 1 31 1  34 o 13 110.012 3.08524 223.727     16.6143  208.866     17.2902  82.073     227.679     12.1229     227.679     
1 1 1 31 1  35 o 17 116.331 3.02408 244.206     17.6206  239.339     17.5782  86.8307    341.573     12.3654     341.573     
1 1 1 31 1  36 o 15 37.1322 5.32355 26.8015     9.48512  24.8845     9.64629  7.79281    110.391     11.2089     290.391     
1 1 1 31 1  37 o 7  93.3528 3.04941 159.414     14.6085  152.508     13.8479  42.5537    109.323     43.8367     289.323     
1 1 1 31 1  38 o 11 35.0806 5.28546 27.7423     9.08324  18.8163     8.97827  9.0432     53.5398     60.5374     53.5398     
1 1 1 31 1  39 o 7  40.4671 4.63459 27.4355     8.95638  33.3146     9.15832  10.3373    106.508     73.3054     106.508     
1 1 1 31 1  40 o 16 58.1153 3.5689  57.0706     10.2602  65.1448     10.2839  30.1874    279.443     16.852      99.4428     
1 1 1 31 1  41 o 7  98.3722 3.07344 172.547     14.8275  174.479     15.3981  69.0596    353.341     1.40342     353.341     
1 1 1 31 1  42 o 13 32.3535 5.82891 24.4938     9.39623  15.4097     9.8593   1.07549    168.937     38.1927     348.937     
1 1 1 31 1  43 o 4  30.0711 5.87025 18.8307     9.19374  15.6262     9.1243   1.98213    199.238     32.2953     19.2379     
1 1 1 31 1  44 o 19 89.1026 3.11681 134.655     13.9674  151.198     13.728   79.9334    133.034     38.6349     133.034     
1 1 1 31 1  45 o 16 86.8368 3.36184 133.974     14.1059  138.299     15.0387  66.8833    292.19      15.0323     292.19      
1 1 1 31 1  46 o 11 37.9939 5.37217 22.1825     9.85601  33.2763     9.86518  20.9609    92.5552     3.64308     272.555     
1 1 1 31 1  47 o 17 52.0879 4.17755 49.8432     10.5224  50.1425     10.8994  31.5504    238.453     5.224       58.4526     
1 1 1 31 1  48 o 14 70.3521 3.53289 84.4353     12.014   95.6497     12.7327  50.1691    112.215     5.68984     112.215     
1 1 1 31 1  49 o 13 35.9592 5.88254 25.4295     10.8649  24.9117     9.91704  20.4466    14.4944     0.955192    194.494     
1 1 1 31 1  50 o 19 29.4892 6.19759 11.1106     10.0989  22.1591     10.1966  13.2445    32.1159     3.41078     212.116     
1 1 1 31 1  51 o 2  42.9551 5.40744 28.5189     11.7214  42.661      10.273   12.0742    70.2653     31.9031     250.265     
1 1 1 31 1  52 o 10 42.4075 5.31285 41.7491     11.4233  27.834      10.2813  21.3546    58.1952     11.3907     238.195     
1 1 1 31 1  53 o 11 64.5198 3.9667  77.6322     13.2003  75.7094     12.1842  49.1208    151.82      12.9438     151.82      
1 1 1 31 1  54 o 3  15.7261 5.07951 -0.99459    9.75444  -9.42892    8.13623  3.69913    102.196     20.6067     102.196     
1 1 1 31 1  55 o 18 23.3888 6.37039 11.5824     10.5586  3.49532     11.0422  5.18267    18.8686     15.3407     198.869     
1 1 1 31 1  56 o 11 25.0193 6.42481 14.545      10.7613  6.91744     10.4055  9.70641    272.448     7.49851     92.4477     
1 1 1 31 1  57 o 12 50.2344 4.88621 61.7622     10.876   36.3638     11.9187  34.7272    32.7098     4.42121     32.7098     
1 1 1 31 1  58 o 9  19.8476 5.82951 5.92364     9.10052  -0.278322   10.383   5.17109    274.327     6.33759     94.3266     
1 1 1 31 1  59 o 2  69.5635 3.80742 82.9637     12.558   97.7318     13.7866  57.3751    166.273     23.4364     166.273     
1 1 1 31 1  60 o 16 47.4868 5.27154 45.8395     11.8732  43.1612     12.3569  38.0306    190.02      16.799      190.02      
1 1 1 31 1  61 o 6  64.3542 4.40555 73.0361     12.4276  85.3441     15.6152  54.0579    339.685     25.043      339.685     
1 1 1 31 1  62 o 1  28.9511 6.47263 19.3319     10.6369  15.594      10.462   16.0216    32.0657     3.31525     32.0657     
1 1 1 31 1  63 f 0  21.1933 5.87779 15.5001     11.0733  -8.52305    9.64842  11.3697    266.873     0           0           
1 1 1 31 1  64 o 4  33.6942 6.57872 33.158      12.0013  15.5518     12.0998  14.3544    280.009     11.0885     100.009     
1 1 1 31 1  65 o 7  27.205  7.04518 14.9555     13.3431  14.625      11.7778  12.6645    192.153     1.47794     12.1526     
1 1 1 31 1  66 o 10 19.3433 5.9425  7.88863     11.5708  -11.3077    11.3419  3.39712    1.2222      10.8972     181.222     
1 1 1 31 1  67 o 1  23.8513 6.93399 11.6502     14.5202  4.66137     12.1233  6.68311    246.26      12.7059     66.2596     
1 1 1 31 1  68 o 1  26.1865 7.29396 3.38776     14.7978  19.6416     14.6285  11.1015    192.961     5.81943     12.9612     
1 1 1 31 1  69 o 10 73.8505 5.22515 114.982     18.997   104.454     19.1013  56.3798    182.694     18.7229     182.694     
1 1 1 31 1  70 o 13 36.6791 7.98999 26.5657     16.5112  39.9867     16.4271  23.4443    234.207     5.84723     234.207     
1 1 1 31 1  71 o 11 21.3641 6.81202 -1.24987    15.4398  3.51832     15.4774  3.48929    285.437     1.72819     105.437     
1 1 1 31 1  72 o 17 24.1099 7.13491 -5.67264    15.632   20.5772     15.664   4.02034    256.558     0.306812    76.5581     
1 1 1 31 1  73 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 1  74 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 2  0  o 13 20.5911 6.74667 11.0173     7.69301  11.0173     7.69301  54.8617    8.91495e-05 126.967     8.91495e-05 
1 1 1 31 2  1  o 5  271.191 3.11416 1294.1      42.3292  1318.63     42.3138  221.879    219.139     45.0549     219.139     
1 1 1 31 2  2  o 16 76.2642 2.89851 103.175     11.0514  103.972     11.0226  49.4113    2.48265     17.1211     2.48265     
1 1 1 31 2  3  o 18 120.9   2.65712 265.981     15.732   253.512     16.3966  71.9384    80.9395     27.226      260.94      
1 1 1 31 2  4  o 5  151.663 2.68688 405.713     20.8969  411.202     19.9082  97.699     179.169     23.1448     359.169     
1 1 1 31 2  5  o 14 269.303 3.09932 1319.91     41.8521  1256.99     41.7866  240.387    159.469     85.6705     159.469     
1 1 1 31 2  6  o 17 50.5956 3.85081 41.8445     9.51475  50.4762     9.63963  5.61296    201         44.4525     21          
1 1 1 31 2  7  o 11 202.4   2.97215 729.637     29.4325  725.508     30.8403  180.76     281.261     67.9172     281.261     
1 1 1 31 2  8  o 3  180.19  2.68074 575.384     24.1926  577.445     24.222   111.961    219.259     38.4968     39.2585     
1 1 1 31 2  9  o 12 145.141 2.608   372.98      18.9363  375.406     18.972   110.042    352.075     12.5818     352.075     
1 1 1 31 2  10 o 9  43.2664 3.91939 31.5865     8.01758  36.1914     8.58766  2.80888    14.3503     33.5325     194.35      
1 1 1 31 2  11 o 3  32.7135 4.91349 24.8077     7.54378  15.054      8.11306  11.848     14.4856     49.1345     14.4856     
1 1 1 31 2  12 o 5  143.314 2.4994  361.7       17.5116  367.699     18.3708  139.14     219.072     77.447      219.072     
1 1 1 31 2  13 o 15 105.258 2.59034 199.978     13.2713  193.92      13.9912  82.5217    355.508     20.403      355.508     
1 1 1 31 2  14 o 3  56.4614 3.31099 53.5534     8.97928  60.679      9.58964  10.686     266.214     50.1582     86.2135     
1 1 1 31 2  15 f 0  109.136 2.68944 217.574     13.9757  206.054     15.3204  75.4906    130.457     0           0           
1 1 1 31 2  16 o 18 25.8556 5.60259 15.5122     8.15454  8.05601     8.13469  8.48907    145.515     26.7401     145.515     
1 1 1 31 2  17 o 12 146.421 2.72683 391.069     18.5075  371.04      21.3015  101.842    157.687     6.53965     337.687     
1 1 1 31 2  18 o 9  96.1987 2.78404 163.36      12.9684  166.038     13.8108  38.7128    10.6415     57.8204     190.642     
1 1 1 31 2  19 o 11 348.866 3.56255 2173.31     62.2455  2160.05     62.323   272.814    67.7928     34.1699     67.7928     
1 1 1 31 2  20 o 19 146.846 2.56432 385.381     18.4119  380.956     19.2973  124.102    118.107     39.284      118.107     
1 1 1 31 2  21 o 12 78.072  2.89754 110.189     10.9264  107.134     11.6432  34.9545    292.746     36.2202     112.746     
1 1 1 31 2  22 o 19 21.6011 5.60796 4.93074     8.21831  8.20279     7.82548  8.39129    96.0122     22.8232     96.0122     
1 1 1 31 2  23 o 19 48.1801 4.03411 39.4831     9.26209  44.5713     9.83947  0.5012     48.4075     59.1849     228.408     
1 1 1 31 2  24 f 0  65.4131 3.25941 74.9574     10.5003  78.1711     10.7324  41.9622    5.83867     0           0           
1 1 1 31 2  25 o 6  147.541 2.81715 378.356     19.4963  396.659     22.0954  126.082    104.967     42.7994     104.967     
1 1 1 31 2  26 o 3  95.8866 2.91886 170.103     13.9763  157.832     13.9939  58.4179    23.8563     16.1773     203.856     
1 1 1 31 2  27 o 15 99.4606 3.00165 182.454     14.9924  170.529     14.8527  77.6507    265.701     18.919      265.701     
1 1 1 31 2  28 o 14 70.5161 3.80246 81.4383     13.6532  97.5895     12.8297  52.4274    95.9469     16.971      95.9469     
1 1 1 31 2  29 o 2  22.5692 5.94696 -1.71708    9.78422  12.5579     9.66963  5.39138    355.011     17.6596     355.011     
1 1 1 31 2  30 o 13 63.4024 3.77264 72.8342     11.5806  71.9028     12.1585  39.5842    45.1342     0.729621    225.134     
1 1 1 31 2  31 o 8  44.2133 4.52039 34.5635     8.89256  37.078      10.5314  13.8467    350.203     21.5707     170.203     
1 1 1 31 2  32 o 6  118.941 2.69783 255.581     15.592   248.919     16.5001  83.9548    332.854     1.16966     332.854     
1 1 1 31 2  33 o 14 216.037 2.87594 828.857     30.3496  835.577     31.9091  145.232    315.85      18.8979     135.85      
1 1 1 31 2  34 o 17 145.877 2.64405 376.792     19.5397  382.074     19.0804  101.057    85.6191     4.10911     265.619     
1 1 1 31 2  35 o 8  127.348 2.64904 289.066     16.3803  289.527     17.3804  97.6049    231.642     17.0247     231.642     
1 1 1 31 2  36 o 6  61.1131 3.44836 64.0756     10.3647  70.5718     10.5714  34.8985    237.086     9.48668     57.0864     
1 1 1 31 2  37 o 2  98.6374 2.83553 184.659     13.3379  163.589     14.4978  78.3087    191.688     20.6705     191.688     
1 1 1 31 2  38 o 15 19.8801 5.10649 10.975      7.12748  -4.4393     8.115    2.22937    141.907     10.8747     141.907     
1 1 1 31 2  39 o 10 40.3385 4.93679 29.5637     8.82631  31.1433     10.3863  4.82387    248.11      63.4194     248.11      
1 1 1 31 2  40 o 7  40.8264 5.02243 24.9632     9.16602  38.0451     10.6203  22.2648    132.704     6.05672     312.704     
1 1 1 31 2  41 o 7  19.5482 5.61495 6.86456     8.7454   -2.76978    9.21136  10.2642    287.642     40.6277     287.642     
1 1 1 31 2  42 o 4  45.9666 5.39642 49.026      10.5157  31.2512     12.6253  34.7027    216.939     14.6518     216.939     
1 1 1 31 2  43 o 15 55.224  4.37334 54.8857     12.2704  57.3194     11.4745  43.0288    304.029     14.4378     304.029     
1 1 1 31 2  44 o 9  113.381 2.99291 223.961     16.8064  238.36      17.1416  99.2268    260.581     41.3939     260.581     
1 1 1 31 2  45 o 11 55.1606 4.23566 50.8574     11.55    61.4344     11.3661  39.8585    336.431     7.3274      336.431     
1 1 1 31 2  46 f 0  36.6676 5.51566 27.5374     9.64139  24.2173     10.0071  14.4276    296.11      0           0           
1 1 1 31 2  47 o 11 52.4193 4.22957 53.9572     10.954   47.6864     10.837   25.5058    35.4427     18.8715     215.443     
1 1 1 31 2  48 o 8  29.6569 6.1649  17.4949     10.3835  16.5834     9.16401  13.8207    181.88      0.887492    1.87966     
1 1 1 31 2  49 f 0  19.3281 5.50243 8.25934     8.77392  -3.71573    8.61045  2.77328    179.442     0           0           
1 1 1 31 2  50 o 13 52.3148 4.14524 49.4392     10.9698  51.8746     10.3537  26.6983    146.031     15.993      326.031     
1 1 1 31 2  51 f 0  73.8919 3.62322 91.9609     14.0793  107.792     12.2817  63.1602    269.448     0           0           
1 1 1 31 2  52 o 1  68.1318 3.66416 74.5722     12.471   96.1298     12.1356  37.2646    139.511     17.3827     319.511     
1 1 1 31 2  53 o 1  30.287  6.34919 17.495      11.0873  18.7018     9.6382   16.0588    176.132     7.59537     176.132     
1 1 1 31 2  54 o 3  28.0174 5.80052 3.15163     10.5332  24.6174     9.46262  10.5069    226.936     12.3977     46.9361     
1 1 1 31 2  55 o 11 61.3095 4.01737 66.1522     12.632   73.8235     11.643   52.5669    290.063     24.6706     290.063     
1 1 1 31 2  56 o 15 60.9054 4.08096 67.4167     12.805   71.38       11.7277  31.0061    45.4366     19.2667     225.437     
1 1 1 31 2  57 o 7  67.2568 3.96504 74.6549     13.4675  94.9275     12.7134  44.349     167.361     0.842092    347.361     
1 1 1 31 2  58 o 3  18.9345 5.69521 -5.0714     10.4751  5.88563     9.32563  3.94626    225.266     3.29009     45.2655     
1 1 1 31 2  59 o 11 20.7368 5.95978 4.04361     9.85748  6.22063     9.5872   6.15104    288.514     3.72635     108.514     
1 1 1 31 2  60 o 19 24.5631 6.2431  17.6424     10.743   3.63537     9.95298  10.8084    292.456     0.512333    292.456     
1 1 1 31 2  61 o 13 30.0039 6.17678 28.9823     10.5407  5.88145     12.0891  13.6565    288.762     7.54393     108.762     
1 1 1 31 2  62 o 18 26.9763 6.59121 22.2229     11.6427  5.27628     11.6935  12.524     329.316     1.14704     149.315     
1 1 1 31 2  63 o 10 74.2799 4.42199 109.308     17.226   102.587     15.3749  47.4942    55.5883     1.90276     235.588     
1 1 1 31 2  64 o 5  22.248  6.57021 -3.11433    11.5965  12.5604     13.5986  4.44602    77.3276     0.172052    257.328     
1 1 1 31 2  65 o 18 63.8348 5.54653 98.3989     17.1615  66.1426     16.8739  52.9507    25.221      24.6002     25.221      
1 1 1 31 2  66 f 0  25.3868 7.38713 0.895265    14.3915  17.6177     16.5729  30.5784    159.613     0           0           
1 1 1 31 2  67 f 0  31.8051 7.91395 27.0569     15.9111  19.2699     15.6494  17.4604    148.723     0           0           
1 1 1 31 2  68 o 5  24.7174 7.2608  5.73581     14.8794  13.0451     14.9731  10.1066    302.007     4.92403     122.007     
1 1 1 31 2  69 o 18 49.9323 7.02047 41.4347     16.6374  72.9862     17.2594  38.6296    22.368      16.8938     22.368      
1 1 1 31 2  70 o 5  24.6582 7.26227 19.6182     15.5051  -2.89169    16.3765  5.14255    45.9237     0.890402    45.9237     
1 1 1 31 2  71 o 18 29.0579 7.85943 21.7288     15.6422  20.4348     16.3348  12.8636    55.8774     1.40865     235.877     
1 1 1 31 2  72 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 2  73 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 3  0  o 18 273.138 3.00834 1324.6      41.1559  1324.6      41.1559  244.324    3.71207e-09 81.6424     3.71207e-09 
1 1 1 31 3  1  f 0  227.542 2.74945 920.331     30.7252  918.53      31.9654  133.959    13.5158     0           0           
1 1 1 31 3  2  o 3  238.923 2.84978 1018.14     34.0374  1009.64     34.2048  208.483    136.308     65.8566     136.308     
1 1 1 31 3  3  o 14 113.636 2.68958 235.784     14.494   223.397     16.0074  60.0244    101.702     42.4167     281.703     
1 1 1 31 3  4  o 15 86.0812 2.7785  134.294     11.8772  129.465     12.0255  5.9958     277.956     110.255     97.9563     
1 1 1 31 3  5  o 15 54.0475 3.37861 49.4848     8.75205  55.2714     9.3643   22.485     165.94      11.5726     345.94      
1 1 1 31 3  6  o 9  81.4197 2.77964 124.085     10.9939  112.085     11.5621  9.12212    324.044     96.4257     144.044     
1 1 1 31 3  7  o 8  178.623 2.67509 561.802     23.3504  571.375     24.5358  127.578    15.9639     5.60587     195.964     
1 1 1 31 3  8  o 19 35.9902 4.71484 23.3484     7.98484  24.3329     8.39724  1.39303    28.5164     27.5482     28.5164     
1 1 1 31 3  9  o 3  104.006 2.62338 193.157     13.1792  191.505     14.1038  51.1844    199.039     45.3085     19.039      
1 1 1 31 3  10 o 19 40.8969 4.21915 27.5117     8.10367  33.4859     8.66332  41.524     327.358     136.357     327.358     
1 1 1 31 3  11 o 9  161.755 2.62871 479.701     20.076   449.887     22.3874  132.853    38.8932     31.9394     38.8932     
1 1 1 31 3  12 o 2  107.354 2.58716 209.674     13.462   200.2       14.2965  64.842     124.763     22.1543     304.763     
1 1 1 31 3  13 o 3  115.791 2.61045 240.844     15.0562  235.924     15.1976  90.4951    182.799     18.1886     182.799     
1 1 1 31 3  14 o 9  219.227 2.75685 854.604     29.2438  853.275     31.2951  199.393    291.859     79.0778     291.859     
1 1 1 31 3  15 o 6  131.983 2.55381 326.431     16.3259  293.289     17.3195  49.0638    316.506     92.9711     136.506     
1 1 1 31 3  16 o 7  56.1702 3.47829 57.4875     9.6353   55.7033     9.745    23.8062    354.728     7.95856     354.728     
1 1 1 31 3  17 o 9  148.568 2.5899  385.308     18.2722  399.295     20.2551  89.6188    223.54      35.6054     43.5402     
1 1 1 31 3  18 o 10 181.186 2.65261 587.636     23.8084  579.117     24.355   130.452    238.488     2.26042     58.4888     
1 1 1 31 3  19 o 7  142.49  2.6268  367.547     18.0762  354.405     19.3676  111.246    299.298     18.5169     299.298     
1 1 1 31 3  20 o 10 141.33  2.65941 362.951     18.992   347.69      18.645   98.4766    31.7627     5.92559     211.763     
1 1 1 31 3  21 f 0  124.997 2.58709 270.16      16.0157  285.825     16.3593  94.9108    300.065     0           0           
1 1 1 31 3  22 o 10 22.4731 5.58795 10.1426     7.80524  5.49423     8.02826  7.92311    172.99      23.5007     172.99      
1 1 1 31 3  23 o 3  137.669 2.69028 329.622     18.9655  345.088     18.0815  103.933    218.929     11.307      218.929     
1 1 1 31 3  24 o 7  90.579  3.26307 135.818     14.3778  157.747     15.1323  79.6098    352.882     39.5409     352.882     
1 1 1 31 3  25 o 9  44.8128 4.72425 35.3955     9.97315  38.21       10.6017  16.235     24.6494     2.72588     204.649     
1 1 1 31 3  26 o 17 150.149 3.02018 390.239     22.791   413.841     22.5927  117.145    159.203     19.4811     159.203     
1 1 1 31 3  27 o 15 58.8042 3.98365 52.2692     11.7292  73.4947     10.9983  16.5648    243.688     44.9843     63.6882     
1 1 1 31 3  28 o 15 119.552 3.04542 256.548     18.3603  253.726     18.0718  85.8177    214.161     2.74975     214.161     
1 1 1 31 3  29 o 6  31.3483 5.78407 19.2975     8.67057  17.5776     9.73474  11.5688    253.699     56.9062     253.699     
1 1 1 31 3  30 o 17 119.422 2.87931 267.095     17.4513  242.309     16.9519  90.1929    237.81      12.4749     237.811     
1 1 1 31 3  31 f 0  131.744 2.77094 318.5       17.1564  300.933     19.2565  58.6623    95.4783     0           0           
1 1 1 31 3  32 o 15 109.613 2.74712 198.316     13.8321  231.279     16.3223  103.253    222.559     57.1667     222.559     
1 1 1 31 3  33 o 1  154.903 2.73362 429.338     19.548   426.729     22.7368  132.38     336.201     45.3535     336.201     
1 1 1 31 3  34 o 3  18.1961 5.3422  2.05359     7.09691  1.34387     8.92363  10.6724    340.108     30.1056     340.108     
1 1 1 31 3  35 o 13 51.7036 3.91498 46.0537     8.91921  51.1705     11.0229  25.3928    92.6626     15.6985     272.663     
1 1 1 31 3  36 o 18 28.7548 5.76143 11.8529     7.95065  19.4874     9.56293  4.26571    70.7592     18.0094     250.759     
1 1 1 31 3  37 o 16 117.19  2.86013 248.854     15.9525  242.63      17.5297  86.4216    96.8706     7.38362     96.8706     
1 1 1 31 3  38 o 11 66.7492 3.59987 84.6577     11.2885  76.5219     12.4846  45.6134    203.616     0.0528327   23.6147     
1 1 1 31 3  39 o 8  158.867 3.22955 467.414     25.4088  439.191     25.923   148.695    344.551     72.8567     344.551     
1 1 1 31 3  40 o 12 106.377 3.25888 204.87      16.6306  202.375     17.9946  63.6446    7.61585     22.2637     187.616     
1 1 1 31 3  41 o 6  75.6254 3.36708 102.437     12.5953  104.174     12.7972  35.9201    182.364     33.1811     2.36393     
1 1 1 31 3  42 o 14 86.0261 3.24644 130.899     13.0118  136.152     14.8462  52.3387    93.8483     14.8817     273.848     
1 1 1 31 3  43 o 19 54.2009 4.07736 53.1603     10.8023  54.7514     11.0085  40.3925    151.524     9.65436     151.524     
1 1 1 31 3  44 o 7  44.8079 4.46274 38.6605     9.14512  36.1151     10.2428  29.1404    343.051     21.922      343.051     
1 1 1 31 3  45 o 13 20.9117 5.62036 6.91151     7.72916  5.26718     8.59877  1.4947     314.617     3.2489      134.617     
1 1 1 31 3  46 o 6  95.0654 2.97417 166.76      14.4157  159.215     13.8545  59.4151    328.895     12.7643     148.895     
1 1 1 31 3  47 o 1  117.187 2.77293 249.408     16.0899  244.738     16.4271  76.8966    177.314     8.85546     357.314     
1 1 1 31 3  48 o 16 48.3428 4.21289 42.6915     9.70474  44.0814     10.2748  39.4597    122.054     18.3429     122.054     
1 1 1 31 3  49 o 2  40.7292 4.8126  28.4171     9.11952  34.6369     9.82749  23.4047    198.881     4.88503     18.8807     
1 1 1 31 3  50 o 11 24.9975 5.90605 14.9295     8.8696   7.51493     8.94809  7.57434    267.293     11.1481     87.2931     
1 1 1 31 3  51 o 11 37.0405 5.54088 28.1429     9.92183  25.4197     10.0076  6.17666    65.7259     36.0263     245.726     
1 1 1 31 3  52 o 7  142.888 2.97222 358.265     21.4614  381.067     21.0261  95.4118    308.234     5.75847     128.234     
1 1 1 31 3  53 f 0  50.4162 4.54386 46.7959     11.306   49.29       11.1174  34.5759    115.003     0           0           
1 1 1 31 3  54 o 1  27.8887 6.50972 15.279      11.1632  15.2016     9.98623  13.7036    150.026     4.32977     330.026     
1 1 1 31 3  55 o 17 25.5596 6.34079 6.63486     11.3386  16.2008     9.71583  12.7259    183.437     0.19427     3.4372      
1 1 1 31 3  56 o 6  20.5458 6.03898 5.46136     11.1068  2.57313     9.36652  2.15115    295.082     18.3794     115.082     
1 1 1 31 3  57 o 11 41.2833 5.85506 35.7974     12.601   33.3241     10.7717  17.8271    65.9231     17.776      245.923     
1 1 1 31 3  58 o 16 35.7192 6.35152 34.4953     12.3561  19.6985     10.7032  26.202     249.537     11.638      249.537     
1 1 1 31 3  59 o 12 27.5062 6.72291 15.0818     12.0771  15.5689     10.5253  6.87708    261.438     19.1303     81.4382     
1 1 1 31 3  60 o 6  53.9566 4.72829 57.0213     13.0287  56.1498     11.9687  44.1196    168.425     19.6548     168.425     
1 1 1 31 3  61 o 16 22.2011 6.2118  7.36437     10.0328  7.73735     10.4562  6.50976    137.845     5.35255     317.845     
1 1 1 31 3  62 o 12 42.9217 5.83647 37.1955     11.5856  38.6207     12.6058  19.7338    16.0909     14.7205     196.091     
1 1 1 31 3  63 o 2  95.0975 3.64868 182.455     18.0611  156.489     16.5906  71.1574    168.004     17.0294     168.004     
1 1 1 31 3  64 o 1  38.1523 6.02957 55.5578     12.9649  6.19402     13.6677  26.8495    120.444     8.08729     120.444     
1 1 1 31 3  65 o 8  29.776  7.70834 25.6731     16.9948  13.2261     13.1532  15.3346    257.862     3.05041     77.8621     
1 1 1 31 3  66 o 16 24.2271 7.10298 3.99046     14.501   12.4559     14.1555  10.7654    86.2586     0.997029    266.259     
1 1 1 31 3  67 o 7  19.5531 6.3607  -2.33558    13.9955  -6.1989     14.7397  4.72758    286.709     2.40146     106.709     
1 1 1 31 3  68 o 12 29.2613 7.77961 12.9212     15.4356  26.4529     16.2067  11.7543    116.387     6.17297     116.387     
1 1 1 31 3  69 o 8  35.8    8.11672 32.4165     15.9773  34.163      16.9995  19.1472    219.511     2.65278     39.5113     
1 1 1 31 3  70 o 8  21.6827 6.84625 9.44709     15.2796  -5.16317    15.8307  2.59337    336.345     1.5636      156.345     
1 1 1 31 3  71 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 3  72 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 4  0  o 17 224.713 2.77566 896.74      31.236   896.74      31.236   240.2      180         145.116     180         
1 1 1 31 4  1  o 16 87.3728 2.67273 145.587     11.6579  126.465     11.6482  42.8598    214.061     36.3714     34.0607     
1 1 1 31 4  2  o 6  168.775 2.53507 511.27      20.9797  500.492     21.8826  146.558    318.272     47.8027     318.272     
1 1 1 31 4  3  o 5  91.733  2.68161 150.46      12.5906  149.016     12.007   82.1218    197.609     58.2231     197.609     
1 1 1 31 4  4  o 14 129.323 2.4952  299.119     16.1757  295.319     16.1361  110.005    309.48      35.8028     309.48      
1 1 1 31 4  5  o 5  151.944 2.60031 408.466     19.8258  411.686     19.7742  115.823    266.368     11.1521     266.368     
1 1 1 31 4  6  o 6  138.127 2.52372 335.615     17.4107  342.547     17.4986  83.6382    125.412     33.2191     305.412     
1 1 1 31 4  7  o 3  18.9908 5.24651 7.10295     7.41112  -1.18157    7.72221  14.5509    302.307     35.6208     302.307     
1 1 1 31 4  8  o 9  104.343 2.66986 196.312     13.2671  191.069     14.5579  61.4411    58.4792     25.2733     238.479     
1 1 1 31 4  9  o 1  94.2501 2.69536 155.488     12.5236  160.72      12.8864  67.0816    153.676     3.86723     153.676     
1 1 1 31 4  10 o 10 47.8684 3.83979 30.376      8.44824  54.0524     9.1872   0.0639909  272.151     59.8356     92.1511     
1 1 1 31 4  11 o 14 127.801 2.53877 290.157     15.8323  290.586     16.6455  116.134    222.859     51.7217     222.859     
1 1 1 31 4  12 o 8  193.826 2.61785 691.864     24.8281  643.617     25.9501  180.971    46.2093     79.775      46.2093     
1 1 1 31 4  13 o 19 117.413 2.63164 248.887     14.6894  241.572     16.1787  108.966    326.355     54.651      326.355     
1 1 1 31 4  14 o 8  127.204 2.53731 288.741     15.6922  286.699     16.608   90.4081    103.274     1.6135      283.274     
1 1 1 31 4  15 o 19 54.8473 3.49678 60.6207     9.05992  47.8005     9.73291  25.6739    291.362     13.0964     111.362     
1 1 1 31 4  16 o 9  57.582  3.46142 65.2523     9.72829  53.9968     9.95687  12.32      21.8848     51.3404     201.885     
1 1 1 31 4  17 o 3  246.625 2.89019 1077.02     34.2096  1086.94     37.183   190.428    73.0459     18.9821     73.0459     
1 1 1 31 4  18 o 13 112.404 2.62647 219.974     14.6667  229.811     14.8812  93.5658    140.921     29.393      140.921     
1 1 1 31 4  19 o 15 67.1156 3.08744 81.5008     9.93049  79.5739     10.699   46.2383    221.139     8.55427     221.139     
1 1 1 31 4  20 o 15 92.6344 3.13856 149.919     14.5284  156.485     14.5216  39.5281    341.903     52.0036     161.903     
1 1 1 31 4  21 o 16 40.9105 4.98137 40.0429     9.74985  22.7928     9.61392  3.03508    81.4087     41.0837     261.409     
1 1 1 31 4  22 o 13 132.486 2.83894 312.664     18.6306  312.819     19.0219  101.616    172.607     13.6617     172.607     
1 1 1 31 4  23 o 3  95.8556 3.23715 175.622     15.9541  153.174     15.0504  64.7796    93.399      4.56461     273.399     
1 1 1 31 4  24 o 4  139.184 3.01402 354.123     19.7523  337.076     22.1063  113.076    165.908     27.061      165.908     
1 1 1 31 4  25 o 9  38.5345 5.38363 27.9906     8.69287  27.3585     11.2814  5.7682     245.288     58.2828     245.288     
1 1 1 31 4  26 o 9  121.469 2.76635 261.462     15.7522  264.765     17.8295  95.6099    334.934     19.1875     334.934     
1 1 1 31 4  27 o 12 59.9352 3.5906  70.3994     10.0277  59.2511     11.1288  30.6343    282.497     16.4096     102.497     
1 1 1 31 4  28 o 17 61.4033 3.39929 71.8317     9.59776  63.8993     10.9825  37.8688    204.963     24.2583     204.963     
1 1 1 31 4  29 o 11 28.1753 5.47912 9.28443     7.876    20.4399     8.61192  2.855      28.8933     23.9687     28.8933     
1 1 1 31 4  30 o 12 79.2483 3.09172 110.48      11.98    114.566     12.483   37.8065    10.3132     33.7054     190.313     
1 1 1 31 4  31 o 9  108.989 2.779   210.162     14.7812  214.203     15.5231  64.0785    213.077     25.9532     33.077      
1 1 1 31 4  32 o 10 61.0216 3.50688 59.2878     10.1664  75.5097     11.064   40.3281    63.6994     1.37715     63.6994     
1 1 1 31 4  33 o 12 142.952 2.8326  352.736     19.6943  377.865     20.8561  145.18     208.843     88.636      208.843     
1 1 1 31 4  34 o 12 78.2087 3.38332 113.411     12.8937  106.727     13.4647  49.1337    1.73336     10.4635     181.733     
1 1 1 31 4  35 o 17 47.5541 4.58485 39.2077     10.1009  44.2212     11.1922  23.9774    104.84      14.9606     284.84      
1 1 1 31 4  36 o 17 23.927  6.07204 10.7488     8.56778  7.06379     10.1958  2.43505    247.403     30.8503     247.403     
1 1 1 31 4  37 o 18 43.1206 4.94386 40.6288     9.81237  29.2062     10.5138  31.5094    225.434     12.6343     225.434     
1 1 1 31 4  38 o 2  43.3921 4.84383 35.1533     9.79003  35.1144     10.5612  14.7587    216.859     28.1757     36.8595     
1 1 1 31 4  39 o 16 125.172 2.93257 276.593     16.9715  285.88      19.7039  106.597    151.595     36.6133     151.595     
1 1 1 31 4  40 o 13 23.6839 5.77263 11.2351     8.10526  7.87254     8.65279  3.85515    240.237     13.2729     60.2371     
1 1 1 31 4  41 o 19 81.664  3.16156 115.853     12.2972  124.937     13.4849  74.0923    3.0677      36.2727     3.0677      
1 1 1 31 4  42 o 17 53.3288 3.86269 54.4973     9.81951  49.802      10.4653  34.1573    40.354      3.01908     220.354     
1 1 1 31 4  43 o 10 54.9583 4.09523 50.313      10.9109  61.1696     11.2421  27.4638    257.874     19.6075     77.874      
1 1 1 31 4  44 o 14 16.2368 5.02964 -2.51627    7.32305  0.135236    8.29905  4.97851    135.363     22.4158     135.363     
1 1 1 31 4  45 o 19 31.0779 5.52675 12.7971     8.25626  25.1439     9.32378  2.30992    307.766     34.8926     127.766     
1 1 1 31 4  46 o 18 59.3774 3.7071  59.6136     10.3051  69.7219     11.5421  40.4667    207.013     0.975432    207.013     
1 1 1 31 4  47 o 6  112.918 2.92907 230.798     16.297   229.279     16.7909  69.4386    9.44865     18.1112     189.449     
1 1 1 31 4  48 o 8  70.3461 3.51797 82.2332     11.872   98.8129     12.7568  55.7314    96.8318     16.2705     96.8318     
1 1 1 31 4  49 o 13 69.7475 3.44189 81.5631     11.5341  96.3357     12.367   49.3348    11.7745     3.91227     11.7745     
1 1 1 31 4  50 o 17 20.7835 5.69223 8.19799     8.22529  2.82415     9.01485  5.06127    14.0559     6.90614     194.056     
1 1 1 31 4  51 o 14 24.4614 5.24054 -3.91973    8.06217  22.5438     9.29203  10.9352    234.039     1.61022     234.039     
1 1 1 31 4  52 o 18 32.1961 5.9323  17.4901     9.45978  24.2356     9.99194  21.6741    117.371     12.3965     117.371     
1 1 1 31 4  53 o 2  27.2066 6.0319  12.1147     8.66238  17.2731     9.71738  9.4439     271.419     13.9689     91.4194     
1 1 1 31 4  54 o 9  58.0355 3.91058 64.8169     10.6736  61.1459     11.7168  32.5016    133.208     12.9092     313.208     
1 1 1 31 4  55 o 15 47.3629 4.57522 39.8963     9.95606  46.4026     11.2083  36.4685    144.185     11.6983     144.185     
1 1 1 31 4  56 o 4  21.9917 6.06331 7.57088     9.36668  7.24334     9.91656  7.80084    325.422     0.824821    145.422     
1 1 1 31 4  57 o 15 32.7621 6.48944 22.9518     11.578   22.4758     10.588   13.4664    33.115      13.7874     213.115     
1 1 1 31 4  58 o 10 67.8131 4.11499 86.0243     14.0237  88.3772     13.6627  56.5942    48.4758     23.9079     48.4758     
1 1 1 31 4  59 f 0  23.8702 6.54437 11.5126     11.5065  7.83876     10.9021  7.50507    40.1437     0           0           
1 1 1 31 4  60 o 14 20.2421 6.07349 8.2632      11.2664  -3.93193    10.8804  2.48905    207.734     14.2138     27.734      
1 1 1 31 4  61 o 7  15.3791 5.10884 -8.79794    9.6375   -6.92832    10.3886  1.73016    38.9173     14.3682     38.9173     
1 1 1 31 4  62 o 17 62.5095 5.02806 83.7359     14.7026  70.3508     15.9037  38.2088    253.444     5.24766     73.4443     
1 1 1 31 4  63 o 12 99.9993 4.00162 185.838     19.2413  192.569     20.6931  75.9768    351.522     19.6778     351.522     
1 1 1 31 4  64 o 2  22.199  6.45965 12.6063     11.7577  -4.65974    13.1774  6.05216    11.2329     11.8024     191.233     
1 1 1 31 4  65 o 6  26.3837 7.31233 28.4744     17.3723  -6.61299    13.746   9.6057     211.98      4.72231     211.98      
1 1 1 31 4  66 o 3  31.8416 7.8877  31.9276     15.8705  15.2953     16.6838  18.9113    354.156     2.25506     354.156     
1 1 1 31 4  67 o 1  20.8211 6.71426 2.51582     14.7111  -6.41255    16.7451  4.85231    41.8475     2.22056     221.847     
1 1 1 31 4  68 o 3  34.233  8.32196 31.6652     15.8907  30.8607     18.9431  18.3788    253.225     1.53093     73.2252     
1 1 1 31 4  69 o 16 22.2938 7.06852 7.53908     15.7639  -0.470427   17.3143  4.95142    338.109     5.07247     158.109     
1 1 1 31 4  70 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 4  71 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 5  0  o 12 31.985  5.71672 21.3449     7.92352  21.3449     7.92352  1.22084    360         18.7301     360         
1 1 1 31 5  1  o 4  61.0456 3.1309  70.8698     9.46689  62.553      9.5245   18.2951    317.467     44.6939     137.467     
1 1 1 31 5  2  o 2  20.1212 5.05658 11.0807     7.07312  -2.18675    7.3375   9.45332    189.006     24.5558     189.006     
1 1 1 31 5  3  o 11 124.019 2.57844 283.987     16.3571  263.264     15.6603  107.171    345.505     37.6575     345.505     
1 1 1 31 5  4  o 1  106.994 2.58819 211.531     14.1171  195.921     13.5969  63.6811    101.607     25.8151     281.607     
1 1 1 31 5  5  o 2  20.9077 5.16687 0.182642    7.31913  11.4187     7.19665  1.0388     83.6644     2.81337     83.6644     
1 1 1 31 5  6  o 6  49.0646 3.65501 47.3624     8.6002   39.5564     8.98887  15.0256    236.553     1.8895      236.553     
1 1 1 31 5  7  o 5  99.3916 2.59903 170.728     12.8263  180.935     13.0168  96.9967    356.207     65.0257     356.207     
1 1 1 31 5  8  o 15 61.5911 3.1489  70.6312     9.80533  65.1471     9.49986  22.6947    256.857     36.1925     76.8571     
1 1 1 31 5  9  o 16 66.4598 3.11916 73.5628     10.3548  84.5275     10.2564  42.9143    349.259     1.79781     349.259     
1 1 1 31 5  10 o 5  146.776 2.50128 383.318     18.7565  382.324     18.0337  122.886    278.578     33.3195     278.578     
1 1 1 31 5  11 o 7  135.771 2.55629 333.13      17.4294  322.635     17.324   90.2386    168.532     16.5432     348.532     
1 1 1 31 5  12 o 3  131.127 2.50919 312.371     16.0305  299.318     16.8811  94.4225    266.623     0.570632    86.6229     
1 1 1 31 5  13 o 3  129.673 2.56822 294.791     16.0141  303.547     17.3225  91.8299    100.437     3.57562     280.437     
1 1 1 31 5  14 o 16 117.695 2.56059 239.144     14.6712  253.953     15.5018  75.6855    191.105     17.9032     11.105      
1 1 1 31 5  15 o 18 60.3425 3.32403 66.9817     10.0354  63.6014     9.9075   23.1843    238.575     33.6621     58.5749     
1 1 1 31 5  16 o 11 62.3816 3.61712 71.8937     10.7579  67.9361     11.6061  23.8987    278.037     35.8969     98.0373     
1 1 1 31 5  17 o 7  173.948 2.91922 537.955     24.5997  539.481     26.2699  153.361    287.046     53.8306     287.046     
1 1 1 31 5  18 o 19 83.9072 3.16071 118.767     12.8745  133.094     13.6099  65.7103    357.643     17.5199     357.643     
1 1 1 31 5  19 o 10 91.4436 3.16896 143.951     14.2905  154.993     14.6615  72.7196    189.055     19.1299     189.055     
1 1 1 31 5  20 o 3  102.635 3.0118  190.031     14.9813  186.057     15.9075  89.8134    122.247     36.7377     122.247     
1 1 1 31 5  21 f 0  100.509 3.12976 184.966     15.5526  176.083     15.8812  70.4698    215.601     0           0           
1 1 1 31 5  22 o 9  183.269 2.80163 601.686     24.9679  595.033     26.4632  145.424    64.8337     24.3425     64.8337     
1 1 1 31 5  23 o 2  83.3405 3.07027 120.688     12.6684  127.839     12.8865  48.1966    146.529     19.6547     326.529     
1 1 1 31 5  24 o 6  115.651 2.81597 233.537     15.7176  243.901     16.8735  94.5718    27.3784     25.4838     27.3784     
1 1 1 31 5  25 o 15 132.733 2.93284 320.855     17.6528  308.389     21.0833  130.9      81.189      74.6827     81.189      
1 1 1 31 5  26 o 16 17.8097 5.15276 -5.39176    7.27059  6.72366     8.29993  11.1138    354.464     29.0078     354.464     
1 1 1 31 5  27 o 3  42.5641 4.40857 37.6736     8.78519  29.1611     9.25892  13.5166    142.108     20.6566     322.108     
1 1 1 31 5  28 o 18 101.404 2.72246 187.86      13.6259  179.481     13.9774  48.5214    230.714     47.112      50.7137     
1 1 1 31 5  29 o 5  52.1237 3.99693 51.0941     9.74466  47.719      10.7193  34.0849    28.2132     7.14839     28.2132     
1 1 1 31 5  30 o 15 64.8766 3.73714 75.9239     11.8545  76.1968     12.233   35.0601    22.5461     18.3411     202.546     
1 1 1 31 5  31 o 9  74.8782 3.34694 98.7485     12.3912  102.984     12.598   51.3558    332.491     0.877085    152.491     
1 1 1 31 5  32 o 14 115.497 3.08593 223.509     18.1221  255.162     17.4193  71.6731    219.454     21.9221     39.454      
1 1 1 31 5  33 o 14 87.0358 3.47899 130.396     15.3961  142.635     14.7667  61.8248    16.9959     0.67648     16.996      
1 1 1 31 5  34 o 8  78.2603 3.35571 110.814     13.6882  109.897     12.4845  71.7732    126.23      35.6537     126.23      
1 1 1 31 5  35 o 4  16.0112 4.96295 -8.26097    7.86228  2.3363      8.05155  3.75565    69.4666     14.9018     69.4666     
1 1 1 31 5  36 o 12 17.4493 5.24807 -3.54594    7.84907  3.51838     8.51164  4.38619    111.075     20.9542     111.075     
1 1 1 31 5  37 o 4  27.7694 5.78244 16.6078     8.3716   12.413      8.96576  12.7064    242.162     61.3065     242.162     
1 1 1 31 5  38 o 9  44.4154 4.43939 37.8807     9.07795  35.378      10.0495  25.7902    26.0737     6.54105     206.074     
1 1 1 31 5  39 o 15 113.991 2.76937 239.252     14.751   227.394     16.7168  108.839    337.774     57.5658     337.774     
1 1 1 31 5  40 o 14 24.9905 5.89907 10.1338     7.88249  12.5123     9.45579  2.07461    167.518     0.352113    347.518     
1 1 1 31 5  41 o 16 86.3847 3.07167 129.696     12.568   139.826     13.9429  66.9649    208.613     13.6098     208.613     
1 1 1 31 5  42 o 9  114.603 2.96543 236.398     15.9376  237.007     18.0022  91.7108    219.001     22.4688     219.001     
1 1 1 31 5  43 o 15 32.5672 5.80104 14.5732     8.55262  27.5261     10.6646  14.9113    162.181     9.36966     342.181     
1 1 1 31 5  44 o 6  47.1135 4.86306 41.8337     10.0018  41.8505     12.1465  22.0088    59.2384     19.0703     239.238     
1 1 1 31 5  45 o 1  23.7051 5.95723 12.67       8.24873  4.70791     10.4049  4.89801    178.92      14.8466     358.92      
1 1 1 31 5  46 o 16 79.1446 3.34778 122.979     12.2327  105.193     13.926   59.0046    30.8575     9.10842     30.8575     
1 1 1 31 5  47 f 0  96.2908 3.22395 163.206     14.7051  173.511     16.3159  60.9338    225.731     0           0           
1 1 1 31 5  48 o 13 61.438  3.84301 73.2878     10.8946  65.9825     12.3457  52.7414    240.506     23.2727     240.506     
1 1 1 31 5  49 o 17 31.0735 5.85968 11.4941     8.53509  27.6539     10.6923  14.7791    292.552     8.72297     112.552     
1 1 1 31 5  50 o 1  51.1406 4.38895 52.6191     9.97579  45.9792     11.7387  27.1715    256.35      14.57       76.3502     
1 1 1 31 5  51 o 15 21.8844 5.95695 5.40043     8.52023  9.05623     9.92548  3.12149    24.5902     0.535465    24.5902     
1 1 1 31 5  52 o 3  35.2348 5.74211 28.3226     9.20705  21.6097     10.7669  17.8291    98.4139     9.4134      278.414     
1 1 1 31 5  53 o 6  15.0641 4.93392 -1.53957    8.45105  -15.1428    10.1281  0.625914   151.353     7.35096     331.353     
1 1 1 31 5  54 o 7  54.5907 4.58847 61.0839     10.6254  53.323      13.4081  40.6136    60.9914     8.90989     60.9915     
1 1 1 31 5  55 o 7  26.2844 6.31236 14.9346     9.12021  12.2871     10.9595  13.9826    323.449     3.03817     323.449     
1 1 1 31 5  56 o 4  22.6212 5.8043  15.091      8.71906  -2.18624    10.8171  7.61725    200.812     8.52563     20.8116     
1 1 1 31 5  57 o 19 17.2715 5.42855 0.0484466   8.35957  -2.79208    10.5661  1.91025    350.531     5.93572     170.531     
1 1 1 31 5  58 o 2  21.503  6.14932 7.73173     9.84038  4.54973     10.8324  2.75767    188.61      0.294597    8.61005     
1 1 1 31 5  59 o 3  24.1365 6.04715 -3.69704    10.8199  20.3522     10.6591  7.17638    106.602     0.822916    106.602     
1 1 1 31 5  60 o 14 21.7517 6.17986 1.94432     9.73128  11.178      11.1912  6.59248    64.736      4.72411     244.736     
1 1 1 31 5  61 o 19 20.4162 6.02353 9.19173     10.6043  -3.43423    10.8753  4.74059    107.342     10.426      287.342     
1 1 1 31 5  62 o 5  22.3689 6.46976 7.4026      11.7365  6.28725     11.2981  8.33608    108.588     1.19529     108.588     
1 1 1 31 5  63 o 13 20.0325 6.28889 3.78271     11.6541  -5.87279    14.2323  5.25602    266.581     8.79299     86.5814     
1 1 1 31 5  64 o 17 53.0105 6.35121 51.256      16.4703  69.1197     15.6598  38.0437    156.524     8.4143      156.524     
1 1 1 31 5  65 o 8  26.582  7.42448 27.8588     17.5869  -0.394734   13.2109  11.8469    211.95      4.8157      211.95      
1 1 1 31 5  66 o 9  27.6347 7.68824 14.8642     15.4492  19.4917     15.8477  9.33685    152.83      12.4041     332.83      
1 1 1 31 5  67 o 4  33.2717 8.55546 38.5369     19.1399  22.3263     18.6478  19.4965    124.915     5.71777     124.915     
1 1 1 31 5  68 o 8  24.7469 7.34722 21.7674     16.4551  -2.05817    16.2679  6.17312    26.1304     12.047      206.13      
1 1 1 31 5  69 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 6  0  o 1  132.907 2.47863 314.119     16.4831  314.119     16.4831  50.5859    8.10786e-07 97.694      180         
1 1 1 31 6  1  o 17 109.581 2.63899 216.539     13.7707  210.992     15.119   65.2972    153.051     27.5873     333.051     
1 1 1 31 6  2  o 3  17.0264 5.03506 1.28404     7.39682  0.68754     6.98221  8.06051    236.875     19.5737     236.875     
1 1 1 31 6  3  o 5  57.522  3.39896 62.7688     10.1053  56.0793     9.31713  19.788     60.1595     36.4003     240.16      
1 1 1 31 6  4  o 10 102.069 2.60654 199.604     13.1294  171.867     13.4118  52.952     261.68      41.0994     81.6803     
1 1 1 31 6  5  o 12 80.8331 2.73478 118.966     11.0412  114.029     11.047   67.6615    190.691     28.84       190.691     
1 1 1 31 6  6  f 0  18.436  5.10086 -1.15567    7.1874   6.80905     7.1225   44.2371    140.897     0           0           
1 1 1 31 6  7  o 9  101.09  2.63325 179.964     13.5286  184.007     13.0962  93.809     249.31      48.263      249.31      
1 1 1 31 6  8  o 4  63.5695 3.16157 67.0551     9.76017  77.8234     10.242   42.6979    32.2867     5.69838     32.2867     
1 1 1 31 6  9  o 3  26.9425 5.47827 13.3096     7.75944  13.4438     7.82259  1.71146    200.338     9.52433     200.338     
1 1 1 31 6  10 o 11 127.561 2.58703 296.692     16.5111  282.652     16.5226  131.081    122.316     82.1963     122.316     
1 1 1 31 6  11 o 7  62.7083 3.34782 73.5604     10.7288  67.5363     10.1595  43.3977    35.1145     9.43159     35.1145     
1 1 1 31 6  12 o 13 82.3152 3.02131 123.468     12.3982  118.601     12.4383  56.9264    121.492     0.0889064   301.49      
1 1 1 31 6  13 o 9  72.7718 3.37147 97.7947     13.0751  91.9973     11.3617  61.3863    344.833     33.2976     344.833     
1 1 1 31 6  14 o 17 144.755 3.01828 375.956     21.7865  371.443     21.9546  75.1611    359.743     61.7055     179.743     
1 1 1 31 6  15 o 2  24.5478 5.95772 10.6372     9.31722  9.4842      8.37241  7.06243    313.818     27.8821     313.818     
1 1 1 31 6  16 o 4  83.0356 3.2007  121.294     13.7886  125.426     12.7025  58.9465    146.423     2.84071     146.423     
1 1 1 31 6  17 o 18 166.404 3.05501 487.937     24.7494  500.283     26.155   125.893    20.2018     8.61319     20.2018     
1 1 1 31 6  18 o 16 100.508 2.80657 189.58      13.4313  171.176     14.6638  68.8986    166.345     5.15378     346.345     
1 1 1 31 6  19 o 15 33.2596 5.31516 22.6292     8.19819  18.884      9.12722  0.845646   279.741     34.9646     279.741     
1 1 1 31 6  20 o 3  173.94  2.6365  552.44      22.8619  525.577     23.0851  158.346    217.907     63.9311     217.907     
1 1 1 31 6  21 o 4  24.5762 5.72603 6.825       7.86663  14.0911     8.78708  7.48614    60.82       30.3095     60.82       
1 1 1 31 6  22 o 1  107.006 2.81379 207.708     15.6659  201.272     14.4507  54.4037    242.428     44.8128     62.4276     
1 1 1 31 6  23 o 7  81.3075 3.11876 121.241     12.3216  115.673     12.9683  51.4384    347.981     9.88356     167.981     
1 1 1 31 6  24 o 8  60.9373 3.67483 70.906      10.3607  63.2737     11.7028  34.6325    207.948     10.6624     27.9479     
1 1 1 31 6  25 f 0  117.316 3.00332 233.535     17.1558  259.113     18.1006  68.6004    335.425     0           0           
1 1 1 31 6  26 o 12 26.5853 6.07574 16.5403     9.49106  8.28403     9.42291  11.8722    141.487     51.9474     141.487     
1 1 1 31 6  27 o 1  137.621 2.9476  336.617     20.4987  340.846     20.1072  93.8711    302.82      11.0735     122.82      
1 1 1 31 6  28 o 13 65.0258 3.86977 72.3797     12.3895  80.8847     12.5747  32.2378    243.95      25.7841     63.95       
1 1 1 31 6  29 o 18 60.4262 3.89079 64.0836     11.0464  68.464      12.2573  54.5821    198.668     33.3091     198.668     
1 1 1 31 6  30 o 7  29.2406 6.14635 19.88       9.05927  11.1892     10.9988  1.61776    32.6809     32.3155     212.681     
1 1 1 31 6  31 o 19 55.8501 3.80139 49.1076     9.94619  64.828      11.0299  28.9002    340.635     19.4944     160.635     
1 1 1 31 6  32 o 3  69.644  3.25545 77.6273     10.2676  97.8343     12.3608  51.5998    71.4496     6.0742      71.4496     
1 1 1 31 6  33 o 4  70.2761 3.30039 83.1201     10.7587  95.3579     12.3697  37.934     227.648     23.1481     47.648      
1 1 1 31 6  34 o 11 117.844 2.75135 253.152     15.5076  244.675     16.8856  114.422    248.338     61.4005     248.338     
1 1 1 31 6  35 o 9  195.153 2.8684  653.82      27.6205  712.606     28.4763  138.872    41.3904     3.33521     221.39      
1 1 1 31 6  36 o 8  25.777  5.95847 9.51052     8.74795  14.6379     9.13001  3.61575    63.7231     21.6542     243.723     
1 1 1 31 6  37 o 9  60.4549 3.83098 70.5606     10.937   63.1122     11.9072  58.1646    316.159     37.7853     316.159     
1 1 1 31 6  38 o 12 61.4542 3.6819  60.3287     10.7532  78.0636     11.6607  46.2127    149.273     8.38343     149.273     
1 1 1 31 6  39 o 7  77.3567 3.29648 108.323     12.5988  108.54      12.8403  49.7241    206.626     8.90122     26.6262     
1 1 1 31 6  40 o 4  25.2619 5.8335  14.167      8.06821  8.72636     9.31797  2.05407    236.915     25.5251     56.9154     
1 1 1 31 6  41 o 9  31.875  5.70138 20.7101     8.52968  18.8423     9.74401  17.3708    228.988     6.57615     228.988     
1 1 1 31 6  42 o 8  24.6841 5.89768 11.8757     7.98278  9.93672     9.47464  7.38225    230.317     1.83763     50.3167     
1 1 1 31 6  43 f 0  99.9559 3.05128 177.786     13.7224  183.522     16.6647  55.8083    66.0646     0           0           
1 1 1 31 6  44 o 18 18.78   5.46943 6.06195     7.85605  -3.56731    9.68022  1.41518    346.421     5.49651     166.421     
1 1 1 31 6  45 o 8  85.1731 3.21286 135.031     12.726   128.523     14.4834  48.8001    37.1165     21.155      217.117     
1 1 1 31 6  46 o 16 22.2386 5.81475 12.1282     8.2229   -0.206027   10.5698  6.68206    113.419     6.80997     293.419     
1 1 1 31 6  47 o 4  20.6885 5.60106 10.8059     7.89719  -5.01447    10.6434  4.82128    266.541     10.4756     86.5409     
1 1 1 31 6  48 o 13 25.2179 6.22426 9.64122     8.28544  14.0241     11.0512  12.4259    76.101      0.530417    76.101      
1 1 1 31 6  49 o 15 39.2312 5.30618 32.6084     9.21162  27.7406     10.7741  33.2225    181.998     19.7707     181.998     
1 1 1 31 6  50 o 4  40.6378 5.35723 40.0714     9.39834  25.4787     11.1879  32.664     256.133     14.1971     256.133     
1 1 1 31 6  51 o 14 28.5844 6.05271 9.92515     8.88578  23.4117     10.476   10.6466    9.5585      14.2994     189.559     
1 1 1 31 6  52 o 19 55.0715 4.35078 60.5507     10.7933  54.9381     12.5592  29.4708    220.284     15.5055     40.2838     
1 1 1 31 6  53 o 1  23.7823 6.23273 4.51447     9.41548  15.2257     10.8566  9.74294    92.1722     2.14795     92.1722     
1 1 1 31 6  54 o 12 33.8594 6.05627 26.0155     9.55842  21.6795     11.161   21.3977    157.293     1.47357     157.293     
1 1 1 31 6  55 o 15 27.4289 6.31864 15.2497     9.27655  15.7818     10.6837  10.8891    187.843     10.6525     7.84279     
1 1 1 31 6  56 o 3  23.9236 6.23494 11.7967     9.09249  9.0595      10.8275  7.80228    223.82      10.2465     43.8202     
1 1 1 31 6  57 o 4  31.0841 6.2828  22.2239     9.5114   18.691      11.2794  14.8344    269.805     7.25914     89.8047     
1 1 1 31 6  58 o 2  28.2391 6.41811 19.0334     9.64523  14.177      11.365   14.2801    129.039     1.50901     309.038     
1 1 1 31 6  59 o 12 27.8094 6.75151 16.4328     11.4548  16.0257     11.2638  9.68706    343.276     5.06276     343.276     
1 1 1 31 6  60 o 15 47.315  5.53031 46.5859     12.881   44.2385     12.4314  29.53      323.958     2.12139     143.958     
1 1 1 31 6  61 f 0  39.5925 6.40728 35.7925     12.5823  31.3961     12.3103  34.3909    157.615     0           0           
1 1 1 31 6  62 f 0  26.0611 7.18669 17.0149     14.0104  8.77346     13.3494  13.1324    340.104     0           0           
1 1 1 31 6  63 o 12 27.7001 7.64178 13.7526     15.6162  18.399      15.1678  7.35341    169.767     4.31425     169.767     
1 1 1 31 6  64 o 19 31.5038 7.81156 18.2563     17.9832  28.4975     14.0888  12.076     12.9443     13.6681     192.944     
1 1 1 31 6  65 o 16 19.6794 6.52939 -4.0351     18.9773  -5.82616    13.0444  3.86197    23.4106     5.66595     203.411     
1 1 1 31 6  66 o 18 27.8294 7.49186 1.50532     16.5219  30.6187     15.9177  12.5846    353.4       1.82444     173.4       
1 1 1 31 6  67 o 4  23.1523 7.5414  -8.57077    16.3084  17.3416     23.1942  5.01868    110.331     2.8037      290.331     
1 1 1 31 6  68 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 7  0  o 11 84.116  2.95889 126.629     12.4022  126.629     12.4022  63.686     180         1.37434     180         
1 1 1 31 7  1  o 14 159.65  2.70763 452.241     21.1447  455.076     22.172   111.436    333.127     12.5762     153.127     
1 1 1 31 7  2  o 2  91.0126 2.88026 140.921     13.1324  154.87      13.0477  40.8895    184.279     49.327      4.27922     
1 1 1 31 7  3  o 5  42.0097 4.6362  30.4149     9.66515  34.4685     9.14889  4.7867     124.582     41.9459     304.582     
1 1 1 31 7  4  o 7  20.264  5.50682 7.50498     8.21322  2.07305     7.74997  31.2239    271.074     81.2917     271.074     
1 1 1 31 7  5  o 14 25.7053 5.71148 6.78101     9.00468  15.815      8.1348   9.67511    201.426     39.08       201.426     
1 1 1 31 7  6  o 5  156.122 2.81007 438.284     22.4151  430.406     21.5183  150.76     158.882     73.7786     158.882     
1 1 1 31 7  7  o 6  113.635 2.87563 226.457     15.875   234.209     16.8228  76.2671    10.654      12.3488     190.654     
1 1 1 31 7  8  o 15 43.8863 4.57813 28.9687     9.36351  42.268      10.0024  17.6521    74.3525     11.4301     254.353     
1 1 1 31 7  9  o 11 73.2331 3.3894  98.8101     12.6855  93.544      12.0584  11.2951    51.6935     81.9645     231.693     
1 1 1 31 7  10 o 2  22.4221 5.80403 -0.802803   9.50479  12.4271     8.92839  9.34839    165.956     30.9299     165.956     
1 1 1 31 7  11 o 9  87.0456 3.20652 128.317     14.4609  143.031     13.2917  47.6962    119.608     41.4324     119.608     
1 1 1 31 7  12 f 0  91.2756 3.03652 138.438     13.8595  159.771     13.7798  36.8632    231.602     0           0           
1 1 1 31 7  13 o 4  57.8355 3.70362 67.2144     10.641   53.8364     10.4969  30.2684    150.406     15.2272     330.406     
1 1 1 31 7  14 o 2  36.8926 5.11819 32.8727     9.79338  18.7679     8.49852  1.37106    293.268     46.1876     293.268     
1 1 1 31 7  15 o 17 75.3006 3.03719 104.888     11.261   98.1843     11.5445  63.5187    34.4799     28.1095     34.4799     
1 1 1 31 7  16 o 18 32.2985 5.49674 19.7674     8.99037  19.5627     8.58861  2.54772    298.734     19.2732     118.734     
1 1 1 31 7  17 o 12 200.149 2.70897 707.759     27.049   720.41      27.2945  143.971    216.587     6.74908     36.5868     
1 1 1 31 7  18 o 11 177.422 2.64437 570.564     23.4319  551.597     23.5843  161.444    343.754     63.768      343.754     
1 1 1 31 7  19 o 10 91.5998 2.80597 156.553     12.7371  143.5       12.9343  57.6171    310.931     14.7025     130.93      
1 1 1 31 7  20 o 16 122.44  2.70297 282.564     16.6337  253.051     16.4666  129.843    9.4261      88.4782     9.4261      
1 1 1 31 7  21 o 16 44.0399 4.37589 38.6716     8.92944  32.663      9.69344  16.7124    320.666     19.4762     140.666     
1 1 1 31 7  22 o 14 70.1711 3.54617 84.4579     11.2898  93.0702     13.4708  38.2691    77.5547     20.9627     257.555     
1 1 1 31 7  23 o 17 159.455 3.05053 450.772     22.7436  459.069     25.8866  149.059    153.641     66.6387     153.641     
1 1 1 31 7  24 o 5  29.4503 6.07673 20.9667     8.6689   9.67851     11.6013  4.25427    1.42387     17.7922     181.424     
1 1 1 31 7  25 o 13 81.8801 3.78346 109.149     14.426   133.599     16.4741  67.8493    166.529     20.9358     166.529     
1 1 1 31 7  26 o 1  60.1585 4.04209 63.3185     10.9094  68.3738     13.1294  11.1629    55.635      62.9267     235.635     
1 1 1 31 7  27 o 19 50.1665 4.46638 37.0763     10.1218  56.4705     11.7108  38.7484    323.636     11.8504     323.636     
1 1 1 31 7  28 o 19 59.1773 3.52848 64.1271     10.0287  62.6615     10.6825  50.6249    93.2346     21.2856     93.2346     
1 1 1 31 7  29 o 12 38.2109 4.96078 36.8908     8.51345  19.0221     9.36961  4.11354    359.787     60.6204     359.787     
1 1 1 31 7  30 o 4  151.115 2.74921 381.333     20.3665  437.184     21.2299  102.696    139.025     13.9433     319.025     
1 1 1 31 7  31 o 3  60.3221 3.49476 74.117      10.0441  58.2962     10.6708  46.2146    220.906     9.41855     220.906     
1 1 1 31 7  32 o 16 53.7633 3.84999 54.7316     10.1572  50.9294     10.2843  35.6425    266.356     2.22722     86.3561     
1 1 1 31 7  33 o 7  82.6493 2.97811 118.049     12.0335  128.001     12.5556  79.5802    230.061     43.7855     230.061     
1 1 1 31 7  34 f 0  129.105 2.80639 307.56      18.6339  291.222     17.6409  74.3859    23.5707     0           0           
1 1 1 31 7  35 o 14 134.16  2.64507 311.979     17.0897  334.038     18.4476  103.432    157.799     14.2971     157.799     
1 1 1 31 7  36 o 3  26.4352 5.3308  2.54317     7.83736  22.9875     8.98868  5.84622    120.236     18.8641     300.236     
1 1 1 31 7  37 o 11 77.0311 3.08818 107.475     11.4078  107.074     12.3161  47.9838    102.686     12.6767     282.686     
1 1 1 31 7  38 o 19 38.1169 5.08672 19.0325     9.00596  37.7414     9.60303  9.63645    253.413     31.7429     73.4126     
1 1 1 31 7  39 o 9  77.5695 3.20745 104.17      12.23    114.112     12.5919  61.213     297.444     14.0208     297.444     
1 1 1 31 7  40 o 3  75.5968 3.24966 93.6657     11.9662  114.308     12.4903  51.8567    358.043     2.07937     178.043     
1 1 1 31 7  41 o 10 43.2278 4.80677 27.5657     9.41205  44.1        10.5628  32.8596    94.1242     10.6272     94.1242     
1 1 1 31 7  42 o 10 54.8245 3.95218 62.0071     10.4419  49.3749     10.7831  36.0516    65.3321     2.63969     245.332     
1 1 1 31 7  43 o 3  74.4137 3.31235 106.567     11.46    95.2645     12.9419  35.2566    196.619     33.6611     16.6194     
1 1 1 31 7  44 o 17 57.5603 4.00411 61.9634     10.7243  60.7931     12.0118  37.8544    62.9146     3.18243     242.915     
1 1 1 31 7  45 o 3  27.801  6.05705 17.3624     8.54269  12.2834     10.4156  15.5852    166.14      3.67355     166.14      
1 1 1 31 7  46 o 15 38.2804 5.38885 24.288      9.49461  33.4968     10.4784  23.2775    268.238     3.47676     88.2382     
1 1 1 31 7  47 o 7  32.4621 5.82399 17.299      8.86853  25.3195     10.2146  18.1915    165.337     12.6482     165.337     
1 1 1 31 7  48 o 16 42.0975 5.49592 39.3466     9.77116  30.7999     12.206   25.9869    281.444     3.77581     101.444     
1 1 1 31 7  49 o 5  34.9391 6.05351 20.6644     9.15035  29.7616     11.9421  26.274     332.603     10.4314     332.603     
1 1 1 31 7  50 o 19 20.9273 5.93504 8.38953     8.4992   0.787051    11.2713  0.918101   214.773     27.0142     214.773     
1 1 1 31 7  51 o 7  25.2282 6.15277 17.5084     9.07993  3.59932     11.8509  11.1543    183.166     6.43946     3.16571     
1 1 1 31 7  52 o 7  36.9069 6.32521 20.9326     10.6688  37.3311     12.801   27.6361    42.2123     10.3106     42.2123     
1 1 1 31 7  53 o 9  21.8844 6.20656 7.79476     8.88319  5.27801     12.1164  7.73196    201.548     5.48335     21.5476     
1 1 1 31 7  54 o 10 25.4577 6.54029 16.0786     9.75764  6.49747     13.1947  8.48186    20.5847     12.3889     200.585     
1 1 1 31 7  55 o 15 68.1593 3.81636 84.186      12.4742  91.2504     13.3893  46.2495    62.4823     0.779364    62.4822     
1 1 1 31 7  56 o 11 25.8174 6.38683 13.6348     9.5467   13.2681     10.8753  9.70892    112.641     8.73932     292.641     
1 1 1 31 7  57 o 14 27.6998 6.58286 14.346      9.80128  18.0933     11.7845  14.5736    31.5937     4.34203     31.5937     
1 1 1 31 7  58 o 14 20.495  5.67345 12.6696     9.09395  -7.90614    10.6528  5.96473    223.767     7.3633      43.7673     
1 1 1 31 7  59 f 0  23.2431 6.51712 8.20658     10.9906  9.38748     11.6055  4.03341    266.962     0           0           
1 1 1 31 7  60 o 16 21.591  6.28403 14.0966     12.422   -6.21504    11.1067  8.19415    247.028     4.60595     67.0284     
1 1 1 31 7  61 o 4  23.1775 6.7428  -2.04843    15.4968  13.0455     11.6912  9.33891    105.348     5.41083     285.348     
1 1 1 31 7  62 o 3  32.9304 7.85811 16.356      16.2751  35.6089     16.1035  20.5007    182.794     2.70338     182.794     
1 1 1 31 7  63 o 14 25.6255 7.41656 9.25751     14.9962  16.2293     15.4684  8.64248    344.288     3.14253     344.288     
1 1 1 31 7  64 o 7  22.804  6.90301 -12.32      15.7141  18.2173     15.3258  5.55673    199.724     11.9544     19.7238     
1 1 1 31 7  65 o 1  48.9337 7.94159 47.8978     20.775   75.5828     18.307   40.4258    297.869     23.8634     297.869     
1 1 1 31 7  66 o 10 27.1256 7.80503 24.8357     16.1099  6.95062     19.6398  9.10219    257.993     9.15368     77.993      
1 1 1 31 7  67 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 8  0  o 1  62.7443 3.63579 71.4887     11.2497  71.4887     11.2497  56.5767    3.12559e-05 25.1798     3.12559e-05 
1 1 1 31 8  1  o 7  93.492  2.91352 154.592     13.9575  157.752     13.2588  76.9586    204.891     21.8009     204.891     
1 1 1 31 8  2  o 11 59.3851 3.47483 59.3366     10.5159  67.7609     9.88353  9.54737    15.4205     63.7892     195.421     
1 1 1 31 8  3  o 2  112.119 2.7984  225.534     15.7053  223.159     15.6922  49.3208    240.839     65.7541     60.8394     
1 1 1 31 8  4  o 8  116.324 2.76348 244.275     16.2917  238.608     15.8823  109.126    158.529     51.4888     158.529     
1 1 1 31 8  5  o 15 30.9038 5.6944  17.4551     9.57203  18.4361     8.2778   1.48983    142.448     7.65848     322.448     
1 1 1 31 8  6  o 6  126.476 2.6936  296.762     17.7157  274.055     16.3973  117.618    356.395     52.3782     356.395     
1 1 1 31 8  7  o 3  83.9104 2.9794  135.544     12.8864  116.698     12.0848  53.8513    134.329     11.1975     314.329     
1 1 1 31 8  8  o 9  118.794 2.78052 242.155     16.9667  261.769     16.0226  100.93     316.583     30.0845     316.583     
1 1 1 31 8  9  o 5  29.4822 5.49041 19.2493     8.79837  13.5926     7.72204  1.64074    337.568     26.3443     337.568     
1 1 1 31 8  10 o 5  37.3606 5.09654 14.4563     9.58924  39.4052     8.56243  3.52233    106.713     35.7493     286.713     
1 1 1 31 8  11 o 5  82.8669 2.86903 117.234     11.7588  128.502     11.9879  44.2072    121.688     29.6142     301.688     
1 1 1 31 8  12 o 13 48.2099 3.74874 44.1811     9.06631  40.1885     8.74491  14.5954    299.009     33.0854     119.009     
1 1 1 31 8  13 o 2  68.3459 3.00777 83.3898     10.4549  84.0815     10.0402  57.4818    237.149     30.4468     237.149     
1 1 1 31 8  14 o 19 107.773 2.62298 210.423     14.4112  204.199     13.8803  44.2581    258.093     68.6092     78.0934     
1 1 1 31 8  15 f 0  43.2647 4.09739 37.7225     8.77254  30.9265     8.49739  32.3163    264.854     0           0           
1 1 1 31 8  16 o 17 141.502 2.64184 375.514     19.1259  339.543     18.3059  115.686    37.3258     24.749      37.3258     
1 1 1 31 8  17 o 5  95.1713 2.7001  175.127     13.0174  149.087     12.6492  72.9678    30.3868     10.112      30.3868     
1 1 1 31 8  18 o 2  58.0162 3.45415 59.931      10.1593  61.5559     9.726    26.8896    144.821     25.7451     324.821     
1 1 1 31 8  19 o 9  97.1702 2.97189 170.581     14.8274  167.59      14.0431  96.5197    84.7728     56.8316     84.7728     
1 1 1 31 8  20 o 13 95.9002 3.21902 164.871     16.6195  165.232     14.1211  96.9594    145.355     59.5699     145.355     
1 1 1 31 8  21 o 18 15.6164 4.95805 -1.53819    7.93046  -6.13654    8.36614  17.233     282.214     46.7577     282.214     
1 1 1 31 8  22 o 12 89.7519 3.0764  146.2       13.5927  142.898     13.9899  70.4016    272.647     11.9707     272.647     
1 1 1 31 8  23 f 0  89.315  3.07884 147.376     13.9667  139.074     13.5124  79.7262    119.712     0           0           
1 1 1 31 8  24 o 7  84.84   3.3184  145.456     13.1141  114.571     14.5992  57.3225    182.068     7.68999     2.06816     
1 1 1 31 8  25 o 3  50.0866 3.81684 44.3413     9.2158   47.1648     9.64454  24.9804    88.0273     19.4991     268.027     
1 1 1 31 8  26 o 17 47.9929 4.25422 44.4654     9.83089  40.3159     10.1371  32.155     333.656     0.261345    153.656     
1 1 1 31 8  27 o 11 31.1541 5.42783 19.7992     8.03163  17.2692     8.84649  13.2893    123.686     9.52472     303.686     
1 1 1 31 8  28 o 12 73.2045 3.11061 104.559     10.8144  88.9045     11.7398  64.1547    288.591     25.475      288.591     
1 1 1 31 8  29 o 18 38.2544 4.7359  20.4579     8.21184  35.4579     9.168    14.2212    259.117     22.4803     79.117      
1 1 1 31 8  30 o 7  42.1776 4.58495 32.7592     8.67696  33.6677     10.0458  27.101     322.822     0.856494    142.822     
1 1 1 31 8  31 o 6  109.441 2.73197 221.281     14.3761  208.867     15.4793  79.3272    18.8362     0.798806    18.8361     
1 1 1 31 8  32 o 5  83.4121 2.99189 119.384     12.105   131.665     12.8286  64.0342    340.585     9.33808     340.585     
1 1 1 31 8  33 o 1  73.1349 3.12534 94.1585     10.9325  99.338      11.869   59.3169    280.287     15.7801     280.287     
1 1 1 31 8  34 o 15 123.005 2.76858 265.424     15.6945  278.815     18.3444  102.817    175.818     28.8737     175.818     
1 1 1 31 8  35 o 15 86.9475 3.08742 137.103     12.5433  136.218     14.2125  78.0552    340.549     33.2934     340.549     
1 1 1 31 8  36 o 15 77.1838 3.17856 108.89      11.443   107.021     12.9706  67.3552    46.9955     26.5242     46.9955     
1 1 1 31 8  37 o 13 63.9278 3.51511 68.6797     10.7087  80.7664     11.6368  47.0063    231.243     5.06205     231.243     
1 1 1 31 8  38 o 15 29.6988 5.71984 10.8179     8.48525  23.8602     9.58723  10.5088    15.5616     15.5589     195.562     
1 1 1 31 8  39 o 8  23.9614 5.79384 16.959      9.25373  0.445756    9.36549  7.75488    266.677     2.90092     86.6766     
1 1 1 31 8  40 o 11 84.3299 3.17039 134.814     13.0298  123.472     13.6142  63.6972    250.82      8.64023     250.82      
1 1 1 31 8  41 o 16 58.1264 3.98439 57.8032     11.2709  67.4011     11.6159  44.7946    269.855     9.90198     269.855     
1 1 1 31 8  42 o 15 35.5445 5.76323 25.1252     9.83931  24.7939     10.255   20.3413    161.782     4.95447     341.782     
1 1 1 31 8  43 o 6  36.3217 5.68119 23.2619     9.74428  29.038      10.4175  24.152     113.289     2.00147     113.289     
1 1 1 31 8  44 o 4  90.2736 3.41714 139.57      15.1619  159.28      15.6172  70.8068    237.715     14.904      237.715     
1 1 1 31 8  45 o 3  78.6945 3.66247 110.111     14.9254  118.601     13.6988  67.1636    299.707     24.8864     299.707     
1 1 1 31 8  46 o 7  53.472  4.26295 47.112      10.6057  61.3678     11.8088  42.3005    18.2119     12.0656     18.2119     
1 1 1 31 8  47 f 0  35.099  6.10608 25.8536     9.51261  24.6194     11.8957  13.2913    217.253     0           0           
1 1 1 31 8  48 o 17 50.0343 4.6077  55.7443     10.5031  41.0155     11.5215  33.0202    153.624     1.76581     333.624     
1 1 1 31 8  49 o 11 22.0364 5.99994 6.33597     8.77614  9.31525     9.93015  2.94056    145.459     20.3734     325.459     
1 1 1 31 8  50 o 11 33.6807 5.93725 16.0757     9.68883  31.737      10.7951  25.203     322.489     11.2562     322.489     
1 1 1 31 8  51 o 4  22.5062 5.63788 -4.65658    8.63041  18.7568     10.0409  9.12067    6.56719     4.37943     186.567     
1 1 1 31 8  52 o 4  58.4498 4.13635 61.7314     11.1918  68.7488     12.7191  44.0486    170.08      9.50923     170.08      
1 1 1 31 8  53 o 16 20.7509 6.07051 0.411354    8.76982  9.87691     11.883   4.5146     178.127     1.39634     358.127     
1 1 1 31 8  54 o 9  18.3761 5.76987 0.788394    8.88595  -2.26193    12.4381  1.98926    217.276     11.0285     37.2763     
1 1 1 31 8  55 o 1  22.5295 6.37431 6.5137      9.25297  9.55666     12.5053  7.56325    299.4       5.4328      119.4       
1 1 1 31 8  56 o 18 22.2155 6.46034 5.23699     10.6849  8.14186     12.4152  4.80901    319.189     14.9237     139.189     
1 1 1 31 8  57 o 3  34.5137 6.90353 24.5694     11.3475  28.1653     13.6146  20.3778    268.575     1.99386     88.5747     
1 1 1 31 8  58 o 18 28.2309 6.86827 21.7135     12.2294  12.1296     11.7393  17.5674    48.0196     7.32825     48.0196     
1 1 1 31 8  59 o 8  25.3682 6.95288 7.49343     12.2037  16.8621     13.344   13.3248    146.294     3.2525      146.294     
1 1 1 31 8  60 o 6  72.8582 4.68635 99.2734     16.0872  110.856     17.7715  61.2164    28.8927     25.7366     28.8927     
1 1 1 31 8  61 o 5  24.6241 7.3276  5.59143     14.7134  14.3873     16.1743  10.4833    278.252     2.33298     278.252     
1 1 1 31 8  62 o 1  20.9371 6.65196 -13.7571    15.145   10.7278     15.4619  4.50806    265.102     1.29615     85.102      
1 1 1 31 8  63 o 18 31.1189 7.60327 7.24525     16.1317  39.8163     16.4976  17.8685    311.104     4.34362     311.104     
1 1 1 31 8  64 o 15 24.3067 7.17776 -4.8103     15.2912  23.087      16.1869  6.09339    40.2427     0.313709    220.243     
1 1 1 31 8  65 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 8  66 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 9  0  o 12 112.097 3.0016  224.496     16.8069  224.496     16.8069  106.671    1.64885e-06 44.8168     1.64885e-06 
1 1 1 31 9  1  o 15 85.8534 3.12201 129.997     14.1445  134.19      12.5493  60.988     123.503     0.0200726   123.497     
1 1 1 31 9  2  o 16 115.521 2.77065 248.679     16.6721  228.267     15.3686  110.895    257.146     55.9562     257.146     
1 1 1 31 9  3  o 5  27.4022 5.70039 17.6393     8.42968  9.90569     8.67624  11.0641    185.573     49.684      185.573     
1 1 1 31 9  4  o 7  20.2193 5.57853 4.49126     8.00563  4.97991     8.31993  18.8407    208.074     53.5697     208.074     
1 1 1 31 9  5  o 12 53.5421 3.67089 59.913      9.67368  44.4329     9.59385  7.57724    326.36      58.7876     146.36      
1 1 1 31 9  6  o 13 70.2173 3.2017  87.4995     10.9214  89.5902     11.4893  47.5763    68.9765     1.75941     248.976     
1 1 1 31 9  7  o 14 49.5429 3.95822 47.9768     9.29835  41.4551     9.89481  1.92479    218.931     72.332      218.931     
1 1 1 31 9  8  o 15 48.144  4.04397 29.9375     9.0551   56.6833     9.25211  28.4866    201.282     1.80151     201.282     
1 1 1 31 9  9  o 12 120.408 2.65486 262.267     15.2154  255.455     16.7256  114.49     288.797     54.6832     288.797     
1 1 1 31 9  10 o 16 99.4823 2.77421 183.862     13.9519  170.117     13.6495  59.2131    202.792     26.4721     22.7916     
1 1 1 31 9  11 o 9  171.967 2.82311 530.704     24.7243  525.451     23.9316  179.751    236.082     106.593     236.082     
1 1 1 31 9  12 o 2  29.0001 5.57757 20.9738     8.34278  10.3217     8.92954  0.520508   176.473     27.4764     356.473     
1 1 1 31 9  13 o 11 126.837 2.71381 299.222     17.6712  275.882     16.7918  107.026    107.433     28.2753     107.433     
1 1 1 31 9  14 o 3  68.1452 3.48037 86.0886     12.3795  81.4047     11.2276  36.0817    94.8048     24.6968     274.805     
1 1 1 31 9  15 o 8  122.314 3.01722 275.657     19.7953  260.368     17.1015  94.0222    227.535     8.57424     227.535     
1 1 1 31 9  16 o 18 55.1366 3.94259 55.0235     11.3328  55.5793     10.1035  19.9565    185.194     37.7351     5.19402     
1 1 1 31 9  17 o 16 62.9384 3.63377 71.8773     11.9035  71.4682     10.7912  59.9083    90.0807     37.2811     90.0807     
1 1 1 31 9  18 o 10 51.3858 4.07915 51.7536     10.8279  44.8458     9.82593  29.2706    13.998      12.6375     193.998     
1 1 1 31 9  19 o 12 142.525 2.83298 376.311     21.6457  351.114     18.7598  154.417    339.449     100.266     339.449     
1 1 1 31 9  20 o 5  14.2828 4.64891 -4.03004    7.83417  -7.20135    7.53888  5.92998    359.748     18.8412     359.748     
1 1 1 31 9  21 o 11 29.944  5.46158 14.629      8.33361  19.5623     8.26332  6.38315    106.286     52.6821     106.286     
1 1 1 31 9  22 o 14 64.0675 3.33286 74.5999     10.7465  73.7389     10.5049  57.8179    244.13      26.7809     244.13      
1 1 1 31 9  23 o 16 136.992 3.08853 355.62      21.1501  319.225     21.1543  120.425    350.261     40.1557     350.261     
1 1 1 31 9  24 o 13 59.3221 3.60293 65.7538     11.1975  62.1512     10.0088  36.8654    213.821     10.1253     33.8207     
1 1 1 31 9  25 o 4  63.3674 3.38352 81.7503     10.8203  64.239      10.4271  32.8968    225.258     24.7397     45.2585     
1 1 1 31 9  26 o 9  93.749  2.92926 171.461     14.4341  145.214     13.0316  90.6678    80.2922     46.9662     80.2922     
1 1 1 31 9  27 o 10 20.7803 5.36547 11.7543     7.96258  -1.47864    8.02606  2.55748    171.698     26.9485     171.698     
1 1 1 31 9  28 o 9  17.0567 5.21724 -0.319777   7.54288  -0.382149   8.80888  4.23461    214.643     21.9498     214.643     
1 1 1 31 9  29 o 7  19.1549 5.49182 -3.01573    8.6849   7.28943     8.56419  0.453724   326.726     11.3377     146.726     
1 1 1 31 9  30 o 15 67.4685 3.67745 93.1013     11.5927  73.542      12.7452  44.9679    147.713     5.83548     327.713     
1 1 1 31 9  31 o 7  104.694 2.91407 199.548     15.0536  195.529     15.4565  93.0864    141.373     35.5593     141.373     
1 1 1 31 9  32 o 2  36.6443 5.29704 27.939      9.10322  23.7866     9.67929  16.512     15.1685     15.265      195.169     
1 1 1 31 9  33 o 1  80.269  3.22294 120.795     12.5883  112.909     13.192   62.255     39.3945     10.23       39.3945     
1 1 1 31 9  34 o 3  73.0591 3.32017 92.2528     11.819   101.933     12.3625  54.8534    281.746     6.28432     281.746     
1 1 1 31 9  35 o 4  23.6339 5.72235 -0.969702   8.20026  18.3653     10.0686  0.624703   268.533     29.8661     268.533     
1 1 1 31 9  36 o 7  21.2142 5.63564 10.9854     8.30484  -0.105866   9.07956  3.92345    317.135     11.2703     137.135     
1 1 1 31 9  37 o 4  104.224 2.9861  196.886     15.3011  196.071     15.8215  74.7727    39.5134     0.431169    39.5139     
1 1 1 31 9  38 o 16 71.9434 3.34686 82.7876     11.4766  106.715     12.4779  41.3436    230.467     19.1602     50.4666     
1 1 1 31 9  39 o 7  33.2475 5.73154 24.8026     9.02962  18.8081     10.0339  20.292     88.284      0.639149    268.284     
1 1 1 31 9  40 o 13 47.5307 4.45242 39.372      9.95025  45.8836     10.7369  22.7028    28.0523     20.2631     208.052     
1 1 1 31 9  41 o 13 33.432  5.61775 14.2406     9.10431  30.8443     9.96975  15.4281    2.51324     13.0023     182.513     
1 1 1 31 9  42 o 19 20.2593 5.60634 9.20329     8.12311  -0.878777   9.4457   3.79761    195.027     0.321247    15.0266     
1 1 1 31 9  43 o 12 29.4437 6.02253 18.4114     8.84767  16.4249     10.0234  12.7542    93.3831     12.026      273.383     
1 1 1 31 9  44 o 13 24.6508 6.19212 15.5549     9.46655  4.93064     10.8449  11.1248    138.428     3.83514     138.428     
1 1 1 31 9  45 o 6  23.3781 6.15414 10.9889     9.31374  7.62294     10.1289  6.0563     51.0586     16.1121     231.059     
1 1 1 31 9  46 o 11 45.035  4.96644 38.396      10.5288  40.9993     11.1602  22.704     273.861     16.0115     93.8613     
1 1 1 31 9  47 o 18 15.8142 5.05616 -12.6832    8.49082  2.49406     9.3943   1.53484    99.7793     7.36785     279.779     
1 1 1 31 9  48 o 2  64.0936 3.84841 80.7191     11.4713  74.0642     12.8646  50.6594    70.3315     13.3453     70.3315     
1 1 1 31 9  49 o 1  39.217  5.55778 31.6272     9.8613   31.0254     11.198   31.9159    141.162     14.868      141.162     
1 1 1 31 9  50 o 1  23.7526 6.14528 5.67022     9.06557  15.1676     10.4334  3.29703    151.066     22.2154     331.066     
1 1 1 31 9  51 o 1  74.3427 3.59721 103.455     12.5731  103.771     14.0202  63.8655    335.598     26.3536     335.598     
1 1 1 31 9  52 o 1  39.85   5.72169 36.1582     10.2846  29.5703     11.7199  16.241     12.7365     19.9338     192.736     
1 1 1 31 9  53 o 4  46.7537 5.37436 48.7525     12.0399  39.9308     12.1678  23.0447    231.319     16.0978     51.3194     
1 1 1 31 9  54 o 19 23.5512 6.43596 12.0018     10.7762  7.22884     10.976   9.92228    122.56      1.27856     302.56      
1 1 1 31 9  55 o 12 71.2109 4.25308 89.5909     14.3139  105.475     15.7659  53.9243    342.692     11.4208     342.692     
1 1 1 31 9  56 o 18 41.6496 6.43299 36.4442     12.2431  38.0556     13.8554  34.0072    200.998     15.7829     200.998     
1 1 1 31 9  57 o 13 35.9229 6.91688 29.0504     12.0144  28.8704     13.6059  7.99314    56.6276     30.9327     236.628     
1 1 1 31 9  58 o 16 36.4926 7.71003 32.7046     14.3244  31.1076     16.1736  25.1213    146.572     5.63662     146.572     
1 1 1 31 9  59 o 6  50.9212 6.53873 39.6907     14.4227  77.4485     17.6745  37.6754    212.371     9.12755     212.371     
1 1 1 31 9  60 o 9  29.6143 7.84776 24.5948     15.5884  18.2414     16.1543  17.4166    188.596     5.22129     188.596     
1 1 1 31 9  61 o 19 21.618  6.8751  1.70152     15.3299  4.02873     15.8585  5.99448    126.919     3.41988     306.919     
1 1 1 31 9  62 o 18 24.6758 7.72769 15.2723     18.9072  3.89834     19.3838  7.79366    309.069     0.552121    129.069     
1 1 1 31 9  63 o 17 19.2019 6.46291 0.0910683   16.5228  -23.1077    18.9178  0.453157   99.1588     0.942719    279.159     
1 1 1 31 9  64 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 10 0  o 5  19.8963 7.35175 10.522      9.60414  10.522      9.60414  8.92213    180         34.7589     180         
1 1 1 31 10 1  o 11 68.7496 3.74839 85.8312     12.8891  85.1136     12.7405  14.4895    309.606     71.0476     129.606     
1 1 1 31 10 2  o 18 22.1477 5.95924 4.93466     9.92457  7.88262     8.52966  10.6143    41.5983     43.1889     41.5983     
1 1 1 31 10 3  o 6  110.311 2.99563 210.402     16.4416  225.692     16.6071  82.7181    81.6147     2.98467     81.6147     
1 1 1 31 10 4  o 5  14.3037 4.62031 -8.34646    7.72961  -2.25542    7.27903  3.00616    313.478     8.01106     313.478     
1 1 1 31 10 5  o 14 21.1227 5.54533 3.15498     8.40328  8.88323     7.63258  13.5626    284.178     49.0801     284.178     
1 1 1 31 10 6  o 17 16.8713 5.11529 1.24625     7.90478  -1.66825    7.62703  4.87746    269.699     15.9731     269.699     
1 1 1 31 10 7  o 6  30.1792 5.7119  14.2199     8.74431  20.3938     9.01662  6.20311    73.3574     51.0666     73.3574     
1 1 1 31 10 8  o 6  23.1908 5.71015 6.81637     8.49323  10.7937     7.97137  16.7362    22.5326     61.6169     22.5326     
1 1 1 31 10 9  o 4  86.8952 3.14776 136.54      14.6469  134.713     12.6081  64.0977    353.073     1.52127     353.073     
1 1 1 31 10 10 o 7  68.0471 3.49061 81.4124     12.3662  85.8241     11.205   39.2634    334.423     19.7052     154.423     
1 1 1 31 10 11 o 3  83.4489 3.25223 131.643     13.9492  119.048     13.1496  72.2392    86.6492     23.7296     86.6492     
1 1 1 31 10 12 o 14 45.2357 4.53454 37.3549     10.3138  38.2742     9.64361  33.8392    131.048     8.68699     131.048     
1 1 1 31 10 13 o 14 61.7157 3.7417  80.4723     11.3     58.5787     11.3562  52.0288    284.866     17.3622     284.866     
1 1 1 31 10 14 o 2  104.009 2.94892 212.206     14.5692  176.647     15.8565  101.787    31.3454     51.6161     31.3454     
1 1 1 31 10 15 o 4  92.0774 3.16406 150.031     13.5876  154.937     15.4874  65.6067    28.6767     3.85088     208.677     
1 1 1 31 10 16 o 1  131.858 2.76667 313.195     17.3323  309.619     19.1333  94.5846    292.815     6.16124     112.815     
1 1 1 31 10 17 o 2  59.9596 3.48575 70.4519     9.99853  60.0515     10.6366  56.4287    246.25      30.9015     246.25      
1 1 1 31 10 18 o 10 90.2339 3.00969 152.652     13.5744  140.249     13.5501  92.0236    54.6337     54.2591     54.6337     
1 1 1 31 10 19 o 8  32.6082 5.89204 19.9033     9.49412  21.1098     9.83368  16.6527    67.6078     4.97915     247.608     
1 1 1 31 10 20 o 11 82.7949 3.02439 135.147     12.3299  112.184     12.5703  76.9815    344.34      34.9074     344.34      
1 1 1 31 10 21 o 16 78.5413 3.0474  116.21      11.5793  106.209     12.2551  39.643     201.082     35.2235     21.0815     
1 1 1 31 10 22 o 15 60.7132 3.66868 69.5304     10.8205  64.7884     11.2547  61.9002    172.416     43.8276     172.416     
1 1 1 31 10 23 o 5  32.366  5.72257 28.1287     9.15087  12.0207     10.3138  14.392     209.338     11.4808     29.3376     
1 1 1 31 10 24 o 19 72.9326 3.35376 102.172     11.123   90.7834     13.0158  43.0136    40.2582     19.3902     220.258     
1 1 1 31 10 25 o 18 72.8136 3.13177 95.8299     10.8059  95.9168     11.9118  52.2516    67.4149     0.151264    247.415     
1 1 1 31 10 26 o 15 96.7229 2.86405 163.629     13.0253  173.404     14.6669  80.5976    193.792     20.882      193.792     
1 1 1 31 10 27 o 10 16.2834 5.11406 -4.66191    8.41649  -0.407993   8.3922   1.09043    7.83256     8.5137      7.83256     
1 1 1 31 10 28 o 17 99.9714 2.8098  175.059     14.5852  184.982     13.446   69.0725    76.2072     7.20801     256.207     
1 1 1 31 10 29 o 8  90.8347 2.87642 149.36      13.1088  148.277     13.0123  65.1322    272.489     1.16553     92.4891     
1 1 1 31 10 30 o 6  108.06  2.98938 205.938     15.9387  215.876     16.3763  103.124    11.368      50.2456     11.368      
1 1 1 31 10 31 o 14 71.9238 3.26963 92.7456     11.3724  95.291      12.0696  71.9693    41.2997     43.566      41.2997     
1 1 1 31 10 32 f 0  70.4161 3.38181 95.3847     11.9505  85.3914     11.756   48.2767    205.975     0           0           
1 1 1 31 10 33 o 5  71.4112 3.30015 86.3512     11.4323  99.4844     12.0487  46.5175    273.536     8.85439     93.5357     
1 1 1 31 10 34 o 15 27.9373 6.09182 12.0471     8.49189  18.434      10.3397  7.31146    28.8432     20.3639     208.843     
1 1 1 31 10 35 o 14 77.2124 3.22364 107.248     12.1803  109.66      12.6553  43.2848    210.052     23.951      30.052      
1 1 1 31 10 36 o 2  80.4058 3.28275 118.447     12.4501  117.118     13.8413  50.3291    103.796     14.3147     283.796     
1 1 1 31 10 37 o 12 20.2413 5.67905 2.30646     8.08807  7.53362     9.2065   4.88771    119.97      7.89484     299.97      
1 1 1 31 10 38 o 5  89.6806 3.07938 153.839     13.4911  138.86      14.0389  66.3168    50.6179     4.54967     50.6179     
1 1 1 31 10 39 o 1  52.074  4.43442 48.6952     11.4747  53.7566     11.1484  27.0567    206.63      18.8362     26.6301     
1 1 1 31 10 40 o 13 46.3539 4.69394 34.254      10.0904  48.5627     10.9569  41.1183    174.197     20.4726     174.197     
1 1 1 31 10 41 o 4  19.0202 5.54613 6.38629     8.29762  -1.80167    9.46739  0.379882   251.081     21.1915     71.0809     
1 1 1 31 10 42 o 1  37.8852 5.58777 27.7336     9.70539  29.8588     10.8255  18.9601    68.1602     13.2398     248.16      
1 1 1 31 10 43 o 15 23.6527 6.14695 11.2575     9.35205  8.55983     9.8717   11.4422    211.748     2.38128     31.7478     
1 1 1 31 10 44 o 11 67.7694 3.89476 79.9405     12.4709  92.8005     13.7658  54.7693    139.713     15.0427     139.713     
1 1 1 31 10 45 o 3  54.5285 4.38003 51.2724     11.4187  63.067      12.0377  40.8005    110.335     6.67451     110.335     
1 1 1 31 10 46 o 11 23.9473 5.7618  -1.39442    9.04713  20.2917     10.0214  12.0041    338.511     1.51689     338.511     
1 1 1 31 10 47 o 11 55.4542 4.60702 66.1625     12.1668  53.5206     12.6994  43.7793    221.919     12.0226     221.919     
1 1 1 31 10 48 o 12 49.2755 5.27484 39.0919     12.6477  58.8486     11.9085  39.8371    242.979     14.1019     242.979     
1 1 1 31 10 49 o 17 19.5723 5.86158 1.83552     9.55004  4.48927     10.3419  4.66789    345.87      6.98204     165.87      
1 1 1 31 10 50 o 19 22.5922 6.38681 4.27113     11.5558  10.7661     10.712   7.71771    144.747     1.59629     324.747     
1 1 1 31 10 51 o 2  45.8495 5.58262 44.0175     12.4603  42.1279     12.2682  32.0188    107.598     3.8546      107.598     
1 1 1 31 10 52 o 14 35.2266 6.79036 32.2526     12.1277  22.5358     12.932   23.3961    301.172     3.49668     301.172     
1 1 1 31 10 53 o 12 18.8412 5.92446 -3.55888    10.8696  2.19302     11.6771  4.53882    135.013     3.09292     315.013     
1 1 1 31 10 54 o 16 17.1733 5.62437 -17.2454    12.4846  0.0863219   11.4924  3.65987    154.256     4.96759     334.256     
1 1 1 31 10 55 o 6  35.3327 7.0625  33.9631     12.8728  22.5495     13.907   16.5033    155.02      12.5735     335.02      
1 1 1 31 10 56 o 17 34.8812 6.9613  20.0628     12.6273  35.9509     13.4706  19.1064    323.304     6.06804     143.304     
1 1 1 31 10 57 o 13 56.7858 5.63617 65.495      15.5942  69.3006     15.5868  43.4465    281.591     11.4451     281.591     
1 1 1 31 10 58 o 4  21.1669 6.50422 -2.50194    12.6043  9.74917     13.5446  7.06633    57.1679     2.19738     237.168     
1 1 1 31 10 59 o 3  20.8555 6.765   -2.4508     18.0891  1.14636     14.1885  2.37563    40.9626     0.418012    220.963     
1 1 1 31 10 60 o 19 35.6641 8.92568 42.1369     19.6704  34.0175     20.6537  23.1463    335.62      7.07005     335.62      
1 1 1 31 10 61 o 8  22.2213 7.29915 -4.73031    19.1986  6.22516     20.0073  3.03526    83.1958     1.15924     263.196     
1 1 1 31 10 62 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 11 0  o 13 61.9115 3.42322 69.6439     10.4675  69.6439     10.4675  58.6922    360         24.0124     360         
1 1 1 31 11 1  o 6  68.18   3.29488 85.2626     11.0071  82.4958     11.3613  48.6355    65.7008     1.73868     245.701     
1 1 1 31 11 2  o 10 83.7489 3.17957 125.653     13.8695  126.797     12.6872  54.636     314.667     14.2835     134.667     
1 1 1 31 11 3  o 16 97.871  2.99389 179.671     14.3895  164.45      14.8607  83.4773    291.492     22.458      291.492     
1 1 1 31 11 4  o 1  108.361 2.96405 216.954     15.6719  204.555     16.4163  109.359    128.463     59.091      128.463     
1 1 1 31 11 5  o 5  45.0204 4.79292 30.2845     10.0528  45.9524     10.666   20.3432    313.191     22.4414     133.191     
1 1 1 31 11 6  o 18 59.3806 3.83386 63.0118     11.5614  65.3568     10.9794  29.1778    151.704     27.738      331.704     
1 1 1 31 11 7  o 8  76.9547 3.48028 109.018     13.1264  105.061     13.5598  51.3402    50.7019     10.1717     230.702     
1 1 1 31 11 8  o 16 65.289  3.80592 68.3076     12.1098  87.2366     12.4584  63.4746    78.9423     35.6464     78.9423     
1 1 1 31 11 9  o 8  37.4194 5.15406 30.5179     9.31645  22.7077     9.29029  16.0885    267.033     18.1172     87.0332     
1 1 1 31 11 10 o 16 77.6326 3.33237 107.182     12.1901  110.453     13.5947  71.0953    284.679     29.9404     284.679     
1 1 1 31 11 11 o 17 87.974  3.00431 143.2       12.8269  135.233     13.5441  88.8817    87.4286     50.2516     87.4286     
1 1 1 31 11 12 o 16 40.7704 4.68879 36.1073     8.95391  26.3923     9.33603  27.3114    180.424     1.04095     180.424     
1 1 1 31 11 13 o 15 44.4711 4.19437 36.0149     9.11744  37.0364     9.11024  20.5238    179.016     21.194      359.016     
1 1 1 31 11 14 o 17 46.5035 3.86326 40.4723     8.74571  38.8781     8.90879  17.5989    149.361     30.7708     329.361     
1 1 1 31 11 15 o 3  22.8954 5.54549 11.9849     7.95219  5.79137     7.68708  0.722757   125.483     0.519102    305.483     
1 1 1 31 11 16 o 5  60.1277 3.35914 65.1943     9.83448  65.9532     10.2426  45.8904    89.2003     6.17655     89.2003     
1 1 1 31 11 17 o 17 49.4847 3.75899 47.1188     9.25298  42.6259     9.08575  45.8148    358.528     28.6123     358.528     
1 1 1 31 11 18 o 10 101.814 2.80185 187.297     14.1417  185.344     14.3927  79.4773    212.293     9.10158     212.293     
1 1 1 31 11 19 o 10 41.7949 4.30736 33.5023     8.73172  31.5549     8.77277  27.243     73.3149     1.72522     253.315     
1 1 1 31 11 20 o 3  30.0925 5.34816 21.1796     8.19378  13.8444     8.09548  3.49875    166.857     47.7833     166.857     
1 1 1 31 11 21 o 17 55.6395 3.67352 59.3891     10.1258  53.9315     10.1028  25.2928    36.7703     29.3232     216.77      
1 1 1 31 11 22 o 11 34.9818 5.1947  33.8268     8.66802  14.1534     9.20826  22.8621    288.946     3.31118     288.946     
1 1 1 31 11 23 o 2  21.537  5.57735 5.62947     8.18583  8.79161     7.67711  1.18936    336.775     26.7912     336.775     
1 1 1 31 11 24 o 18 25.9243 5.52541 8.89147     7.87005  16.4706     8.05151  9.34339    273.077     9.59413     93.0772     
1 1 1 31 11 25 o 10 27.613  5.58167 10.0919     8.54959  19.0061     8.19518  12.0559    295.349     6.9737      115.349     
1 1 1 31 11 26 o 16 46.4424 4.14397 39.928      9.55847  40.2418     9.29836  13.6602    337.417     38.5352     157.417     
1 1 1 31 11 27 o 8  20.3817 5.47206 -2.07328    8.51408  10.7322     8.24548  1.0055     264.581     24.3482     264.581     
1 1 1 31 11 28 o 10 17.4498 5.23404 3.06981     7.57636  -2.0898     8.60755  2.21762    354.279     20.085      354.279     
1 1 1 31 11 29 o 13 47.3909 4.5602  53.29       9.53174  32.2517     10.598   7.24425    147.278     52.9601     327.278     
1 1 1 31 11 30 o 2  36.6175 5.18165 26.6973     8.94381  25.0966     9.40134  12.3188    241.361     25.301      61.3611     
1 1 1 31 11 31 f 0  45.3066 4.34109 38.9025     9.29415  38.0773     9.88915  26.6225    216.42      0           0           
1 1 1 31 11 32 o 11 37.7751 5.29518 30.5495     9.62119  24.9381     9.70496  20.1424    270.777     10.5113     90.777      
1 1 1 31 11 33 o 15 51.8029 4.3832  51.346      9.83467  49.2478     12.213   41.098     126.058     10.5136     126.058     
1 1 1 31 11 34 o 14 58.3319 3.96628 60.991      10.6716  65.2865     12.2159  31.1776    255.772     20.6356     75.7719     
1 1 1 31 11 35 o 17 58.98   4.02424 73.4493     10.637   56.4272     12.3026  45.9422    25.5641     8.83414     25.5641     
1 1 1 31 11 36 o 18 50.8609 4.44731 50.5899     10.0871  47.1993     11.8889  36.4818    351.597     1.9858      351.597     
1 1 1 31 11 37 o 3  20.8161 6.02495 4.27583     8.29293  5.1032      11.6667  0.531805   82.8456     24.3555     262.846     
1 1 1 31 11 38 o 6  71.5966 3.64691 94.5672     12.1778  95.2116     13.7627  51.0995    243.563     0.261924    243.564     
1 1 1 31 11 39 o 4  31.7471 6.01512 25.0328     9.09118  15.6984     11.0815  6.40841    354.773     30.1934     174.773     
1 1 1 31 11 40 o 17 33.948  6.00961 26.7336     9.32266  20.4551     11.3418  14.546     232.076     16.5503     52.0757     
1 1 1 31 11 41 f 0  29.4982 6.09901 9.68871     8.92087  26.8052     11.149   19.131     296.49      0           0           
1 1 1 31 11 42 o 19 63.708  3.96609 74.9352     11.3967  78.2306     13.591   46.6459    1.21646     3.85537     1.21646     
1 1 1 31 11 43 o 3  34.374  6.21045 29.4786     9.95232  20.0634     12.0336  19.1813    343.246     6.80912     163.246     
1 1 1 31 11 44 o 2  58.9939 4.34299 73.8129     11.2312  60.0853     13.4582  51.9637    232.362     22.8006     232.362     
1 1 1 31 11 45 o 17 43.4847 5.40324 41.1834     10.5184  35.319      11.9838  34.0991    308.962     28.7502     308.962     
1 1 1 31 11 46 o 4  21.1324 6.00175 4.66338     8.99877  8.1721      10.4145  7.3126     9.24653     3.45798     189.247     
1 1 1 31 11 47 o 18 29.9475 6.42308 24.6909     10.643   13.5199     11.073   15.7251    192.543     5.12968     12.5429     
1 1 1 31 11 48 o 10 51.9615 5.4857  57.6991     12.5648  51.9794     14.7775  39.5616    77.4047     9.34914     77.4047     
1 1 1 31 11 49 o 17 21.7717 6.0462  -8.16398    10.4581  16.7099     11.5007  4.07503    29.7668     0.0681951   29.7668     
1 1 1 31 11 50 o 2  21.7866 6.36911 12.3375     11.9918  -3.44478    11.9011  6.01352    346.623     0.185794    346.623     
1 1 1 31 11 51 o 13 20.6408 6.32491 0.280367    12.1739  4.6686      12.081   6.49001    349.335     7.6736      169.335     
1 1 1 31 11 52 o 18 53.7891 5.61431 62.7855     14.5633  55.7496     14.7245  39.0136    74.6816     5.30021     74.6816     
1 1 1 31 11 53 o 6  20.3374 6.29023 -0.286379   11.9067  4.18302     12.5064  7.24453    314.717     5.20324     134.717     
1 1 1 31 11 54 o 8  21.6931 6.43002 8.78618     11.3919  2.25536     12.5225  8.15913    232.047     6.73853     52.0471     
1 1 1 31 11 55 o 18 24.2499 6.88059 9.4197      12.1566  12.4063     13.3273  10.0696    132.607     7.50968     312.607     
1 1 1 31 11 56 o 16 19.0171 6.10169 -18.9889    13.126   8.07876     13.7306  2.31971    309.46      0.626179    129.46      
1 1 1 31 11 57 o 10 17.4193 5.8138  -13.7427    13.2081  -2.72948    13.5148  1.16208    70.3651     1.70635     250.365     
1 1 1 31 11 58 f 0  24.2031 7.51109 4.23639     20.2983  12.9343     15.7238  9.92218    110.084     0           0           
1 1 1 31 11 59 o 11 23.5783 7.90702 19.571      31.2045  -4.31078    15.3211  4.59707    31.0797     0.515656    211.08      
1 1 1 31 11 60 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 11 61 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 12 0  o 17 52.5004 4.06603 51.1575     10.3717  51.1575     10.3717  40.1978    180         1.06259     180         
1 1 1 31 12 1  o 14 70.5419 3.42122 90.6233     11.8896  89.7075     12.1496  41.886     103.489     19.9677     283.489     
1 1 1 31 12 2  o 4  98.0268 3.06233 173.841     15.1753  172.282     14.8373  73.6494    286.415     1.5861      286.415     
1 1 1 31 12 3  o 11 36.9554 5.25118 19.2645     9.31648  33.4921     9.4558   25.9598    293.738     7.84171     293.738     
1 1 1 31 12 4  o 17 14.2611 4.61505 -9.99748    6.9762   -0.898665   8.0608   10.6554    233.268     33.3495     233.268     
1 1 1 31 12 5  o 10 88.6389 2.93364 137.782     13.1088  145.054     12.867   64.7962    125.915     1.67344     305.915     
1 1 1 31 12 6  o 8  34.8827 5.07817 23.8894     8.43227  22.4835     8.72763  23.1998    222.264     8.01314     222.264     
1 1 1 31 12 7  o 17 112.258 2.82808 230.746     15.4289  222.152     16.3054  83.6122    234.963     0.177769    54.9629     
1 1 1 31 12 8  o 14 27.2232 5.71235 12.9991     8.18886  15.1985     8.53947  11.1898    60.2752     3.8997      240.275     
1 1 1 31 12 9  o 12 67.6443 3.31077 76.5028     10.765   89.5744     11.5372  63.3668    168.941     29.9418     168.941     
1 1 1 31 12 10 o 18 49.8272 3.95461 46.8578     9.29743  44.4651     10.0587  46.1009    75.0305     26.6133     75.0305     
1 1 1 31 12 11 o 4  18.9885 5.3831  7.49745     8.03067  -2.97571    8.50344  1.01319    312.567     18.2904     312.567     
1 1 1 31 12 12 o 14 44.7345 4.49733 39.9897     9.59226  34.7724     9.92595  28.2249    2.56069     5.6212      182.561     
1 1 1 31 12 13 o 1  62.5889 3.58375 77.1152     11.4914  65.9162     10.7883  53.5517    35.8832     17.6649     35.8832     
1 1 1 31 12 14 o 11 20.1283 5.2231  -5.71045    8.17004  12.2972     7.97659  0.609724   9.00618     17.5802     189.006     
1 1 1 31 12 15 o 9  24.2062 5.88045 10.947      8.9868   9.81446     8.24846  7.0145     319.618     45.4672     319.618     
1 1 1 31 12 16 o 9  39.054  4.94852 29.2103     9.42624  28.774      9.23239  23.2619    76.5739     6.08747     256.574     
1 1 1 31 12 17 o 19 71.4299 3.50978 85.7957     12.4963  100.323     12.4011  50.1313    249.727     3.90253     69.727      
1 1 1 31 12 18 o 2  84.1668 3.09081 134.166     12.3848  122.253     13.4943  70.9241    310.644     18.7287     310.644     
1 1 1 31 12 19 f 0  87.3122 2.91061 136.197     12.3251  139.002     13.0695  57.4984    166.809     0           0           
1 1 1 31 12 20 o 16 75.8258 3.201   109.524     12.0002  99.185      12.1809  46.9659    183.763     17.0793     3.76258     
1 1 1 31 12 21 o 10 23.8018 5.68512 11.7932     7.99816  8.50084     8.21467  5.82219    35.7043     42.4911     35.7043     
1 1 1 31 12 22 o 7  45.8724 4.36822 39.3054     9.29001  39.4006     10.2518  37.0698    193.64      11.967      193.64      
1 1 1 31 12 23 o 3  47.1114 4.16446 47.7678     9.29995  35.2896     9.63963  33.0368    249.928     0.536714    249.928     
1 1 1 31 12 24 o 1  41.9184 4.65462 35.112      9.60988  31.4056     9.29537  33.8635    88.3308     12.7946     88.3308     
1 1 1 31 12 25 o 9  16.6466 5.11515 0.221271    7.67394  -1.3109     8.23976  0.220529   334.597     9.59107     334.597     
1 1 1 31 12 26 o 18 30.7358 5.6987  19.7248     8.90225  17.4257     8.88539  7.11775    133.955     26.785      313.955     
1 1 1 31 12 27 o 4  26.4451 5.74748 14.3279     8.23326  12.581      8.50719  9.46317    292.033     12.9558     112.033     
1 1 1 31 12 28 o 16 35.8795 5.34997 30.79       9.61019  19.8291     9.08753  23.3303    143.651     0.096393    323.651     
1 1 1 31 12 29 o 13 39.9594 4.95226 35.8775     9.17628  25.7522     9.73003  26.206     46.2006     1.74807     226.201     
1 1 1 31 12 30 o 10 16.9526 5.16432 -2.26825    7.82624  2.23639     8.2136   3.17803    314.693     24.2288     314.693     
1 1 1 31 12 31 o 3  28.8024 5.69256 20.9679     8.86003  11.8045     8.60441  9.35031    1.23232     19.1354     181.232     
1 1 1 31 12 32 o 11 80.4352 3.09679 122.619     12.2069  113.201     12.6258  71.7693    41.6372     27.7188     41.6372     
1 1 1 31 12 33 o 15 14.6057 4.71965 -6.59756    7.84339  -2.31274    7.69512  1.97649    113.359     17.0092     113.359     
1 1 1 31 12 34 o 10 20.8192 5.09117 15.7658     8.19124  -9.21899    8.36987  7.00899    132.272     8.7568      312.272     
1 1 1 31 12 35 o 2  40.7199 4.93921 38.0398     9.77994  26.882      9.52595  22.6068    278.095     11.2686     98.0952     
1 1 1 31 12 36 o 11 54.2008 4.13648 53.7634     10.5355  57.1779     11.577   46.0365    196.464     16.233      196.464     
1 1 1 31 12 37 o 16 59.3915 3.92201 58.6052     10.9692  74.3315     12.0825  46.4261    18.943      8.85393     18.9429     
1 1 1 31 12 38 o 5  59.1736 4.2173  65.9913     10.8209  66.9887     13.6394  54.0203    36.1016     25.2657     36.1016     
1 1 1 31 12 39 o 2  63.5475 3.83489 81.1318     11.4699  70.7991     12.5434  66.2549    236.067     44.5891     236.067     
1 1 1 31 12 40 o 18 16.9179 5.31344 -0.220815   8.36192  -2.38892    9.70952  3.10431    77.3234     6.08139     257.323     
1 1 1 31 12 41 o 3  91.7472 3.23012 164.088     14.3295  147.611     15.1788  78.8803    184.779     27.0899     184.779     
1 1 1 31 12 42 o 14 17.7026 5.45563 4.30052     8.75162  -6.79452    10.3644  2.76512    124.998     2.12696     304.997     
1 1 1 31 12 43 o 11 63.4674 4.1367  85.4423     12.7616  68.979      13.0612  46.2619    87.8809     3.62887     87.8809     
1 1 1 31 12 44 o 7  31.6904 6.69416 22.9875     10.7447  20.8195     12.2835  21.9381    174.063     7.25424     174.063     
1 1 1 31 12 45 o 4  24.0173 6.61864 10.0999     10.5116  10.3935     12.4831  1.70478    177.41      0.592131    177.41      
1 1 1 31 12 46 o 9  42.0922 6.5021  49.2295     12.5151  28.0463     14.4997  36.7436    322.191     24.6378     322.191     
1 1 1 31 12 47 o 10 18.226  5.88055 -12.1953    11.5244  2.72578     12.7524  3.0811     354.934     7.36843     174.934     
1 1 1 31 12 48 o 15 30.4879 7.13382 20.9865     11.4852  20.3882     14.0665  20.33      274.522     7.73491     274.522     
1 1 1 31 12 49 o 12 62.7402 4.97136 82.0204     13.7293  74.1349     16.5075  55.4636    147.289     25.1811     147.289     
1 1 1 31 12 50 o 4  53.5463 5.61779 59.9834     13.2043  57.6368     15.7534  48.6916    208.893     25.6798     208.893     
1 1 1 31 12 51 o 11 53.0623 5.63776 49.2527     13.2805  67.9219     15.7935  43.5604    336.639     15.6266     336.639     
1 1 1 31 12 52 o 14 27.6562 7.41339 15.0089     13.8374  18.4739     14.4458  14.3373    178.41      4.37962     358.41      
1 1 1 31 12 53 o 6  22.7538 6.98489 6.3298      13.3404  5.20774     16.3104  9.432      10.1158     1.92749     10.1158     
1 1 1 31 12 54 o 4  19.3959 6.27112 6.63464     13.8314  -21.5742    15.7971  5.35762    13.4596     6.33551     193.46      
1 1 1 31 12 55 o 18 33.0616 6.80565 50.8959     15.7945  -8.68307    17.7458  17.9268    155.448     5.16029     335.448     
1 1 1 31 12 56 o 1  20.4453 6.63694 12.1632     16.798   -23.1348    16.1593  3.33244    261.443     1.50917     81.4428     
1 1 1 31 12 57 o 15 32.9277 9.28254 34.3401     28.2691  37.327      20.1075  18.2241    316.163     0.312713    136.163     
1 1 1 31 12 58 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 12 59 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 13 0  o 2  95.1323 3.06718 162.739     14.5533  162.739     14.5533  98.4548    360         52.8406     360         
1 1 1 31 13 1  o 17 133.86  2.80055 321.49      18.5467  323.282     18.9843  148.548    194.373     97.5104     194.373     
1 1 1 31 13 2  o 18 80.7216 3.2501  111.936     12.5874  124.393     13.6058  59.6765    136.931     0.179932    316.931     
1 1 1 31 13 3  o 14 60.8017 3.53768 61.3634     10.4974  73.8192     10.8219  65.4888    68.8915     52.2463     68.8915     
1 1 1 31 13 4  o 8  18.0179 5.31061 -0.42948    7.52841  4.01612     8.4821   21.4056    55.1521     65.8732     55.1521     
1 1 1 31 13 5  o 1  93.7539 2.92503 165.731     13.0537  151.503     14.256   66.9707    336.728     5.76419     156.728     
1 1 1 31 13 6  o 1  13.7691 4.51375 -9.98523    7.26853  -2.79763    7.73951  8.49835    208.033     27.9362     208.033     
1 1 1 31 13 7  o 10 38.8353 4.82872 25.1955     8.68019  32.2525     9.4213   30.4105    202.178     12.2497     202.178     
1 1 1 31 13 8  o 13 22.4354 5.83133 6.80755     7.80545  9.36112     9.4052   5.91268    11.1589     40.2493     11.1589     
1 1 1 31 13 9  o 13 73.4669 3.14897 99.9615     11.2681  95.6764     11.7866  64.2312    311.394     21.0892     311.394     
1 1 1 31 13 10 o 14 23.5157 5.4554  16.1094     8.0715   1.38765     8.50448  4.58327    280.591     17.5796     100.591     
1 1 1 31 13 11 f 0  50.8226 3.7865  55.7399     9.4164   39.9532     9.3411   27.3835    329.262     0           0           
1 1 1 31 13 12 o 1  15.388  4.91988 -2.07231    7.344    -5.71054    8.9709   2.57053    329.68      14.3118     329.68      
1 1 1 31 13 13 o 9  15.1391 4.82085 -2.7482     7.38128  -3.64136    8.01378  6.0545     31.1735     25.0694     31.1735     
1 1 1 31 13 14 o 18 47.9326 4.19052 37.5049     9.54924  48.2848     10.0708  38.2406    225.266     9.83982     225.266     
1 1 1 31 13 15 o 10 69.0714 3.44586 80.7307     11.511   93.5082     12.1814  36.2795    284.263     29.1314     104.263     
1 1 1 31 13 16 o 11 26.7055 6.0086  11.7287     9.21995  15.3003     8.98588  10.8521    156.965     9.17621     336.965     
1 1 1 31 13 17 o 13 19.8399 5.46095 10.0631     8.38038  -4.05268    8.77924  2.12107    346.838     3.12831     166.838     
1 1 1 31 13 18 o 18 50.1503 4.02766 47.8397     10.3543  45.4544     9.52996  33.6866    126.252     3.97054     306.253     
1 1 1 31 13 19 o 18 58.4835 3.72863 62.4605     11.0677  63.315      10.5409  44.7481    25.5958     5.46696     25.5958     
1 1 1 31 13 20 o 6  55.4052 3.91879 48.0145     10.908   66.0825     10.1214  40.1861    88.7536     1.03433     88.7536     
1 1 1 31 13 21 o 14 95.2575 3.00288 172.459     14.8197  156.359     13.7845  68.0463    49.9523     4.56326     229.952     
1 1 1 31 13 22 o 6  73.0294 3.45033 100.608     12.2794  94.3253     12.7945  56.8215    315.973     7.23916     315.973     
1 1 1 31 13 23 o 13 98.0866 2.97975 169.357     13.9848  179.285     15.24    99.1455    358.857     54.8543     358.857     
1 1 1 31 13 24 o 17 36.4775 5.40973 24.8897     9.7829   27.113      9.36006  27.1721    62.162      7.58735     62.162      
1 1 1 31 13 25 o 9  21.5839 5.75964 9.0091      8.65301  5.04304     8.48487  6.22697    353.96      9.08291     173.96      
1 1 1 31 13 26 o 9  58.1803 4.01989 70.065      10.702   56.0521     12.0552  60.1744    70.4919     39.9999     70.4919     
1 1 1 31 13 27 o 4  53.6788 4.02642 48.559      10.6864  59.0474     10.521   43.2371    334.707     10.3409     334.707     
1 1 1 31 13 28 o 15 70.5164 3.33138 96.2222     11.4943  86.0514     11.858   41.6652    318.936     19.4317     138.936     
1 1 1 31 13 29 o 5  27.2717 5.97756 7.65326     9.8346   20.5654     9.34695  16.4619    295.083     1.12004     295.083     
1 1 1 31 13 30 o 18 18.7277 5.4973  5.62899     8.41097  -1.30087    8.98392  3.91767    235.377     11.5788     55.3769     
1 1 1 31 13 31 o 10 66.5092 3.55395 76.2946     11.7066  87.4627     11.7647  46.2613    182.952     3.64867     2.9524      
1 1 1 31 13 32 o 18 56.9684 3.85569 67.5058     10.7084  54.1808     10.8845  51.2052    229.795     21.7973     229.795     
1 1 1 31 13 33 f 0  39.5861 5.16385 27.6089     9.70124  34.45       10.0104  43.4504    233.495     0           0           
1 1 1 31 13 34 o 19 44.6244 5.21036 50.6823     10.1273  29.0367     11.4498  38.7785    74.7135     16.6198     74.7135     
1 1 1 31 13 35 o 18 31.725  5.84141 19.9583     9.29883  21.5616     9.4614   24.4889    108.538     15.2624     108.538     
1 1 1 31 13 36 f 0  50.4841 4.28592 50.9011     10.5398  46.7683     10.6827  27.1818    316.764     0           0           
1 1 1 31 13 37 o 5  35.0597 5.78606 24.6274     10.0624  26.2354     9.9029   16.0917    94.5608     15.7073     274.561     
1 1 1 31 13 38 o 1  88.9083 3.25343 147.259     13.644   145.64      15.1884  82.0794    176.312     36.7385     176.312     
1 1 1 31 13 39 o 17 32.8671 6.34527 28.9259     10.8965  17.4254     11.1318  25.1988    26.5608     15.3841     26.5608     
1 1 1 31 13 40 o 13 18.2208 5.60534 -13.9473    9.66775  8.64738     11.0933  4.0298     250.469     3.44085     70.4691     
1 1 1 31 13 41 o 18 25.4124 6.75066 14.2674     11.2179  10.4071     12.2983  9.65476    5.81641     11.5088     185.816     
1 1 1 31 13 42 o 19 17.2022 5.54838 -4.21854    9.91562  -2.65526    11.2213  2.19128    205.955     4.48069     25.955      
1 1 1 31 13 43 o 9  52.0999 5.27145 52.4593     12.4237  57.268      14.3005  41.1397    324.438     11.0691     324.438     
1 1 1 31 13 44 f 0  22.6042 6.50141 6.57176     10.6659  9.0248      12.4136  13.7828    115.573     0           0           
1 1 1 31 13 45 o 14 34.141  6.9778  18.1783     11.4992  35.2242     14.2174  25.4781    198.467     10.9921     198.467     
1 1 1 31 13 46 o 3  35.0061 6.98146 28.9746     12.1708  26.1284     13.5049  23.7904    14.9257     3.07043     14.9257     
1 1 1 31 13 47 o 11 26.8532 7.0634  16.6353     12.0424  12.7554     13.6128  5.56862    257.292     23.5124     77.2922     
1 1 1 31 13 48 o 4  24.9681 7.03394 18.4624     14.1279  1.90585     13.4905  13.4527    54.4922     0.840953    234.492     
1 1 1 31 13 49 o 15 39.7561 7.37585 33.4997     13.3999  40.3407     16.3703  26.8211    63.2596     1.27268     63.2596     
1 1 1 31 13 50 o 17 28.2621 7.36498 11.0345     12.8345  25.1804     15.1343  15.2855    215.912     3.76352     35.9119     
1 1 1 31 13 51 o 7  44.57   7.10886 52.9306     14.8422  39.6383     16.3535  34.4533    250.502     10.1783     250.502     
1 1 1 31 13 52 o 11 29.3794 7.80703 18.4673     16.1126  24.105      15.336   18.062     326.249     8.3504      326.249     
1 1 1 31 13 53 o 7  24.8611 7.23185 22.5855     15.8142  -0.472906   14.9356  11.2569    289.112     1.50837     289.112     
1 1 1 31 13 54 o 3  23.2974 7.22354 2.72135     17.8704  12.2409     15.2101  8.32187    358.152     5.47545     178.152     
1 1 1 31 13 55 o 18 19.7054 6.51679 -5.55861    17.2641  -1.06228    14.9299  2.69461    84.3942     2.95474     264.394     
1 1 1 31 13 56 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 13 57 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 14 0  o 8  30.6382 6.37306 20.9533     8.50309  20.9533     8.50309  21.7166    360         9.89788     360         
1 1 1 31 14 1  o 11 77.3835 2.98087 111.482     11.4712  105.35      11.551   89.0738    33.4611     67.6965     33.4611     
1 1 1 31 14 2  o 12 41.1967 4.56238 33.5614     9.25873  30.5485     8.95844  31.2347    262.775     6.44053     262.775     
1 1 1 31 14 3  o 10 41.3226 4.8062  28.5656     9.77795  36.5036     9.27258  5.83099    323.135     48.1399     143.135     
1 1 1 31 14 4  o 19 33      5.29391 13.0405     8.96792  29.8144     8.64575  13.2267    82.4334     18.4027     262.433     
1 1 1 31 14 5  o 5  69.4802 3.28893 83.766      11.4336  92.0762     11.3096  68.2948    314.942     35.7642     314.942     
1 1 1 31 14 6  o 16 63.7205 3.51631 63.3599     11.0754  85.9853     10.955   58.1732    43.7349     24.0926     43.7349     
1 1 1 31 14 7  o 2  27.7252 5.37621 5.65913     8.61145  23.1783     8.39449  10.7616    325.594     13.3585     145.594     
1 1 1 31 14 8  o 15 43.2103 4.52708 37.4209     9.74826  33.023      9.26121  20.3583    344.663     21.0599     164.663     
1 1 1 31 14 9  o 14 19.8452 5.0573  12.9        7.70195  -7.54725    8.01993  3.09465    146.335     11.2905     326.335     
1 1 1 31 14 10 o 18 35.315  5.37243 22.5513     8.6913   26.0584     9.7703   4.50674    122.695     40.9972     302.695     
1 1 1 31 14 11 o 6  20.713  5.52987 -0.800036   7.88257  11.5212     8.83028  4.52315    356.316     7.51961     176.316     
1 1 1 31 14 12 f 0  54.468  3.85839 55.156      10.2959  54.417      10.4814  38.0724    22.3387     0           0           
1 1 1 31 14 13 o 5  56.1683 3.70857 55.3965     9.97052  60.8035     10.67    48.778     53.5521     17.2414     53.5521     
1 1 1 31 14 14 o 14 56.0612 3.86785 50.8564     10.0526  65.7221     11.3966  24.4572    2.76828     33.2718     182.768     
1 1 1 31 14 15 o 12 30.0162 6.05331 19.5791     9.24512  15.92       9.97714  18.5053    87.5928     4.59155     87.5928     
1 1 1 31 14 16 f 0  57.3848 4.02832 62.5319     10.8114  59.5946     11.9702  31.9774    111.31      0           0           
1 1 1 31 14 17 o 7  37.2391 5.45542 41.4864     9.08996  13.8306     11.0248  23.1092    99.6049     4.3908      279.605     
1 1 1 31 14 18 o 14 21.4108 5.97927 5.71924     8.64539  6.11494     10.3057  5.27193    6.71789     11.18       186.718     
1 1 1 31 14 19 o 11 20.8057 5.71005 6.9246      8.02288  4.76427     9.10923  4.33572    137.429     13.1741     317.429     
1 1 1 31 14 20 o 18 85.6862 3.17826 136.476     12.6923  130.907     14.402   77.5874    328.907     29.0749     328.907     
1 1 1 31 14 21 o 17 46.8146 5.00622 51.1137     10.4383  33.642      11.5956  37.6262    191.596     9.67837     191.596     
1 1 1 31 14 22 o 19 51.0189 4.27984 49.4667     10.5566  48.2853     10.8914  49.1442    292.271     27.4768     292.271     
1 1 1 31 14 23 f 0  37.897  5.27002 25.5047     9.85845  30.7512     9.41459  39.2652    189.183     0           0           
1 1 1 31 14 24 o 14 22.7182 6.02364 9.65604     9.98431  7.23632     8.55082  5.00701    93.294      1.3781      93.294      
1 1 1 31 14 25 o 8  20.7877 5.75548 6.98576     9.04574  4.97223     8.39241  5.54865    147.386     0.202655    147.386     
1 1 1 31 14 26 o 13 61.9859 3.73608 75.2531     11.5691  67.5693     11.4005  57.5865    242.617     25.9717     242.617     
1 1 1 31 14 27 o 4  16.1935 5.2248  -3.51696    8.85806  -5.35557    9.97171  2.2301     91.6273     6.14898     271.627     
1 1 1 31 14 28 o 14 17.9082 5.31819 -2.06952    8.22566  5.10571     8.31071  2.91954    151.299     13.1732     331.299     
1 1 1 31 14 29 o 18 31.664  6.27498 23.6038     10.9574  18.1244     9.80297  22.8409    221.087     5.37858     221.087     
1 1 1 31 14 30 o 9  24.7091 6.03063 8.82091     8.7862   14.6309     9.52162  9.05532    76.3484     13.5203     256.348     
1 1 1 31 14 31 o 18 59.7825 3.73159 62.5995     10.9029  71.4639     11.2033  49.097     98.7453     12.2857     98.7453     
1 1 1 31 14 32 o 8  31.0282 5.40029 32.2362     9.30319  6.90157     9.47785  23.3614    102.133     7.72227     102.133     
1 1 1 31 14 33 f 0  26.2976 6.11265 16.9812     9.04747  10.5882     10.0539  21.2651    64.9632     0           0           
1 1 1 31 14 34 o 9  15.8269 5.02911 -6.45181    8.29407  0.876045    8.61242  1.33237    278.435     2.10467     98.4353     
1 1 1 31 14 35 o 16 26.9574 6.1359  9.25763     9.18845  20.8164     10.2636  15.7486    226.278     1.24635     46.2779     
1 1 1 31 14 36 o 13 47.427  5.03014 40.5283     11.6833  49.198      11.3348  41.2907    48.6463     17.3268     48.6463     
1 1 1 31 14 37 o 7  46.4545 5.18744 43.5258     11.8986  43.2128     11.4491  34.3366    261.205     4.19616     261.205     
1 1 1 31 14 38 o 7  59.0325 4.34481 64.0014     12.7931  70.9397     12.4749  56.3523    339.273     30.5424     339.273     
1 1 1 31 14 39 o 9  56.8078 4.73565 72.7173     12.8859  54.8713     13.1911  35.5576    120.738     9.18818     300.738     
1 1 1 31 14 40 o 7  23.403  6.57024 12.3756     10.9886  4.8297      12.6233  9.98564    131.71      1.28261     311.71      
1 1 1 31 14 41 o 9  25.5151 6.71141 16.731      11.2046  8.2542      12.4203  5.3264     166.083     21.3242     346.083     
1 1 1 31 14 42 o 15 23.3067 6.61444 13.4154     11.6753  2.39381     12.8091  2.1579     159.394     0.690583    159.394     
1 1 1 31 14 43 o 4  58.3441 5.54464 78.019      15.2243  61.5622     15.9582  36.5818    4.025       8.71479     184.025     
1 1 1 31 14 44 o 13 27.7651 7.15672 14.2806     12.4408  18.7824     13.447   11.4123    290.767     12.4424     110.767     
1 1 1 31 14 45 o 11 36.8978 6.98566 43.1401     13.2499  17.8807     15.6956  21.9118    172.592     5.51864     352.592     
1 1 1 31 14 46 o 12 27.3363 7.33045 9.56263     12.8513  22.243      15.1433  14.3541    66.0767     4.82622     246.077     
1 1 1 31 14 47 o 18 18.6934 6.03078 2.6764      11.938   -13.1704    14.3079  5.64551    129.092     2.16539     309.092     
1 1 1 31 14 48 o 16 43.5596 7.7929  40.9779     17.123   51.5534     17.1112  39.4597    265.09      23.8413     265.09      
1 1 1 31 14 49 o 16 32.9967 7.79427 39.7291     16.3749  14.2356     16.5126  24.692     47.0495     14.1178     47.0495     
1 1 1 31 14 50 o 3  32.0364 8.23761 23.4985     17.1756  31.6997     17.3144  14.595     125.857     11.5363     305.857     
1 1 1 31 14 51 o 9  22.6335 7.0442  -1.00273    15.9443  12.5883     15.7138  7.44617    68.0151     0.107722    68.0153     
1 1 1 31 14 52 o 14 21.2854 6.7177  14.4706     15.7238  -12.3252    15.1417  5.11092    69.3048     1.60916     249.305     
1 1 1 31 14 53 o 2  26.2937 7.68206 14.4704     17.0703  19.7035     16.081   9.12257    108.299     2.30161     108.299     
1 1 1 31 14 54 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 14 55 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 15 0  o 10 15.8368 6.37725 6.23663     7.90217  6.23663     7.90217  2.38383    180         20.6692     180         
1 1 1 31 15 1  o 12 55.02   3.71566 58.9914     10.0411  52.7318     10.1613  43.9944    44.554      8.19175     44.554      
1 1 1 31 15 2  o 18 61.6793 3.47974 64.1984     10.6934  75.4576     10.5656  58.0977    286.108     26.8008     286.108     
1 1 1 31 15 3  o 4  44.6284 4.71551 48.3199     9.46475  28.4167     10.1823  13.5869    171.134     37.9039     351.134     
1 1 1 31 15 4  o 11 41.0401 4.73874 27.9673     9.46861  36.4623     9.19989  36.8901    110.815     24.9549     110.815     
1 1 1 31 15 5  o 18 147.439 2.66968 376.864     20.0272  407.03      19.3479  139.764    147.896     57.0666     147.896     
1 1 1 31 15 6  f 0  17.4912 5.23999 0.998332    7.98427  1.40354     7.91706  10.7673    257.352     0           0           
1 1 1 31 15 7  o 17 88.7894 2.97014 141.052     13.5152  144.841     12.8196  51.7107    134.915     29.8064     314.915     
1 1 1 31 15 8  o 5  88.8575 2.96081 144.368     13.4169  141.953     12.876   65.747     241.228     1.4556      61.2281     
1 1 1 31 15 9  o 7  45.3243 4.37102 39.9767     9.90817  37.4065     9.43344  29.5545    280.451     5.78357     100.451     
1 1 1 31 15 10 o 5  42.5602 4.74904 35.8615     9.81257  33.2439     9.76519  30.1299    294.767     0.36669     294.767     
1 1 1 31 15 11 o 8  66.9049 3.53658 90.4004     11.9046  74.34       11.5752  53.7933    175.558     9.02357     175.558     
1 1 1 31 15 12 o 18 59.7634 3.6858  68.4345     10.9444  63.3702     10.8998  45.8435    213.13      4.18335     213.13      
1 1 1 31 15 13 o 12 63.4568 3.46531 74.9841     10.8998  72.8503     10.9662  49.2045    132.553     5.12781     132.553     
1 1 1 31 15 14 o 9  69.4749 3.32486 89.5436     11.3369  87.0984     11.6689  61.8941    208.099     21.6575     208.099     
1 1 1 31 15 15 o 15 90.2623 3.27525 150.103     14.286   147.407     15.2182  81.3678    306.032     28.5011     306.032     
1 1 1 31 15 16 o 17 16.4055 5.10062 0.330122    7.92525  -2.87338    8.37386  1.46749    331.303     5.61453     151.303     
1 1 1 31 15 17 o 11 46.6357 4.51002 37.2127     10.4125  45.5106     9.93816  37.1684    297.074     7.96573     297.074     
1 1 1 31 15 18 o 17 32.8892 5.76967 22.363      9.04381  20.9978     9.90683  22.8481    257.591     2.23959     257.591     
1 1 1 31 15 19 o 2  54.1035 4.0519  50.9615     10.4411  58.8371     11.1944  59.9198    227.253     50.5377     227.253     
1 1 1 31 15 20 o 8  50.7713 4.43155 57.2412     10.2545  41.1198     11.2454  52.0438    223.066     33.3975     223.066     
1 1 1 31 15 21 o 6  21.8578 5.89142 7.15286     8.43132  7.90348     9.47184  4.15371    127.16      19.4264     307.16      
1 1 1 31 15 22 o 13 28.6264 6.26906 14.9288     8.90052  18.4344     10.9376  17.8328    105.037     0.76134     285.037     
1 1 1 31 15 23 o 17 25.9814 6.26714 7.54873     8.57596  19.0786     11.3566  6.41035    315.576     22.0675     135.576     
1 1 1 31 15 24 o 4  23.3756 6.29226 10.2224     9.60928  7.7411      10.9331  11.585     276.499     3.39338     96.4989     
1 1 1 31 15 25 o 5  52.6895 4.78852 64.6315     10.842   43.5406     12.7364  44.937     31.941      14.3391     31.941      
1 1 1 31 15 26 o 16 25.3682 6.22827 3.50893     9.58108  20.3098     11.1264  15.5135    225.519     4.38076     225.519     
1 1 1 31 15 27 o 7  34.0939 5.973   23.9112     10.1357  24.3458     10.1699  18.2587    227.507     10.6955     47.5073     
1 1 1 31 15 28 o 6  29.8966 6.23219 18.3577     10.6661  19.0996     9.33816  22.2642    95.7537     8.37206     95.7537     
1 1 1 31 15 29 o 11 21.8605 6.05765 9.15478     9.91709  5.7069      9.4639   10.2904    248.285     0.910938    68.2854     
1 1 1 31 15 30 o 15 19.9145 5.92014 4.66237     10.8459  2.80701     9.16052  2.86637    301.65      18.444      121.65      
1 1 1 31 15 31 o 13 59.9678 4.00414 63.0675     12.2457  74.0802     11.334   49.3011    308.451     12.3054     308.45      
1 1 1 31 15 32 o 6  30.7096 6.36664 16.7569     10.7652  23.7249     10.3924  14.6247    52.9259     11.9723     232.926     
1 1 1 31 15 33 o 5  60.8372 4.45525 65.8752     12.9372  78.0619     13.8169  49.2761    345.232     11.3168     345.232     
1 1 1 31 15 34 o 19 49.1578 5.37136 69.7568     12.2981  31.2003     11.9772  32.094     189.196     5.42995     9.19585     
1 1 1 31 15 35 o 7  25.3734 6.58485 15.9462     10.7014  8.96838     11.7475  10.2941    252.823     10.7285     72.8234     
1 1 1 31 15 36 o 15 18.2682 5.64659 -7.91672    10.235   6.01456     10.3025  2.7929     328.318     2.12193     148.318     
1 1 1 31 15 37 o 14 54.7848 4.9905  64.3568     13.6878  55.8468     13.0571  41.6506    61.1776     6.22764     61.1776     
1 1 1 31 15 38 o 14 26.5556 6.70485 12.6932     11.6508  16.8255     11.0728  8.87758    321.062     4.1928      321.062     
1 1 1 31 15 39 o 3  30.273  7.11093 25.1059     13.8702  16.6393     11.3946  17.6531    299.221     2.30087     119.221     
1 1 1 31 15 40 o 13 25.9272 6.9035  5.83219     14.9919  17.9908     11.2496  11.0627    300.916     9.7183      120.916     
1 1 1 31 15 41 o 19 25.5921 6.54986 4.83567     12.0075  19.6037     11.1623  12.5062    40.2304     6.02243     40.2303     
1 1 1 31 15 42 o 11 45.9292 6.04793 53.9127     13.5061  36.1472     13.174   38.4525    174.882     14.2534     174.882     
1 1 1 31 15 43 o 14 21.1891 6.50535 4.72577     12.2159  2.02829     13.525   8.33429    120.263     6.78312     300.263     
1 1 1 31 15 44 o 7  26.2083 7.48449 15.2547     15.512   11.7959     14.8801  11.5967    68.6532     9.41759     248.653     
1 1 1 31 15 45 o 18 24.3568 7.26207 8.79552     15.3414  10.501      14.9837  10.2438    285.457     8.80642     105.457     
1 1 1 31 15 46 o 1  35.8657 7.80822 19.1033     17.7761  45.0804     16.1182  18.8435    146.822     10.0838     326.822     
1 1 1 31 15 47 o 10 38.2459 8.12019 41.5213     17.367   35.3515     16.2806  25.5675    166.432     1.17927     166.432     
1 1 1 31 15 48 o 16 16.5383 5.64482 -18.8801    15.1083  -9.30903    13.3452  1.24773    272.71      11.8819     92.7101     
1 1 1 31 15 49 o 14 26.8429 7.54797 7.33482     16.4615  25.8001     15.6626  10.686     188.987     4.54721     188.987     
1 1 1 31 15 50 o 8  17.2591 5.86251 -7.16588    15.2504  -14.1381    14.1695  1.35057    52.1619     3.86382     232.162     
1 1 1 31 15 51 o 18 19.4007 6.42422 0.0133406   15.899   -6.1827     15.4238  2.85691    313.98      4.28361     133.98      
1 1 1 31 15 52 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 15 53 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 16 0  o 3  42.1919 4.75443 34.6714     9.28886  34.6714     9.28886  0.0157089  2.21923e-05 64.3241     2.21929e-05 
1 1 1 31 16 1  o 13 45.436  4.47902 32.8129     9.91876  45.9956     9.57114  46.0611    268.442     31.6068     268.442     
1 1 1 31 16 2  o 19 14.8068 4.75614 -4.00868    7.66178  -3.29159    7.71225  1.05474    195.852     13.8967     195.853     
1 1 1 31 16 3  o 9  43.4268 4.57584 36.028      9.5612   35.8485     9.74647  29.3467    59.7313     3.86308     239.731     
1 1 1 31 16 4  o 15 25.4121 5.99556 11.9834     8.98406  12.6107     8.92929  4.91465    141.977     24.307      321.977     
1 1 1 31 16 5  o 19 50.4555 4.00346 48.4429     9.88553  46.7502     10.0047  24.9314    292.28      24.6825     112.28      
1 1 1 31 16 6  o 16 50.4617 4.01179 42.901      9.94183  52.5792     9.88211  40.2812    131.928     7.16592     131.928     
1 1 1 31 16 7  o 11 115.95  2.71959 243.611     15.7865  243.151     15.7753  96.4665    19.341      17.8175     19.341      
1 1 1 31 16 8  o 17 89.0144 2.9943  150.075     13.3987  138.536     13.2285  82.0546    84.502      30.7451     84.502      
1 1 1 31 16 9  o 4  28.036  5.70024 20.7109     8.73047  10.3497     8.75606  3.46586    344.648     32.3131     164.648     
1 1 1 31 16 10 o 8  48.0872 4.1112  43.8628     9.71901  43.1528     9.6935   28.0469    263.307     14.4707     83.3069     
1 1 1 31 16 11 o 5  17.8127 5.21144 6.881       8.07605  -5.26878    8.18179  4.17816    325.078     4.73564     145.078     
1 1 1 31 16 12 o 9  53.1827 4.10273 42.7536     10.6668  64.5644     10.272   54.9795    155.087     34.2527     155.087     
1 1 1 31 16 13 o 7  73.0179 3.51509 99.7961     12.5196  97.0965     13.0352  73.7327    107.309     39.5854     107.309     
1 1 1 31 16 14 o 18 92.0893 3.19063 146.694     14.884   164.276     14.4017  73.6718    104.649     9.24952     104.649     
1 1 1 31 16 15 o 9  41.6405 5.17263 39.1345     10.0704  29.2585     10.5564  19.8635    296.741     20.7354     116.741     
1 1 1 31 16 16 o 5  44.4102 5.07053 35.0912     11.44    42.1028     10.1074  30.3461    310.456     3.42009     130.456     
1 1 1 31 16 17 f 0  35.3085 5.64172 33.8501     9.73439  17.1321     10.1784  17.4803    144.641     0           0           
1 1 1 31 16 18 o 10 59.1045 3.77201 58.4161     10.7109  72.6644     11.3436  42.0257    136.738     3.12612     316.738     
1 1 1 31 16 19 o 7  56.5109 3.92259 53.2835     10.7082  67.334      11.1333  44.8437    112.249     6.90541     112.249     
1 1 1 31 16 20 o 1  20.8102 5.5584  12.9643     8.54696  -5.24006    9.78811  7.59319    151.601     1.23487     151.601     
1 1 1 31 16 21 o 18 22.4264 5.93494 6.38036     9.291    10.6555     8.88793  11.3628    112.648     1.60644     112.648     
1 1 1 31 16 22 o 7  42.1755 4.99692 27.2987     9.99151  43.833      10.0469  33.3541    63.7687     6.98191     63.7687     
1 1 1 31 16 23 o 2  20.4382 5.72133 4.60043     8.63462  7.27213     8.80677  3.44285    132.17      18.89       312.17      
1 1 1 31 16 24 o 1  17.4786 5.3417  5.61286     9.30047  -6.5755     8.56883  3.06934    128.223     12.7134     308.223     
1 1 1 31 16 25 o 19 22.5947 5.96374 11.2322     9.26894  6.87303     8.99449  10.2563    278.943     2.96366     278.943     
1 1 1 31 16 26 o 17 24.4838 6.37359 8.45702     9.1739   14.7752     11.4451  5.83969    4.97366     20.7089     184.974     
1 1 1 31 16 27 o 12 25.6631 6.62052 15.1451     10.8004  10.7622     11.5427  10.1236    246.541     13.0663     66.5408     
1 1 1 31 16 28 o 14 20.3621 6.27572 -3.60323    10.5049  7.68122     13.5944  1.09378    197.576     23.4165     17.5762     
1 1 1 31 16 29 o 6  38.623  7.31033 24.4834     12.3221  44.8606     16.8354  27.0698    100.285     1.23073     100.285     
1 1 1 31 16 30 o 7  20.8407 6.36791 1.28599     10.1418  5.88848     13.9928  4.93486    316.215     0.452656    316.215     
1 1 1 31 16 31 o 6  21.3196 6.69109 1.61874     12.342   1.28379     16.1446  8.03598    120.902     4.78212     300.902     
1 1 1 31 16 32 o 16 38.5641 7.38323 34.3023     16.3841  34.2844     13.0377  28.6298    291.984     5.76516     291.984     
1 1 1 31 16 33 o 5  24.9373 6.94026 8.98823     13.0437  13.832      12.596   10.2518    207.268     9.35386     27.2679     
1 1 1 31 16 34 o 15 27.3254 7.16362 10.4748     13.4858  20.5661     13.2208  10.9109    53.7952     12.6836     233.795     
1 1 1 31 16 35 o 19 49.2925 5.81473 60.3477     15.0557  42.144      12.676   43.173     145.977     18.5012     145.977     
1 1 1 31 16 36 o 16 53.1023 5.71403 50.4643     15.5224  66.6694     12.9824  31.7001    206.81      12.1954     26.8099     
1 1 1 31 16 37 o 16 19.0641 5.90239 5.09283     11.4049  -3.13915    10.2824  4.88677    182.069     1.6437      2.06863     
1 1 1 31 16 38 o 4  26.8877 7.02323 21.6166     13.62    8.55618     11.9897  15.9321    26.4731     0.232719    206.473     
1 1 1 31 16 39 o 16 31.9969 7.13275 16.5287     14.0996  29.6863     12.6696  23.1833    258.468     5.70376     258.468     
1 1 1 31 16 40 o 14 19.1128 6.09083 -9.55874    14.6148  3.16701     11.0869  6.92788    40.3356     3.97013     220.336     
1 1 1 31 16 41 o 11 25.0066 6.97709 24.2638     15.5449  -2.17192    11.9883  14.6938    315.377     1.7756      315.377     
1 1 1 31 16 42 o 6  17.4771 5.8062  -8.72767    14.9388  -5.39292    10.8731  3.53641    234.115     1.38519     54.1147     
1 1 1 31 16 43 o 8  17.3866 5.72641 -19.3944    14.9465  0.432098    11.0734  4.60325    89.0886     4.8518      269.089     
1 1 1 31 16 44 o 9  20.4624 6.47115 3.87368     15.3504  0.802536    11.6813  7.82105    329.257     3.50451     149.257     
1 1 1 31 16 45 o 3  38.5028 8.38685 49.6115     17.766   32.4951     19.2743  25.8852    320.299     1.36174     320.299     
1 1 1 31 16 46 o 16 26.5729 7.59065 -1.89517    17.4193  30.087      17.2441  13.053     281.65      4.24283     101.65      
1 1 1 31 16 47 o 17 24.1153 7.29003 -4.05548    16.4011  22.681      16.9005  10.1891    355.534     2.66925     175.534     
1 1 1 31 16 48 o 13 24.3622 7.44278 20.3246     17.0715  2.39977     17.291   9.68155    5.56677     3.54711     185.567     
1 1 1 31 16 49 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 16 50 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 17 0  o 11 77.7838 3.16076 110.008     12.227   110.008     12.227   54.0174    1.53336e-05 10.755      180         
1 1 1 31 17 1  o 19 70.8355 3.32776 86.1421     11.7051  99.127      11.7396  38.2705    201.626     30.2653     21.6262     
1 1 1 31 17 2  o 3  47.9268 4.34389 48.1646     10.1145  39.6236     10.1614  45.3159    313.475     21.721      313.475     
1 1 1 31 17 3  o 13 65.1727 3.4981  72.7693     11.2105  84.8917     11.4271  63.2293    268.383     29.7968     268.383     
1 1 1 31 17 4  o 19 20.5348 5.68091 5.30046     8.29662  6.80937     8.67999  5.66218    336.36      13.8455     156.36      
1 1 1 31 17 5  o 6  59.4558 3.72607 73.4585     11.1563  58.9308     10.7439  45.4335    156.291     2.34273     156.291     
1 1 1 31 17 6  o 18 72.9789 3.29572 105.786     12.0548  90.9045     11.8809  63.6005    319.374     17.8929     319.374     
1 1 1 31 17 7  o 12 53.2736 3.96098 51.6724     10.3494  55.3198     10.4771  32.1151    240.069     14.9862     60.0691     
1 1 1 31 17 8  o 7  22.4438 5.81667 6.77531     8.65858  10.749      8.59764  10.9151    34.8661     4.31227     214.866     
1 1 1 31 17 9  o 18 36.9281 5.31921 27.7658     9.39951  26.8428     9.61724  23.6973    69.8869     5.27022     249.887     
1 1 1 31 17 10 o 6  17.9804 5.33986 -2.57297    8.36406  5.65313     8.41654  3.77999    45.9627     1.12576     225.963     
1 1 1 31 17 11 o 11 25.696  5.82818 18.2322     8.83871  7.35276     9.05582  4.61858    19.3392     45.7544     19.3392     
1 1 1 31 17 12 o 6  54.4484 4.12262 59.9685     11.044   52.7771     11.0556  46.3965    330.955     12.7659     330.955     
1 1 1 31 17 13 o 19 104.083 3.04418 194.321     15.7302  203.561     15.9561  91.5294    306.584     26.1853     306.584     
1 1 1 31 17 14 f 0  15.954  5.06738 -4.22942    8.68477  -0.72105    8.29318  15.5146    61.6066     0           0           
1 1 1 31 17 15 o 9  34.9546 5.87867 25.2979     10.2217  25.4003     10.0724  19.1444    72.7619     11.3666     252.762     
1 1 1 31 17 16 o 1  52.9166 4.25229 62.7521     11.1204  45.2281     10.7867  49.8304    114.442     22.843      114.442     
1 1 1 31 17 17 o 4  56.3379 4.01532 59.2898     11.5094  61.4194     10.8184  39.9922    318.263     3.2711      138.263     
1 1 1 31 17 18 o 13 42.1269 5.02337 32.4372     10.3506  38.3105     10.0283  26.4431    1.34147     8.04836     181.341     
1 1 1 31 17 19 o 4  14.3703 4.73988 -4.91054    8.48558  -7.26321    8.28808  1.13493    71.8353     5.95298     251.835     
1 1 1 31 17 20 o 9  49.1885 4.95477 44.6151     10.9578  51.5064     12.7896  49.4794    20.1196     29.6824     20.1196     
1 1 1 31 17 21 o 18 20.4022 5.80329 4.84468     9.18532  6.66837     9.02809  8.52805    148.788     3.29758     328.788     
1 1 1 31 17 22 o 14 45.9936 5.12051 33.7368     10.8283  52.0853     11.7701  25.3268    273.24      16.2652     93.2395     
1 1 1 31 17 23 o 5  26.5986 6.45043 7.8239      11.0405  20.5631     10.7941  3.62859    329.078     29.3788     149.079     
1 1 1 31 17 24 o 1  35.5151 6.93836 31.6534     14.0816  25.1047     11.4519  30.0231    241.352     20.4499     241.352     
1 1 1 31 17 25 o 10 43.153  6.04208 39.7342     12.4129  38.9436     12.7916  33.2468    145.162     5.7083      145.162     
1 1 1 31 17 26 o 16 23.6547 6.49104 14.1219     11.56    5.56402     10.8077  8.45348    160.81      12.6301     340.81      
1 1 1 31 17 27 o 11 36.4352 6.25434 40.6496     11.9982  17.9109     11.6447  28.8004    41.8409     9.17354     41.8409     
1 1 1 31 17 28 o 14 20.315  6.10483 1.5115      11.5696  5.7759      10.3305  6.7049     327.349     6.59762     147.349     
1 1 1 31 17 29 o 18 39.5372 6.69246 38.2901     13.6241  31.3166     12.5825  27.1861    260.351     0.0260956   80.3497     
1 1 1 31 17 30 o 2  53.309  5.31692 70.3204     14.0304  46.6202     13.1937  45.8131    118.957     16.1164     118.957     
1 1 1 31 17 31 o 4  18.2715 5.72559 6.94121     10.8355  -17.7158    12.3898  3.72458    357.404     4.41147     177.404     
1 1 1 31 17 32 o 18 26.3256 7.22481 15.7787     13.6106  12.2818     13.7374  14.1126    149.201     2.61816     329.201     
1 1 1 31 17 33 o 11 25.4872 6.94937 16.6442     12.1321  7.74991     13.7563  11.1736    4.68399     9.38461     184.684     
1 1 1 31 17 34 o 5  16.9048 5.61973 -10.4811    10.8681  -4.74076    13.2032  3.52845    188.174     5.42379     8.17421     
1 1 1 31 17 35 o 1  22.3753 6.84077 -3.70693    14.6745  10.7993     14.3379  4.26764    116.198     1.73751     116.198     
1 1 1 31 17 36 o 12 36.7716 8.66988 37.5781     21.0601  32.7407     16.5539  27.41      305.973     6.19091     305.973     
1 1 1 31 17 37 o 6  19.6203 6.5769  2.20883     19.4826  -18.8497    13.7521  7.08946    5.30649     0.908741    185.306     
1 1 1 31 17 38 o 3  21.2207 7.02334 -3.74217    22.5664  -4.08966    14.1125  9.23087    310.947     0.100635    130.946     
1 1 1 31 17 39 o 8  27.4105 8.01575 11.3513     21.2944  19.0977     15.8603  8.44922    170.289     5.28956     170.289     
1 1 1 31 17 40 o 2  18.8863 6.37252 -17.5459    19.8703  -6.05931    14.2728  4.87297    163.527     10.9279     343.527     
1 1 1 31 17 41 o 14 38.9583 8.90166 42.7652     22.7032  44.3673     17.7892  30.3064    139.005     9.98128     139.005     
1 1 1 31 17 42 o 19 31.8128 7.99026 13.1694     17.1509  40.4007     17.5108  22.974     345.449     10.4985     345.449     
1 1 1 31 17 43 o 19 29.7311 8.10462 24.2186     17.0366  25.1249     17.1104  18.6936    116.102     7.77176     116.102     
1 1 1 31 17 44 o 7  46.0578 7.6583  51.8724     19.122   58.3627     15.8863  34.8923    150.993     7.90172     150.993     
1 1 1 31 17 45 o 6  18.6311 6.13122 -10.9364    16.3769  2.06658     12.4802  2.8516     102.855     4.11271     282.855     
1 1 1 31 17 46 o 17 21.3473 6.89328 9.79992     16.763   -3.65864    16.4623  5.15541    150.246     3.16518     330.246     
1 1 1 31 17 47 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 17 48 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 18 0  o 9  16.0013 6.5971  6.48        8.76167  6.48        8.76167  2.53109    360         1.90504     180         
1 1 1 31 18 1  o 6  23.2086 6.00658 10.4735     8.95992  9.45381     9.295    10.5415    234.334     4.51137     234.334     
1 1 1 31 18 2  o 17 102.967 2.88333 202.513     14.8738  186.584     14.8065  97.0265    158.083     37.9078     158.083     
1 1 1 31 18 3  o 12 18.16   5.35266 7.47547     8.71331  -4.37998    8.36478  4.32196    156.741     12.1816     336.741     
1 1 1 31 18 4  o 13 44.4972 4.66717 34.1356     9.92085  43.6822     10.1525  41.3454    82.7669     18.9029     82.7669     
1 1 1 31 18 5  o 5  35.2049 5.68061 26.4052     9.63385  24.8433     9.9719   32.4986    240.351     21.8753     240.351     
1 1 1 31 18 6  o 14 17.1044 5.28078 2.15601     8.34536  -2.41067    8.94314  4.5653     299.696     4.98484     119.696     
1 1 1 31 18 7  o 6  25.8334 6.06945 16.7101     9.35687  10.3021     9.2958   10.8261    117.598     13.287      297.598     
1 1 1 31 18 8  o 11 34.6007 5.87909 28.5947     10.3677  21.6999     9.84131  18.5468    219.181     12.3917     39.1807     
1 1 1 31 18 9  o 3  38.9362 5.43962 31.6247     9.81793  30.2462     10.6397  33.5394    63.714      12.5154     63.714      
1 1 1 31 18 10 f 0  18.1461 5.39778 6.14577     8.67384  -2.31138    8.49797  12.8669    22.4061     0           0           
1 1 1 31 18 11 o 3  25.1781 6.1489  12.7963     9.27664  12.8493     9.57827  13.4941    341.194     5.28462     161.194     
1 1 1 31 18 12 o 8  91.7456 3.20445 162.94      14.4106  149.544     14.9117  91.2946    182.94      44.6096     182.94      
1 1 1 31 18 13 o 15 42.8589 5.01574 33.3642     10.5179  40.3512     10.166   37.1008    139.704     13.0736     139.704     
1 1 1 31 18 14 o 17 34.1079 6.06233 20.0943     11.06    29.5498     9.99908  17.0071    272.928     14.4974     92.9281     
1 1 1 31 18 15 o 19 30.2927 6.14963 16.0836     9.95258  23.331      9.95757  19.7012    259.464     1.33611     79.4641     
1 1 1 31 18 16 o 11 26.2293 6.08858 19.7331     9.76466  8.45516     9.53877  11.841     265.101     11.3094     85.1008     
1 1 1 31 18 17 o 6  28.4955 6.2338  21.7439     10.2299  13.1096     9.74387  15.9416    193.204     6.24986     13.2041     
1 1 1 31 18 18 o 7  58.0638 4.67732 69.2541     13.7525  63.6178     12.9864  35.0456    169.627     16.0778     349.627     
1 1 1 31 18 19 o 11 44.1958 6.19785 35.4337     12.5917  48.3798     13.9242  41.2852    225.455     21.2354     225.455     
1 1 1 31 18 20 o 4  27.3974 6.59697 21.9333     11.5431  9.89472     10.8656  17.2577    268.715     0.813952    268.715     
1 1 1 31 18 21 o 15 23.5726 6.61784 12.3983     11.1133  5.80667     12.7235  10.8938    62.4434     5.96468     242.443     
1 1 1 31 18 22 o 8  25.8734 6.76632 14.1019     12.0631  13.4885     11.1804  10.2859    151.666     5.12133     151.666     
1 1 1 31 18 23 o 9  31.7807 6.86504 23.4433     12.4868  22.313      11.4031  19.6793    257.36      2.86759     77.3597     
1 1 1 31 18 24 o 1  70.3049 4.75171 98.4437     18.053   97.4699     14.7692  68.9678    26.289      35.2677     26.289      
1 1 1 31 18 25 o 12 20.0637 6.12252 2.04483     11.9768  3.91289     10.5322  4.23843    129.961     0.842309    309.961     
1 1 1 31 18 26 o 12 18.3659 5.85013 2.04176     11.693   -5.56019    11.1667  2.30778    68.5584     14.7181     248.558     
1 1 1 31 18 27 o 5  17.9429 5.72345 -6.25955    11.377   1.55789     10.756   3.16175    139.183     11.1156     319.183     
1 1 1 31 18 28 o 5  19.8009 5.94257 10.8554     11.2896  -8.93649    10.911   6.5764     196.901     6.30031     16.9008     
1 1 1 31 18 29 o 8  35.2747 6.90551 36.6641     12.9012  20.2937     13.3655  23.5493    17.1636     0.912103    197.164     
1 1 1 31 18 30 o 10 50.2762 6.63511 63.3328     17.0013  48.1114     15.2236  33.9569    354.917     4.41024     174.917     
1 1 1 31 18 31 o 17 23.7254 6.91636 17.3466     15.0832  -0.269402   12.1932  12.138     57.6267     4.34903     57.6268     
1 1 1 31 18 32 o 7  34.4418 7.62552 25.5105     16.5819  31.1553     13.3924  22.001     38.3678     2.94771     218.368     
1 1 1 31 18 33 o 5  26.9423 7.44175 18.9277     15.9882  12.4111     13.0587  5.38346    258.905     25.8683     78.9054     
1 1 1 31 18 34 o 1  42.4561 7.51434 49.1143     17.4466  37.4427     14.4966  36.684     224.669     15.4036     224.669     
1 1 1 31 18 35 o 1  29.5449 7.6064  17.1007     16.512   24.1258     13.5647  15.2826    38.5542     8.60541     218.554     
1 1 1 31 18 36 o 7  39.8032 8.31478 46.3733     17.8374  37.1004     17.9     36.4132    154.207     22.8685     154.207     
1 1 1 31 18 37 o 2  27.8906 7.91654 29.7581     18.395   5.63564     16.9657  15.3532    143.727     4.56211     323.727     
1 1 1 31 18 38 o 3  47.0712 8.07051 56.9457     18.421   57.5835     19.2611  39.6903    124.429     14.8576     124.429     
1 1 1 31 18 39 f 0  20.5965 6.67653 -3.82504    15.8248  4.06838     15.5684  6.79171    266.422     0           0           
1 1 1 31 18 40 o 7  39.854  8.46978 36.4747     18.5836  55.7737     18.9547  32.4237    14.5269     13.927      14.5269     
1 1 1 31 18 41 o 12 21.1826 6.9873  6.7481      22.7493  -0.795884   12.6157  6.45528    289.497     2.56097     109.497     
1 1 1 31 18 42 o 13 18.0556 6.26049 -7.17201    22.9691  -12.382     11.9681  2.49488    49.9325     5.61182     229.932     
1 1 1 31 18 43 o 2  26.2377 7.82092 14.844      24.1848  19.5666     13.9559  9.66465    39.6609     2.52338     39.6609     
1 1 1 31 18 44 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 18 45 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 19 0  o 15 40.784  5.83894 34.6978     10.5685  34.6978     10.5685  24.8197    360         12.9326     180         
1 1 1 31 19 1  o 10 110.967 3.09223 227.351     16.915   229.24      17.4074  101.36     37.5045     33.7958     37.5045     
1 1 1 31 19 2  o 1  23.8637 5.81469 19.1801     9.5929   0.611174    9.45371  8.81507    117.636     14.0555     297.636     
1 1 1 31 19 3  o 13 21.2233 5.94276 8.24781     9.39669  5.91212     9.41514  8.46459    4.86239     8.44528     184.862     
1 1 1 31 19 4  o 17 24.7784 6.19435 17.2846     10.1508  6.95626     9.71937  12.5855    196.197     6.05998     196.197     
1 1 1 31 19 5  o 12 19.3602 5.68052 -0.579483   9.58135  7.46947     9.05782  6.7576     145.032     7.47666     325.032     
1 1 1 31 19 6  o 18 33.599  6.08109 21.9999     10.7781  26.5969     9.90689  26.9288    320.084     8.54022     320.084     
1 1 1 31 19 7  o 18 64.3754 4.10113 70.3919     13.117   89.6346     12.8157  60.2222    23.423      24.479      23.423      
1 1 1 31 19 8  o 6  23.3476 6.17795 10.0028     9.71412  10.7003     9.77121  12.0006    309.418     3.61222     309.418     
1 1 1 31 19 9  o 13 24.0885 6.00156 17.5127     9.54168  3.83027     9.88979  13.365     158.141     4.5882      158.141     
1 1 1 31 19 10 o 17 56.7481 4.30307 70.807      11.7669  54.8792     12.0547  48.5723    15.437      13.1058     15.437      
1 1 1 31 19 11 o 7  29.7504 6.47663 11.5163     10.7712  27.2658     11.5087  20.5163    79.9985     2.31144     79.9985     
1 1 1 31 19 12 o 4  28.9381 6.47614 19.9277     10.8961  16.8724     10.1662  20.7476    31.0987     10.3478     31.0987     
1 1 1 31 19 13 o 7  24.654  6.65076 4.27873     12.7222  16.9362     11.4014  11.9986    277.21      4.63625     277.21      
1 1 1 31 19 14 o 13 54.1115 4.99415 61.3284     13.3056  56.4451     13.1184  40.1619    200.088     0.438438    200.088     
1 1 1 31 19 15 o 15 23.9622 6.35876 17.3245     11.0907  3.23539     10.7568  12.6631    36.0869     1.54645     216.087     
1 1 1 31 19 16 o 17 37.3306 6.47358 38.019      12.1683  24.0398     12.2758  27.9254    11.1476     4.18845     11.1476     
1 1 1 31 19 17 o 11 18.5505 5.74789 6.89834     10.8651  -8.68796    10.5941  0.0753949  74.6035     22.2012     254.604     
1 1 1 31 19 18 o 12 78.3036 4.25674 132.343     16.9839  106.665     16.0891  66.0219    58.1979     15.0828     58.1979     
1 1 1 31 19 19 o 18 66.0489 4.88557 80.8945     15.4032  94.0652     16.4493  60.2643    111.437     23.2482     111.437     
1 1 1 31 19 20 o 13 30.6509 7.00206 20.472      12.6665  22.6569     11.9185  20.5445    262.418     2.23335     262.418     
1 1 1 31 19 21 o 15 26.1875 6.53416 24.2261     12.1804  2.52238     11.4381  10.2187    292.344     13.9075     112.344     
1 1 1 31 19 22 o 3  26.1281 6.85007 16.0095     12.5051  12.9555     11.3417  15.7582    37.6307     2.60758     37.6307     
1 1 1 31 19 23 o 9  18.7559 5.92402 -0.556781   11.8535  0.0389842   10.8775  5.24986    36.1735     8.25789     216.174     
1 1 1 31 19 24 f 0  33.0776 7.08822 14.3039     16.4961  33.9764     12.2562  14.5572    234.737     0           0           
1 1 1 31 19 25 o 19 48.0004 7.22038 64.7788     19.4374  41.992      14.3743  40.722     60.0006     13.102      60.0006     
1 1 1 31 19 26 f 0  31.5308 7.49364 15.0443     17.7432  29.2711     12.8673  22.7488    304.863     0           0           
1 1 1 31 19 27 o 16 19.4252 6.38434 -3.54268    17.5535  -4.93286    11.9013  2.63779    275.875     0.541025    275.875     
1 1 1 31 19 28 o 13 28.1096 7.97972 23.013      21.075   13.3617     13.1616  19.0393    123.528     3.77353     123.528     
1 1 1 31 19 29 o 13 40.8177 8.35194 46.6654     21.7378  39.3136     14.8205  25.5958    258.269     6.47484     78.2693     
1 1 1 31 19 30 o 10 18.5281 6.16572 -15.6156    18.4221  -2.59885    11.8408  3.41091    204.243     15.2551     24.2432     
1 1 1 31 19 31 f 0  25.2369 7.56661 15.0067     19.8316  9.40033     13.2978  11.6291    65.3038     0           0           
1 1 1 31 19 32 o 8  20.6322 6.6103  -20.2721    20.928   7.10137     12.463   8.63552    275.745     0.733647    275.745     
1 1 1 31 19 33 o 9  28.3987 7.80001 22.9526     17.8892  17.5902     13.9294  8.33739    93.1483     21.9512     273.148     
1 1 1 31 19 34 o 12 22.8247 7.00042 -1.41358    18.6161  12.0322     13.0109  11.2879    294.152     1.43237     294.152     
1 1 1 31 19 35 o 19 46.9239 8.33955 61.7152     22.2294  57.5711     17.1815  32.9848    211.617     0.121181    211.616     
1 1 1 31 19 36 o 3  22.0599 7.02904 12.7539     18.8084  -0.271514   13.4459  7.55712    243.55      0.70084     243.55      
1 1 1 31 19 37 o 2  33.8227 8.27246 31.4523     21.1089  36.2757     15.0552  19.7879    333.985     4.75976     153.985     
1 1 1 31 19 38 o 7  19.5764 6.36518 -12.5478    18.2861  5.81125     12.5615  4.85497    341.47      4.61237     161.47      
1 1 1 31 19 39 o 2  19.9656 6.50087 -8.485      18.6538  5.63897     13.025   3.97516    34.2642     2.60211     214.264     
1 1 1 31 19 40 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 19 41 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 19 42 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 20 0  o 2  32.1971 7.91867 26.4201     11.5392  26.4201     11.5392  29.9464    360         12.4373     360         
1 1 1 31 20 1  f 0  55.3015 4.70714 57.8624     12.7538  64.0748     12.7746  28.0727    216.603     0           0           
1 1 1 31 20 2  o 19 27.0836 6.54188 18.0985     10.7435  13.881      10.6953  5.313      283.794     27.1334     103.794     
1 1 1 31 20 3  f 0  26.6048 6.28758 5.74922     10.868   23.0052     10.6743  17.2249    228.304     0           0           
1 1 1 31 20 4  o 5  32.2656 6.39753 30.6289     11.1213  15.775      11.3681  25.501     65.5271     10.1091     65.5271     
1 1 1 31 20 5  o 19 49.1018 5.45485 58.2995     13.6803  42.1871     12.2194  44.9653    146.826     18.9369     146.826     
1 1 1 31 20 6  o 1  28.4405 6.5977  19.3128     10.9989  16.7513     10.7421  18.9296    351.33      8.9638      351.33      
1 1 1 31 20 7  o 1  46.3481 5.86941 47.2268     12.4828  43.9217     13.699   43.634     298.901     21.6029     298.901     
1 1 1 31 20 8  o 9  30.9246 6.98647 25.2968     12.4021  18.7845     12.2449  21.8236    115.109     4.09425     115.109     
1 1 1 31 20 9  o 6  25.1805 6.60884 20.9334     12.1348  2.69208     11.8389  13.8393    236.445     1.40827     56.4452     
1 1 1 31 20 10 o 16 50.0809 6.7084  67.8146     15.6243  44.3894     16.4884  45.8906    155.718     19.9536     155.718     
1 1 1 31 20 11 o 3  57.5208 5.33536 59.4804     14.7748  76.9547     14.9824  59.3909    234.667     35.5171     234.667     
1 1 1 31 20 12 o 11 28.3124 6.96543 4.17315     14.2785  28.0114     13.0841  11.4906    148.408     15.4866     328.408     
1 1 1 31 20 13 f 0  81.1605 4.36075 153.12      17.3252  106.401     17.3085  47.4838    37.4382     0           0           
1 1 1 31 20 14 o 6  20.6089 6.11035 12.0338     11.5821  -6.07561    11.1702  0.163784   295.13      27.2931     295.13      
1 1 1 31 20 15 o 6  33.8968 6.81651 34.3338     12.9099  18.7636     12.064   17.2052    189.486     13.4723     9.48649     
1 1 1 31 20 16 o 12 28.0728 6.42877 29.9905     12.4046  2.41313     11.4225  19.2283    119.933     9.89329     119.933     
1 1 1 31 20 17 o 16 75.1186 4.49079 115.735     16.7149  106.622     16.7484  54.4987    292.705     3.97939     112.705     
1 1 1 31 20 18 o 18 27.6323 6.99858 -3.16511    15.6881  28.7629     13.749   17.3874    222.68      0.643842    42.68       
1 1 1 31 20 19 o 18 21.4604 6.38949 -11.4867    15.357   12.327      11.3748  10.1051    171.162     3.87158     351.162     
1 1 1 31 20 20 o 10 37.6306 7.5631  29.3006     16.6418  38.5593     14.0133  35.0064    116.828     21.6932     116.828     
1 1 1 31 20 21 o 3  22.0627 6.78854 0.940452    16.6483  6.88994     12.0175  8.98889    240.194     9.67392     60.194      
1 1 1 31 20 22 o 19 23.5261 7.59676 18.5669     25.4296  -3.4052     11.4971  13.3303    198.684     2.01597     198.684     
1 1 1 31 20 23 o 1  28.3532 7.79153 31.811      19.2683  6.78574     12.9525  20.4126    283.591     10.1069     283.591     
1 1 1 31 20 24 o 10 20.8638 6.68693 1.69114     17.7097  -0.0745026  12.205   9.98167    80.8139     0.955317    260.814     
1 1 1 31 20 25 o 1  37.1453 8.13818 35.4064     19.8095  36.0774     14.432   26.2883    160.929     0.879333    160.929     
1 1 1 31 20 26 o 12 19.8612 6.4873  -1.83065    18.2577  -1.83073    11.6272  5.99626    58.3893     1.05911     58.3893     
1 1 1 31 20 27 o 10 21.4639 6.69531 -8.816      17.7994  9.62744     12.6933  8.46821    320.397     9.22436     140.397     
1 1 1 31 20 28 o 18 23.8688 7.33509 13.3522     18.7093  5.88644     13.7336  13.3905    227.951     4.08723     227.951     
1 1 1 31 20 29 o 17 38.3524 8.32315 46.2221     20.5156  35.3035     14.703   28.4923    174.529     4.26021     174.529     
1 1 1 31 20 30 o 14 22.5956 7.07316 6.02865     19.1301  7.17417     12.9067  11.0329    86.615      0.617374    86.615      
1 1 1 31 20 31 o 13 22.0194 6.90164 -2.5414     19.456   9.96904     12.7828  7.52566    323.805     1.57016     323.805     
1 1 1 31 20 32 o 7  22.6334 7.17848 7.14064     20.789   7.20673     13.3762  9.17634    320.166     0.839392    320.166     
1 1 1 31 20 33 o 7  26.0725 7.91143 28.3282     22.8538  10.1334     13.6916  11.5119    252.029     4.37235     252.029     
1 1 1 31 20 34 o 5  25.3799 7.41424 -1.11159    22.4274  22.9332     13.9741  12.8874    248.87      0.963657    68.8702     
1 1 1 31 20 35 o 12 21.7686 6.9629  -3.5201     21.9585  9.87628     13.2212  6.14631    204.501     1.02807     24.5011     
1 1 1 31 20 36 o 16 16.0575 5.64879 -8.45955    19.318   -20.7704    11.1307  0.230897   20.548      1.41962     200.548     
1 1 1 31 20 37 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 20 38 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 21 0  o 8  22.5219 8.08053 15.6459     11.3834  15.6459     11.3834  12.8361    180         6.56744     3.5139e-05  
1 1 1 31 21 1  o 7  97.9462 3.69337 185.063     18.0563  180.705     18.0678  97.1977    3.3207      45.1469     3.3207      
1 1 1 31 21 2  o 15 127.683 3.6551  304.244     22.3265  315.941     24.334   133.877    152.759     72.3951     152.759     
1 1 1 31 21 3  o 12 33.6642 7.25082 33.6826     13.8537  20.1694     13.4962  27.6232    278.453     10.701      278.453     
1 1 1 31 21 4  o 10 84.8892 4.34447 139.219     18.4999  143.089     18.2032  85.0478    6.70855     41.4188     6.70855     
1 1 1 31 21 5  o 8  23.5155 6.65307 3.84244     12.6193  14.4388     11.9322  13.4334    170.703     0.951247    170.703     
1 1 1 31 21 6  o 11 43.8796 7.06232 56.3113     16.7728  33.5803     13.8696  39.9744    251.319     17.4289     251.319     
1 1 1 31 21 7  o 3  29.1002 6.91883 8.17985     13.539   28.2895     12.659   17.0981    230.074     5.53146     50.0736     
1 1 1 31 21 8  o 13 54.5429 6.05533 56.2768     16.1148  71.2613     15.5788  39.1054    258.797     3.35881     78.7973     
1 1 1 31 21 9  o 1  27.3802 7.58371 17.5299     14.9573  15.0782     15.365   14.3623    167.945     8.07402     347.945     
1 1 1 31 21 10 o 11 63.3088 6.5485  88.1834     18.1029  87.4312     21.8091  57.2434    17.6122     19.8642     17.6122     
1 1 1 31 21 11 o 16 32.2335 8.294   21.723      24.2632  28.1345     13.8552  25.9704    15.069      10.8279     15.069      
1 1 1 31 21 12 f 0  30.4873 7.76512 32.5906     17.5316  13.2883     13.23    20.7085    289.727     0           0           
1 1 1 31 21 13 o 16 42.6525 8.06219 48.821      19.6051  41.9607     15.5873  34.635     217.704     8.03404     217.704     
1 1 1 31 21 14 o 3  85.5217 5.09905 164.941     24.3486  133.694     18.9523  83.0733    314.42      36.866      314.42      
1 1 1 31 21 15 o 8  19.2018 6.19402 -10.9938    16.1255  2.52619     11.5066  4.43367    74.8653     15.2124     254.865     
1 1 1 31 21 16 o 11 81.1427 5.72547 141.431     24.7603  136.446     20.9575  79.2033    198.342     36.2873     198.342     
1 1 1 31 21 17 o 7  28.2377 7.89386 22.0681     18.5466  15.8385     14.4813  20.6337    107.77      9.44166     107.77      
1 1 1 31 21 18 o 6  33.4463 8.94884 35.2696     20.1388  27.6547     21.4372  12.534     329.949     22.5776     149.949     
1 1 1 31 21 19 o 2  19.5061 6.38263 -7.46982    17.4333  -0.346313   12.4495  6.76253    130.068     9.46443     310.068     
1 1 1 31 21 20 o 5  20.0734 6.56034 1.49132     17.5938  -4.4806     12.9057  8.06933    33.7273     6.96812     213.727     
1 1 1 31 21 21 o 4  22.6071 7.02927 2.41264     17.8408  8.39776     13.5647  12.0811    54.1196     2.98676     54.1196     
1 1 1 31 21 22 o 1  21.5162 6.92991 4.37663     19.4164  0.769948    13.1544  10.3155    118.201     1.76161     118.201     
1 1 1 31 21 23 o 7  22.5422 6.75169 -19.6885    18.265   18.1709     13.6921  11.8672    33.0942     2.95847     33.0942     
1 1 1 31 21 24 o 7  31.8368 7.83225 13.5242     19.5861  37.7793     15.4451  20.4886    269.958     2.06136     89.9584     
1 1 1 31 21 25 o 4  23.9593 7.31442 24.8067     18.7408  -4.40568    14.1083  13.1432    84.8765     0.255863    84.8765     
1 1 1 31 21 26 o 17 30.9201 8.31354 29.8837     21.236   26.866      15.1188  22.6513    126.635     9.08869     126.635     
1 1 1 31 21 27 o 11 26.5134 7.82955 27.1538     19.746   10.8996     14.8224  14.6627    57.7621     5.66856     57.7621     
1 1 1 31 21 28 o 15 47.9886 8.45514 57.6544     24.0034  76.1441     18.4739  45.6317    47.793      25.9385     47.793      
1 1 1 31 21 29 o 11 16.5284 5.66654 -21.9318    17.752   -6.98183    12.252   0.663038   357.921     14.4624     177.921     
1 1 1 31 21 30 o 2  31.1108 8.36725 33.5402     20.4149  28.9058     15.9536  17.5232    237.222     4.95503     57.2219     
1 1 1 31 21 31 o 16 18.0098 6.09019 -7.21443    17.9534  -5.77286    12.9071  2.88442    130.162     6.8043      310.162     
1 1 1 31 21 32 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 21 33 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 21 34 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 22 0  o 15 21.6006 9.30268 14.7191     18.9182  14.7191     18.9182  9.88799    360         12.203      180         
1 1 1 31 22 1  o 4  51.2488 8.15102 77.0292     20.9443  55.7292     20.1289  43.7932    19.373      11.9043     19.373      
1 1 1 31 22 2  o 9  39.533  8.74316 49.4324     19.6877  36.7513     19.1845  26.7251    359.112     3.70136     179.112     
1 1 1 31 22 3  o 13 33.2497 8.10982 43.2354     18.0522  13.2409     17.9361  21.0925    163.26      4.73875     343.26      
1 1 1 31 22 4  o 17 70.6009 8.06454 125.447     32.4544  117.123     19.8183  72.2024    221.571     38.6271     221.571     
1 1 1 31 22 5  o 15 34.8872 8.15611 46.6181     19.5469  19.691      14.3336  20.4952    312.509     9.01807     132.509     
1 1 1 31 22 6  o 1  75.3908 6.2594  122.481     25.3698  126.887     20.0714  67.3979    69.3643     20.3918     69.3643     
1 1 1 31 22 7  o 11 27.1744 7.77129 19.1144     18.8291  15.1951     14.0517  16.3483    352.929     3.32588     172.929     
1 1 1 31 22 8  o 11 34.973  8.13371 26.4204     20.3628  37.6832     15.0294  19.9195    76.064      10.3542     256.064     
1 1 1 31 22 9  o 4  25.4844 7.34193 26.5352     17.5557  0.516051    12.9379  15.5305    92.6845     1.45841     272.685     
1 1 1 31 22 10 o 18 48.408  9.96497 85.1867     35.8436  64.6918     18.9268  34.3251    177.977     2.34452     357.977     
1 1 1 31 22 11 o 9  44.4675 8.78599 52.0671     24.2557  58.2713     17.9566  28.9301    351.974     7.35517     171.974     
1 1 1 31 22 12 o 9  19.8272 6.53614 -8.8091     19.0435  -0.30334    13.3315  7.82122    119.621     7.51007     299.621     
1 1 1 31 22 13 o 15 27.463  7.87116 33.418      19.9217  3.30253     14.8998  2.66912    300.552     1.82109     300.552     
1 1 1 31 22 14 o 19 31.0177 9.17615 44.0842     33.4673  20.7872     15.6455  20.5756    108.995     0.245113    288.995     
1 1 1 31 22 15 o 14 30.3262 8.25884 24.745      21.2799  25.9231     15.2426  23.0145    20.6632     7.80374     20.6632     
1 1 1 31 22 16 f 0  37.4386 9.40666 55.5735     22.8445  35.4977     22.7293  24.6355    77.5579     0           0           
1 1 1 31 22 17 o 3  23.6197 7.49393 19.6556     19.4399  -9.50331    19.0915  12.6856    153.313     3.14567     153.313     
1 1 1 31 22 18 o 8  26.9701 7.62678 5.79146     20.5801  25.1279     14.5661  17.7756    239.77      3.57078     239.77      
1 1 1 31 22 19 o 15 33.0117 8.22187 23.3188     21.6395  38.9414     15.8867  26.1919    320.888     10.7262     320.888     
1 1 1 31 22 20 o 18 19.7879 6.42593 -20.7881    19.0682  8.06839     13.4768  7.16119    229.867     5.17417     49.8665     
1 1 1 31 22 21 o 16 24.6357 7.57107 26.0835     20.1881  2.81917     14.4473  11.2753    279.597     3.88479     279.597     
1 1 1 31 22 22 o 5  21.4731 6.766   -15.4371    19.4061  14.4439     14.1666  7.11428    320.712     0.452936    320.712     
1 1 1 31 22 23 o 14 21.0353 6.94218 1.62837     22.6504  2.36918     13.6438  2.08445    300.519     0.168571    300.518     
1 1 1 31 22 24 o 12 19.4041 6.34756 -23.2369    19.8389  7.84812     13.2713  5.37873    79.8424     6.36252     259.842     
1 1 1 31 22 25 o 9  23.1492 7.41517 25.2811     21.5751  -2.7961     14.7173  8.84676    274.414     0.105178    274.414     
1 1 1 31 22 26 o 1  21.6837 7.00978 4.80502     20.4366  6.892       14.1781  6.9923     126.306     2.03878     306.306     
1 1 1 31 22 27 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 22 28 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 22 29 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 22 30 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 23 0  o 12 22.5907 10.4553 18.0029     29.3214  18.0029     29.3214  3.66571    180         27.1401     360         
1 1 1 31 23 1  o 7  26.1021 8.64918 8.47996     28.4252  16.1865     28.5175  16.0228    216.933     4.10863     216.933     
1 1 1 31 23 2  o 10 22.8715 7.83573 -3.75775    26.9148  -10.2612    28.7636  8.69595    46.937      11.6257     226.937     
1 1 1 31 23 3  o 6  28.1971 9.1827  2.71576     31.4508  38.3509     30.4003  18.1629    107.958     1.73799     107.958     
1 1 1 31 23 4  o 2  28.1971 9.00991 -8.19622    29.3135  44.3962     28.7586  18.7229    243.342     7.15411     243.342     
1 1 1 31 23 5  o 17 24.4584 8.37447 3.22219     35.2787  -1.6551     27.7324  11.1962    110.657     8.41055     290.657     
1 1 1 31 23 6  o 17 25.9519 9.04994 9.7112      38.6631  -10.1054    47.4873  13.6929    250.026     4.91135     250.026     
1 1 1 31 23 7  o 18 22.4062 7.58922 -18.8306    35.4296  3.65338     17.6609  10.7812    53.2731     2.73747     233.273     
1 1 1 31 23 8  o 2  34.0958 10.3671 89.2189     102.642  53.4088     24.4692  17.6261    291.029     12.2834     111.029     
1 1 1 31 23 9  o 9  20.8989 7.35756 -2.58161    35.1644  -21.1168    18.7829  6.59199    165.539     0.359843    165.539     
1 1 1 31 23 10 o 2  22.2876 7.56093 -3.8066     37.5753  2.64805     13.9842  9.22456    1.99571     1.1113      1.9957      
1 1 1 31 23 11 o 9  46.468  9.07717 68.8228     25.8459  66.1206     18.9873  37.4482    171.702     7.89569     171.702     
1 1 1 31 23 12 o 19 20.9887 6.88195 4.19886     19.8941  0.958683    14.4195  1.60334    19.5542     24.1738     199.554     
1 1 1 31 23 13 o 19 23.073  7.32413 27.6035     20.0258  -21.4144    18.2773  5.45241    159.388     1.83301     159.388     
1 1 1 31 23 14 o 18 30.3339 8.47837 40.8224     22.1452  21.2776     15.8459  18.2458    206.61      3.4058      26.6097     
1 1 1 31 23 15 o 14 19.5186 6.53188 2.70303     19.4523  -5.64978    13.6002  3.63191    165.924     0.794626    345.924     
1 1 1 31 23 16 o 1  19.6693 6.52251 -7.65466    19.9524  2.59297     13.6007  5.59051    10.644      2.81166     190.644     
1 1 1 31 23 17 o 13 24.898  7.92674 27.8217     21.8442  0.703026    20.8596  7.29074    256.742     2.61461     256.742     
1 1 1 31 23 18 o 14 22.7379 7.22227 -1.49456    21.6627  14.9832     15.3116  1.79369    256.129     0.414112    256.129     
1 1 1 31 23 19 o 19 20.3327 6.77206 7.52202     20.5571  -3.78024    14.1601  5.45365    326.264     2.68221     146.264     
1 1 1 31 23 20 f 0  21.7768 7.11292 16.3433     21.3483  -0.51331    13.9403  5.1418     77.796      0           0           
1 1 1 31 23 21 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 23 22 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 23 23 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 23 24 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 24 0  x 5  ?       ?       ?           ?        ?           ?        0.649914   180.001     0           0           
1 1 1 31 24 1  o 2  25.9197 12.7128 20.6419     39.8348  0           0        5.17074    260.521     0.133803    80.5213     
1 1 1 31 24 2  o 10 23.6629 8.3784  -4.10445    37.3915  -9.3319     47.7336  10.2495    216.604     4.33661     36.6039     
1 1 1 31 24 3  o 2  26.4686 9.24512 47.6618     44.2874  -0.0036451  45.529   3.90774    86.9584     1.65489     86.9584     
1 1 1 31 24 4  o 18 25.2757 8.924   -14.5023    38.7669  45.5457     49.4984  12         118.127     0.391061    118.127     
1 1 1 31 24 5  o 4  33.4671 11.1713 56.7143     46.2674  135.335     51.7655  9.59702    262.893     27.7387     82.8929     
1 1 1 31 24 6  o 10 27.2835 9.50767 32.4217     45.2906  42.2463     47.2745  13.0543    55.5566     3.75606     55.5566     
1 1 1 31 24 7  o 5  30.056  14.6399 0           0        71.2214     50.2117  9.74838    38.1524     1.22545     38.1524     
1 1 1 31 24 8  o 1  28.0729 13.7367 46.0077     45.6904  0           0        5.03163    151.496     0.519605    151.496     
1 1 1 31 24 9  o 11 23.5831 8.37864 -1.20664    40.7865  -17.0688    48.0453  7.97988    325.571     0.208104    325.571     
1 1 1 31 24 10 x 7  ?       ?       ?           ?        ?           ?        12.4959    171.695     0           0           
1 1 1 31 24 11 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 24 12 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 24 13 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 24 14 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 24 15 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 31 24 16 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 0  0  o 9  311.105 4.76526 1719.76     74.2154  1719.76     74.2154  251.808    360         40.6577     360         
1 1 1 32 0  1  o 15 16.9552 6.38983 7.34388     7.37038  7.34388     7.37038  37.5884    240         83.1432     240         
1 1 1 32 0  2  o 16 114.497 2.62891 233.215     15.0485  233.215     15.0485  123.713    120         83.4134     120         
1 1 1 32 0  3  o 4  271.974 3.24054 1313.49     44.1395  1313.49     44.1395  194.963    360         14.6997     180         
1 1 1 32 0  4  o 8  347.406 3.74129 2143.77     65.1016  2143.77     65.1016  275.905    60          35.0618     60          
1 1 1 32 0  5  o 7  93.4083 3.33315 155.992     15.5116  155.992     15.5116  40.2425    120         58.3379     300         
1 1 1 32 0  6  o 17 311.717 3.54378 1725.82     55.3268  1725.82     55.3268  244.997    180         26.5872     180         
1 1 1 32 0  7  o 11 93.2771 2.78633 155.141     12.9717  155.141     12.9717  60.3134    60          17.6253     240         
1 1 1 32 0  8  o 1  75.4711 3.21483 102.154     12.057   102.154     12.057   29.1705    300         53.0738     120         
1 1 1 32 0  9  o 8  22.5365 6.7831  12.8331     7.78471  12.8331     7.78471  34.3144    360         85.0746     360         
1 1 1 32 0  10 o 14 147.515 2.72683 386.748     20.1272  386.748     20.1272  67.8355    60          83.2417     240         
1 1 1 32 0  11 o 13 113.657 2.58462 229.807     14.687   229.807     14.687   126.405    120         88.513      120         
1 1 1 32 0  12 o 2  260.816 3.01946 1207.84     39.4423  1207.84     39.4423  213.583    180         40.5844     180         
1 1 1 32 0  13 o 18 23.3596 6.8454  13.6471     7.96974  13.6471     7.96974  6.05792    59.9999     16.7049     59.9999     
1 1 1 32 0  14 o 4  12.893  5.68014 1.83631     7.44082  1.83631     7.44082  25.749     300         55.4544     300         
1 1 1 32 0  15 o 9  77.432  2.91171 107.271     11.2253  107.271     11.2253  26.4992    4.86131e-07 61.4052     180         
1 1 1 32 0  16 o 2  136.514 2.59512 331.274     17.725   331.274     17.725   92.3686    60          16.9787     240         
1 1 1 32 0  17 o 1  81.2651 3.09381 118.213     12.5157  118.213     12.5157  59.0209    120         1.08258     300         
1 1 1 32 0  18 o 4  57.7289 3.57782 60.5264     10.1599  60.5264     10.1599  20.8623    180         8.82149     180         
1 1 1 32 0  19 o 9  169.912 2.64519 512.926     22.4992  512.926     22.4992  176.262    60          102.186     60          
1 1 1 32 0  20 o 13 270.691 3.09721 1301.68     41.9903  1301.68     41.9903  185.102    120         28.1847     300         
1 1 1 32 0  21 o 5  26.7549 6.70235 16.7824     8.17305  16.7824     8.17305  35.9229    180         103.357     180         
1 1 1 32 0  22 o 16 149.718 2.69395 398.527     20.1831  398.527     20.1831  136.178    60          52.5201     60          
1 1 1 32 0  23 o 3  35.0515 6.51693 25.9519     9.89023  25.9519     9.89023  7.7972     120         56.6051     120         
1 1 1 32 0  24 o 1  46.2037 4.64638 40.2171     10.1306  40.2171     10.1306  18.0394    180         18.7336     8.37325e-06 
1 1 1 32 0  25 o 19 65.9875 3.61403 78.764      11.7819  78.764      11.7819  6.17482    59.9996     4.33814     59.9996     
1 1 1 32 0  26 o 5  90.3378 2.95768 145.838     13.3244  145.838     13.3244  86.0394    120         40.9389     120         
1 1 1 32 0  27 o 6  130.371 2.82466 302.628     18.4154  302.628     18.4154  104.595    3.18472e-06 19.0537     3.18472e-06 
1 1 1 32 0  28 o 19 73.2788 3.57884 96.8328     12.9962  96.8328     12.9962  69.7161    60          41.3191     60          
1 1 1 32 0  29 o 16 75.5544 3.52286 102.824     13.2038  102.824     13.2038  46.3931    300         16.953      120         
1 1 1 32 0  30 f 0  58.681  4.08181 63.0706     11.7181  63.0706     11.7181  82.8468    180         0           0           
1 1 1 32 0  31 o 1  136.601 2.83587 332.364     19.3754  332.364     19.3754  100.022    240         2.09439     240         
1 1 1 32 0  32 o 10 24.1229 7.12236 14.7147     8.61327  14.7147     8.61327  28.5321    120         85.1049     120         
1 1 1 32 0  33 o 14 62.5988 3.49745 71.0362     10.8097  71.0362     10.8097  45.4001    360         29.8664     360         
1 1 1 32 0  34 o 3  173.832 2.67508 537.693     23.2789  537.693     23.2789  160.376    60          70.2053     60          
1 1 1 32 0  35 o 10 27.5807 6.77029 17.8008     8.44537  17.8008     8.44537  0.824824   300         11.8046     300         
1 1 1 32 0  36 o 9  17.3823 6.60967 7.80294     7.94953  7.80294     7.94953  0.938533   8.65137e-06 2.56408     8.65137e-06 
1 1 1 32 0  37 o 16 29.8953 6.66839 20.1707     8.77774  20.1707     8.77774  1.84596    60          30.0831     240         
1 1 1 32 0  38 o 17 16.6662 6.55919 6.90229     8.11686  6.90229     8.11686  5.45584    300         16.6799     300         
1 1 1 32 0  39 o 14 39.5237 5.61328 31.158      9.85876  31.158      9.85876  25.4963    1.83397e-06 2.46412     180         
1 1 1 32 0  40 o 2  91.0935 3.42457 149.219     15.5318  149.219     15.5318  26.9367    60          75.8198     240         
1 1 1 32 0  41 o 9  19.0319 7.19975 9.53571     9.38837  9.53571     9.38837  1.61622    300         15.3621     300         
1 1 1 32 0  42 o 10 47.586  5.72382 44.1455     12.4645  44.1455     12.4645  34.8711    180         2.63952     180         
1 1 1 32 0  43 f 0  28.0597 7.81171 19.7228     10.5416  19.7228     10.5416  8.7858     60          0           0           
1 1 1 32 0  44 o 11 121.98  3.1313  266.557     19.0841  266.557     19.0841  120.706    300         69.3502     300         
1 1 1 32 0  45 o 13 62.347  3.9278  71.2993     12.0377  71.2993     12.0377  46.7847    4.88311e-06 5.84248     4.88311e-06 
1 1 1 32 0  46 o 1  38.3552 6.03688 30.2199     10.1392  30.2199     10.1392  30.9156    240         12.7302     240         
1 1 1 32 0  47 o 8  43.8373 5.04756 37.2757     10.2067  37.2757     10.2067  33.2305    120         5.51339     120         
1 1 1 32 0  48 o 4  9.5103  4.67703 -6.84742    7.9102   -6.84742    7.9102   5.84919    180         14.2374     180         
1 1 1 32 0  49 o 10 15.5329 6.51746 5.14267     8.81469  5.14267     8.81469  0.0657072  240.001     0.416626    240.001     
1 1 1 32 0  50 o 14 19.7359 7.26605 10.6237     9.35689  10.6237     9.35689  1.18544    300         24.6822     300         
1 1 1 32 0  51 o 8  15.8834 6.54755 5.83331     8.62859  5.83331     8.62859  3.40846    360         19.735      360         
1 1 1 32 0  52 o 18 25.9281 7.4441  17.2592     9.4756   17.2592     9.4756   9.13766    60          53.9584     60          
1 1 1 32 0  53 o 18 68.9023 3.74573 86.8833     12.7535  86.8833     12.7535  43.9763    120         6.9225      300         
1 1 1 32 0  54 o 12 35.2462 6.49028 26.8597     9.90534  26.8597     9.90534  24.1011    180         0.137001    180         
1 1 1 32 0  55 o 18 53.548  4.32425 53.9256     11.213   53.9256     11.213   24.5998    240         24.0946     60          
1 1 1 32 0  56 o 11 15.1213 6.63349 3.69248     10.0402  3.69248     10.0402  0.501345   120         7.44827     300         
1 1 1 32 0  57 o 11 17.6131 7.23078 7.81856     10.4541  7.81856     10.4541  2.62206    9.00578e-06 2.75127     180         
1 1 1 32 0  58 o 4  13.7088 6.29619 0.432105    10.3462  0.432105    10.3462  1.33773    240         11.9923     240         
1 1 1 32 0  59 o 2  26.3688 8.19875 19.2775     11.3351  19.2775     11.3351  10.5073    120         5.34422     120         
1 1 1 32 0  60 o 1  61.4991 4.46088 71.3954     13.3887  71.3954     13.3887  55.3221    360         27.7944     360         
1 1 1 32 0  61 o 19 10.7633 5.36608 -11.934     11.5016  -11.934     11.5016  4.19409    60          13.1615     60          
1 1 1 32 0  62 o 14 40.9294 6.23111 35.2055     11.2157  35.2055     11.2157  20.5583    300         13.641      120         
1 1 1 32 0  63 o 5  14.3463 6.46781 2.24337     10.2833  2.24337     10.2833  7.84757    180         30.2177     180         
1 1 1 32 0  64 o 12 18.9216 7.70678 9.81426     11.732   9.81426     11.732   2.18315    240         1.92196     60          
1 1 1 32 0  65 o 18 23.1788 8.3475  16.0103     12.1742  16.0103     12.1742  5.40045    300         1.72167     300         
1 1 1 32 0  66 o 13 13.056  6.21898 -3.29371    11.6972  -3.29371    11.6972  0.391308   180         5.40315     180         
1 1 1 32 0  67 o 13 21.4774 8.76853 13.6506     15.2418  13.6506     15.2418  8.56303    60          6.80419     240         
1 1 1 32 0  68 o 10 29.5695 9.66754 26.7419     15.7914  26.7419     15.7914  21.2033    120         9.0174      120         
1 1 1 32 0  69 o 17 23.5179 9.16574 17.98       15.6732  17.98       15.6732  1.24108    180         0.386177    180         
1 1 1 32 0  70 o 15 32.2457 9.9652  32.0536     16.7518  32.0536     16.7518  22.4224    60          10.1086     60          
1 1 1 32 0  71 o 14 17.1656 7.80023 5.25201     15.3267  5.25201     15.3267  0.49988    300         6.3803      120         
1 1 1 32 0  72 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 0  73 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 1  0  o 13 80.7974 2.90679 116.704     11.7     116.704     11.7     71.9275    180         31.2516     180         
1 1 1 32 1  1  o 1  202.24  2.74816 706.153     27.8399  746.698     27.8498  159.333    26.6685     22.6983     26.6685     
1 1 1 32 1  2  o 14 181.386 2.73863 583.136     25.3795  585.299     24.3972  134.895    139.557     5.17971     139.557     
1 1 1 32 1  3  o 18 236.736 2.97378 986.265     34.5585  1004.92     35.9986  173.281    203.776     1.95074     23.7756     
1 1 1 32 1  4  o 11 26.3366 5.65851 12.1098     7.87668  12.8264     8.37748  8.87443    8.08584     27.3514     8.08584     
1 1 1 32 1  5  o 1  196.195 2.89246 697.357     29.7932  670.204     27.0648  102.999    263.88      82.3206     83.8797     
1 1 1 32 1  6  o 5  105.694 2.69651 190.315     13.9277  207.105     14.5922  53.3918    193.019     43.3046     13.0186     
1 1 1 32 1  7  o 4  41.0346 4.41634 27.7051     8.58062  33.8139     8.97892  8.31239    301.562     63.0401     301.562     
1 1 1 32 1  8  o 9  186.922 2.76477 628.035     26.4705  613.066     25.3252  128.664    14.7127     15.9945     194.713     
1 1 1 32 1  9  o 6  24.6437 5.5766  9.33982     7.79433  11.8459     7.82664  9.75195    280.117     28.5308     280.117     
1 1 1 32 1  10 o 18 191.734 2.70192 655.477     25.9344  650.276     25.9882  135.033    266.412     10.2282     86.4124     
1 1 1 32 1  11 o 13 38.1357 4.98612 31.3048     9.53192  22.5948     8.81025  4.91627    270.205     47.6827     270.205     
1 1 1 32 1  12 f 0  59.0446 3.35157 60.494      9.83915  64.3341     9.82019  28.6158    91.2611     0           0           
1 1 1 32 1  13 o 17 157.212 2.61214 452.037     20.6003  426.06      20.5473  141.264    128.138     57.0882     128.138     
1 1 1 32 1  14 o 15 154.159 2.6358  421.464     20.3773  422.782     20.3486  101.2      147.608     20.8222     327.608     
1 1 1 32 1  15 o 7  70.6106 3.16171 92.0485     11.3911  86.041      10.8719  38.5175    245.439     15.0394     65.4394     
1 1 1 32 1  16 o 5  45.4147 4.17478 46.9663     9.0538   28.9267     9.01236  1.72988    306.387     50.0499     126.387     
1 1 1 32 1  17 o 4  45.1194 4.22987 33.8371     9.51499  40.1929     9.01437  6.85009    36.6154     36.4447     216.615     
1 1 1 32 1  18 f 0  154.223 2.73851 414.353     20.1413  431.434     22.1557  138.691    250.262     0           0           
1 1 1 32 1  19 o 4  252.072 3.13863 1157.12     39.6826  1104.17     39.5995  194.437    257.429     20.4081     257.429     
1 1 1 32 1  20 o 19 174.876 2.68945 541.706     23.5611  545.428     23.5782  158.18     296.622     64.8214     296.622     
1 1 1 32 1  21 o 9  27.245  5.45668 8.36755     8.08251  18.5855     8.10193  25.7116    1.58845     78.5974     1.58845     
1 1 1 32 1  22 o 13 160.731 2.69395 459.166     21.1451  459.492     22.2404  140.499    271.175     50.7728     271.175     
1 1 1 32 1  23 o 6  85.712  2.99176 134.275     12.8768  127.89      12.7423  63.0107    298.696     10.6037     298.696     
1 1 1 32 1  24 o 5  132.201 2.85121 319.197     19.4002  303.439     18.3378  97.9366    204.236     7.70695     204.236     
1 1 1 32 1  25 o 19 44.3859 4.91639 45.8023     9.78246  27.6272     10.6816  15.7388    3.05702     5.95283     183.057     
1 1 1 32 1  26 o 12 54.8864 4.1844  52.8184     11.2993  56.2589     11.3474  8.58707    123.36      55.1866     303.36      
1 1 1 32 1  27 o 17 142.087 3.02213 361.071     21.5295  359.01      21.4603  90.5665    97.9403     22.2745     277.94      
1 1 1 32 1  28 o 2  156.21  3.02586 435.055     23.6679  435.446     23.6625  118.643    310.444     13.8597     310.444     
1 1 1 32 1  29 o 10 97.8952 3.26585 180.347     16.1261  162.726     15.8097  81.7254    314.455     29.7612     314.455     
1 1 1 32 1  30 o 14 34.0773 5.96239 26.5437     9.85168  17.203      10.6777  3.95489    284.865     13.4623     104.865     
1 1 1 32 1  31 f 0  26.5614 5.92541 13.7978     8.83937  11.6111     8.82603  35.0971    96.8456     0           0           
1 1 1 32 1  32 o 6  85.135  2.96177 123.69      12.1589  135.733     13.0412  58.7896    195.409     2.01382     195.409     
1 1 1 32 1  33 o 11 74.7661 3.04487 111.435     11.2934  89.453      11.3147  55.9793    74.5446     14.3085     74.5446     
1 1 1 32 1  34 o 17 17.9809 5.25838 1.19586     7.77121  2.36532     7.68002  13.4623    181.936     36.5023     181.936     
1 1 1 32 1  35 o 1  82.652  2.99493 112.802     12.0553  132.313     12.6521  51.7159    128.087     10.3116     308.087     
1 1 1 32 1  36 o 14 61.14   3.74518 69.6979     11.0712  65.5859     11.6167  45.9731    225.714     12.9638     225.714     
1 1 1 32 1  37 f 0  117.07  2.92251 255.915     16.6321  234.897     17.5294  101.232    316.728     0           0           
1 1 1 32 1  38 f 0  39.1475 5.4295  34.0662     10.3924  24.1138     10.1298  34.2528    123.265     0           0           
1 1 1 32 1  39 o 13 38.8671 5.75612 27.3936     10.8544  30.1521     10.8511  19.0381    195.691     10.0218     15.6912     
1 1 1 32 1  40 o 18 22.7212 5.96299 13.9022     10.1197  -1.72626    9.47564  0.79039    192.793     18.7166     12.7932     
1 1 1 32 1  41 o 17 69.5097 3.93605 90.9646     12.4778  84.9133     14.5269  52.6765    241.131     10.8556     241.131     
1 1 1 32 1  42 o 19 72.5085 3.86069 95.7486     14.6148  95.5528     13.195   39.1097    4.37599     21.7978     184.376     
1 1 1 32 1  43 o 18 54.4896 4.31241 60.1047     11.245   49.5639     11.7276  44.6848    232.241     19.1819     232.241     
1 1 1 32 1  44 f 0  99.6102 3.03576 178.671     14.9293  178.829     15.3055  53.8893    68.9258     0           0           
1 1 1 32 1  45 o 14 103.164 3.01534 181.751     15.89    202.097     15.1339  72.0329    164.369     0.886007    164.369     
1 1 1 32 1  46 o 18 65.9049 3.60802 77.0774     11.9989  81.2795     11.6262  51.5176    307.447     14.5143     307.447     
1 1 1 32 1  47 o 10 40.4472 5.1041  33.4375     10.1925  28.9555     9.73725  23.1943    258.951     4.59558     78.9505     
1 1 1 32 1  48 o 2  49.6497 4.28317 48.4506     10.3228  43.1867     10.5     38.3187    194.171     13.0855     194.171     
1 1 1 32 1  49 o 18 42.9962 4.79136 40.4203     9.96674  29.8179     9.8427   22.6661    206.034     10.2404     26.0338     
1 1 1 32 1  50 o 16 31.9894 6.30718 20.2397     10.8477  20.2334     10.1392  18.0308    309.457     1.12674     309.457     
1 1 1 32 1  51 o 18 47.9186 4.64606 41.8273     10.8911  44.6855     10.8207  24.2042    196.895     14.8763     16.8955     
1 1 1 32 1  52 o 13 94.8352 3.17799 149.994     14.5891  177.372     15.5147  78.9804    299.267     28.9532     299.267     
1 1 1 32 1  53 o 9  102.13  3.02059 185.42      15.5253  193.282     15.3154  82.8199    333.792     26.5342     333.792     
1 1 1 32 1  54 o 11 34.6797 5.85687 21.5401     10.1068  26.6749     10.0251  11.4902    43.3909     21.4442     223.391     
1 1 1 32 1  55 o 9  67.6833 3.69096 88.7726     12.4572  80.9771     12.3692  49.3451    132.702     8.14828     132.702     
1 1 1 32 1  56 o 7  34.0228 6.06741 26.0178     10.5682  21.4099     10.157   24.5242    225.817     10.0622     225.817     
1 1 1 32 1  57 o 5  43.6014 5.32906 31.1888     11.2742  44.4855     10.9201  25.4094    328.32      5.4174      148.32      
1 1 1 32 1  58 o 13 26.686  6.44556 7.59598     11.76    18.9797     10.1615  9.64772    96.4383     11.7112     276.438     
1 1 1 32 1  59 o 2  17.034  5.47417 -1.06628    10.8931  -6.26978    9.46407  1.4948     348.928     9.60188     168.928     
1 1 1 32 1  60 o 8  22.5415 6.30478 2.99018     11.6392  10.9249     10.1197  6.34754    9.32135     0.276758    189.321     
1 1 1 32 1  61 o 11 30.3285 6.97449 21.6361     12.2961  17.8773     12.0554  13.9826    156.021     6.59163     336.021     
1 1 1 32 1  62 o 5  26.6208 6.87086 6.76194     12.8747  19.612      12.1106  9.47274    130.658     9.51786     310.658     
1 1 1 32 1  63 o 10 23.2069 6.79105 8.50108     12.1674  5.16499     13.7619  3.13748    203.023     19.2826     23.0226     
1 1 1 32 1  64 o 9  42.7186 6.80596 51.0162     13.4997  28.2659     15.5509  25.9301    103.829     1.25476     283.829     
1 1 1 32 1  65 o 11 38.8713 7.37558 42.7428     14.5367  25.1575     15.8887  28.6812    127.83      11.8208     127.83      
1 1 1 32 1  66 o 5  35.0691 8.25766 28.887      15.4462  30.0675     18.6843  22.6323    225.598     5.20809     225.598     
1 1 1 32 1  67 o 8  47.091  7.26581 60.8045     16.4871  40.278      17.0603  29.9575    331.931     1.30136     331.931     
1 1 1 32 1  68 o 11 28.1902 7.72529 19.3032     15.5907  15.9309     15.6109  11.6716    328.928     7.65753     148.928     
1 1 1 32 1  69 o 19 21.8873 6.72126 14.7865     14.8132  -12.9117    14.971   5.62752    297.404     3.01903     117.404     
1 1 1 32 1  70 o 4  20.2523 6.54591 -4.15015    14.7361  2.24325     15.0509  2.54718    232.33      3.54471     52.3298     
1 1 1 32 1  71 o 11 22.4814 7.04545 7.40535     15.8749  3.5279      15.6779  4.00814    121.797     3.8739      301.797     
1 1 1 32 1  72 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 2  0  o 10 53.7262 3.56359 52.5863     9.38948  52.5863     9.38948  2.92423    179.998     0.961886    179.998     
1 1 1 32 2  1  f 0  99.4619 2.76946 182.327     13.4655  169.8       14.0478  72.4566    143.755     0           0           
1 1 1 32 2  2  o 16 179.545 2.67317 571.563     24.0407  573.564     24.0641  157.086    354.042     52.626      354.042     
1 1 1 32 2  3  o 19 18.5114 5.23715 -1.77283    7.60298  6.14804     7.67664  52.4084    135.592     120.912     135.592     
1 1 1 32 2  4  f 0  30.5457 5.56966 14.1653     8.62947  20.5137     8.67877  17.5759    110.161     0           0           
1 1 1 32 2  5  o 6  195.357 2.73032 669.377     26.7153  686.614     26.7423  156.447    331.847     26.6509     331.847     
1 1 1 32 2  6  o 15 29.2398 5.46298 20.3983     8.4378   11.3121     8.1413   23.1651    130.371     74.6139     130.371     
1 1 1 32 2  7  o 16 126.487 2.73558 285.598     17.3366  283.412     17.3032  80.2668    115.138     21.5899     295.138     
1 1 1 32 2  8  o 3  124.407 2.68332 281.315     16.299   269.163     17.0871  70.4752    77.9271     38.4568     257.927     
1 1 1 32 2  9  o 6  104.809 2.71496 199.084     14.2161  191.811     14.2515  83.9515    274.563     22.358      274.563     
1 1 1 32 2  10 o 6  149.485 2.62088 405.032     19.612   389.227     19.6332  99.4843    73.9223     18.1052     253.922     
1 1 1 32 2  11 o 3  174.641 2.67639 550.626     23.4415  533.248     23.4019  145.059    250.538     36.1336     250.538     
1 1 1 32 2  12 o 7  85.9384 2.80671 123.655     12.0032  139.676     12.0766  62.051     223.081     8.19351     223.081     
1 1 1 32 2  13 o 12 62.2327 3.27057 67.1612     10.0694  71.4615     10.1801  37.137     308.363     0.628598    308.363     
1 1 1 32 2  14 o 18 72.0463 3.0256  94.7942     10.8375  90.5131     10.9057  49.2577    68.7975     6.72712     68.7975     
1 1 1 32 2  15 o 9  101.824 2.75817 185.375     14.3228  183.768     13.7707  87.2806    343.089     35.1611     343.089     
1 1 1 32 2  16 o 9  158.79  2.70662 451.522     21.0289  444.876     22.0275  164.579    329.123     103.435     329.123     
1 1 1 32 2  17 o 16 171.042 2.7848  509.968     24.8453  530.505     22.8033  104.625    30.1949     39.9787     210.195     
1 1 1 32 2  18 o 1  168.196 3.064   511.436     23.53    495.959     27.8358  121.854    113.11      0.451801    293.111     
1 1 1 32 2  19 o 7  121.654 2.77644 279.741     16.7569  247.714     16.989   107.909    186.325     44.7668     186.325     
1 1 1 32 2  20 o 7  108.896 2.65221 216.848     14.0435  205.447     14.8203  101.325    149.061     53.1271     149.061     
1 1 1 32 2  21 o 5  178.292 3.01356 574.692     27.5918  557.291     26.2593  145.851    119.079     33.4986     119.079     
1 1 1 32 2  22 o 4  99.0344 3.0727  182.785     15.6273  167.434     14.8012  66.4497    90.7752     5.93995     270.775     
1 1 1 32 2  23 o 2  73.8101 3.4967  91.9878     13.3188  103.468     12.2736  38.7099    167.199     23.0777     347.199     
1 1 1 32 2  24 o 1  51.7073 4.50374 47.3348     10.9463  49.9972     11.9007  27.8273    137.858     7.61281     137.858     
1 1 1 32 2  25 o 17 129.386 2.9544  302.849     18.5167  294.369     19.7068  93.3214    235.137     1.9293      235.137     
1 1 1 32 2  26 o 17 86.5246 2.98579 136.03      12.4437  131.516     13.3365  52.1693    291.323     15.5948     111.323     
1 1 1 32 2  27 o 3  56.3718 3.46463 57.4794     9.51277  56.9349     9.86246  36.3257    146.32      9.59847     146.32      
1 1 1 32 2  28 o 17 156.957 2.77472 444.662     20.8063  433.754     22.751   147.056    126.044     70.7608     126.044     
1 1 1 32 2  29 o 16 105.311 2.80889 197.803     14.3674  198.213     15.2158  71.1628    243.941     5.45688     63.9407     
1 1 1 32 2  30 f 0  161.388 2.82035 461.661     21.6038  467.733     23.9485  80.876     80.4685     0           0           
1 1 1 32 2  31 o 16 47.3692 4.33633 43.352      9.15254  38.7789     10.7284  24.3395    240.818     0.505121    240.817     
1 1 1 32 2  32 o 4  129.095 2.78148 294.707     16.9393  300.527     18.9676  82.1615    88.5203     19.2839     268.52      
1 1 1 32 2  33 o 8  210.39  3.09176 788.729     30.7657  794.03      34.3407  150.194    171.787     2.03238     351.787     
1 1 1 32 2  34 o 10 19.1413 5.21499 12.6451     9.30855  -25.7895    9.88752  18.0216    123.792     54.1815     123.792     
1 1 1 32 2  35 o 18 38.7884 5.88725 39.3539     10.6229  18.4898     11.8574  19.4801    18.8945     6.26269     198.895     
1 1 1 32 2  36 o 18 71.7974 3.94026 93.1532     13.3092  93.7158     14.7833  57.9273    16.5648     17.4733     16.5648     
1 1 1 32 2  37 o 7  55.0579 4.36961 51.6654     11.746   59.6028     11.9048  44.8257    287.512     18.192      287.512     
1 1 1 32 2  38 o 19 75.5616 3.68865 83.6471     13.9747  125.097     13.1159  60.0564    314.396     16.0792     314.396     
1 1 1 32 2  39 o 1  88.4931 3.24933 134.881     15.0349  147.416     13.5504  70.6494    194.971     18.1524     194.971     
1 1 1 32 2  40 o 1  63.9226 3.76863 73.8405     12.0576  74.8499     11.865   56.7612    182.245     28.7294     182.245     
1 1 1 32 2  41 o 17 69.0809 3.42839 84.0774     11.8386  88.881      11.7372  61.9205    342.814     31.0405     342.814     
1 1 1 32 2  42 o 6  17.7287 5.37703 0.960773    8.73583  -0.630843   8.3837   0.0931822  250.619     1.48981     250.619     
1 1 1 32 2  43 o 18 68.7476 3.34943 85.0221     11.4584  86.3997     11.4792  50.6774    335.717     7.59177     335.717     
1 1 1 32 2  44 o 11 48.8909 4.2503  43.5965     10.0137  44.9703     10.3764  35.7461    193.237     8.18176     193.237     
1 1 1 32 2  45 o 7  104.878 2.99901 206.454     14.9315  190.49      16.407   88.1043    70.5288     30.8096     70.5288     
1 1 1 32 2  46 o 13 50.0012 4.39312 50.4945     10.2893  42.7051     11.0676  27.0307    155.185     12.5481     335.185     
1 1 1 32 2  47 o 13 75.562  3.32425 105.307     12.3951  102.118     12.648   58.7737    335.965     14.6165     335.965     
1 1 1 32 2  48 o 3  93.6277 3.0269  162.014     14.0415  155.063     14.2761  66.4171    349.343     3.87798     349.343     
1 1 1 32 2  49 o 2  45.3598 4.88867 39.6792     10.72    38.3771     10.7996  29.1404    15.4562     0.583591    195.456     
1 1 1 32 2  50 o 14 46.3912 5.09327 37.0354     11.7289  45.3405     10.988   29.2784    35.2175     2.12703     215.218     
1 1 1 32 2  51 o 10 66.8612 3.72744 78.596      12.22    86.0964     12.5492  52.1037    70.0893     14.1366     70.0893     
1 1 1 32 2  52 o 2  60.7639 3.94061 65.653      11.9869  71.5014     11.7078  51.2749    148.288     21.7686     148.288     
1 1 1 32 2  53 o 2  32.0653 6.17856 21.8591     10.4028  19.8611     9.99832  12.1915    245.174     16.0035     65.1745     
1 1 1 32 2  54 o 4  31.4423 6.2352  20.0153     10.3948  20.4121     10.0505  13.3472    315.334     12.44       135.334     
1 1 1 32 2  55 o 19 26.6714 6.06245 21.9485     10.1987  4.61739     9.92344  5.12709    24.4461     22.6117     204.446     
1 1 1 32 2  56 o 13 51.2879 4.67944 51.6753     11.9788  49.7684     11.5166  23.7954    211.108     20.4573     31.1084     
1 1 1 32 2  57 o 9  37.1678 6.17498 25.2483     11.7154  32.2686     10.999   29.1437    295.589     18.1015     295.589     
1 1 1 32 2  58 o 6  20.2665 5.91449 7.01015     9.71555  1.08756     10.0405  2.93834    335.815     15.1068     155.815     
1 1 1 32 2  59 o 9  25.4397 6.30445 2.41535     11.3155  19.7895     10.5889  0.977171   113.848     28.6139     293.848     
1 1 1 32 2  60 o 17 28.1618 6.89686 20.135      12.9234  13.1575     10.869   1.47093    4.73983     0.773681    4.73983     
1 1 1 32 2  61 o 19 31.7241 6.8413  25.3682     12.2294  18.442      11.6656  10.0249    32.8153     18.2265     212.815     
1 1 1 32 2  62 o 17 58.2449 5.36178 82.8615     15.9015  54.0702     14.316   46.8356    199.647     19.2242     199.647     
1 1 1 32 2  63 o 12 43.4026 6.85205 40.4074     15.4552  40.9931     13.6015  21.0468    273.438     13.0009     93.4382     
1 1 1 32 2  64 o 17 25.181  6.84207 16.0967     12.2779  6.06506     12.6756  12.0811    308.627     1.55802     128.627     
1 1 1 32 2  65 f 0  32.1859 7.77698 34.3901     17.6308  14.6424     12.9707  20.6251    222.196     0           0           
1 1 1 32 2  66 o 15 22.5958 6.81576 13.9073     14.6926  -6.35439    13.8936  0.405949   352.922     25.2211     172.922     
1 1 1 32 2  67 o 18 14.5228 5.0792  -19.6937    13.7812  -29.5119    13.4004  0.173297   301.122     6.35787     301.122     
1 1 1 32 2  68 o 12 24.5852 7.16689 20.2542     15.1839  -2.67643    15.502   9.11887    136.838     2.79344     316.838     
1 1 1 32 2  69 o 7  22.091  6.91514 11.3014     15.6371  -4.1845     15.3551  4.80204    110.815     3.70905     290.815     
1 1 1 32 2  70 o 13 24.8344 7.46443 11.5979     16.1809  12.2077     16.2647  7.12575    109.074     5.24884     289.074     
1 1 1 32 2  71 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 3  0  o 13 50.6896 3.802   47.1682     9.3851   47.1682     9.3851   23.4058    180         19.4289     3.58417e-05 
1 1 1 32 3  1  o 8  70.1249 3.05899 83.7031     10.6508  91.9705     10.7293  50.8488    179.766     17.7628     179.766     
1 1 1 32 3  2  o 17 130.188 2.58804 305.049     16.7083  297.688     17.0211  90.4076    239.624     7.38918     59.6235     
1 1 1 32 3  3  o 9  134.841 2.74166 312.802     17.5262  334.186     19.4859  83.7708    280.528     28.4034     100.528     
1 1 1 32 3  4  o 9  273.594 3.12335 1341.38     42.1877  1321.82     43.4399  192.301    89.3907     21.0284     269.391     
1 1 1 32 3  5  o 12 205.02  2.71508 742.367     26.9467  751.686     28.8239  114.879    74.2695     73.065      254.27      
1 1 1 32 3  6  o 6  97.8894 2.61028 167.891     12.41    173.137     13.1526  85.9024    198.046     38.9348     198.046     
1 1 1 32 3  7  o 9  86.859  2.81878 134.158     12.0338  134.647     12.4375  67.2607    292.052     17.3567     292.052     
1 1 1 32 3  8  o 9  86.6344 2.93328 132.613     11.6252  134.944     13.7001  48.1936    316.527     24.5065     136.527     
1 1 1 32 3  9  o 2  53.2071 3.54808 51.7764     8.89458  49.9817     9.75931  7.05794    52.4777     55.1125     232.478     
1 1 1 32 3  10 o 10 154.172 2.57485 433.589     19.2377  411.314     20.4863  104.814    297.422     15.2066     117.422     
1 1 1 32 3  11 o 4  129.27  2.57426 307.539     16.1066  287.044     17.1454  83.3685    123.795     20.1874     303.795     
1 1 1 32 3  12 o 12 128.839 2.53335 292.195     15.861   298.253     16.8156  94.5519    317.767     3.62633     317.767     
1 1 1 32 3  13 o 6  63.645  3.22446 64.0508     9.99394  81.454      10.361   43.5843    98.4457     15.4405     98.4457     
1 1 1 32 3  14 o 12 76.8947 2.87856 103.937     10.6959  107.034     11.4072  48.7185    149.769     6.59325     329.769     
1 1 1 32 3  15 o 9  179.772 2.60247 577.094     22.7056  572.053     24.1568  135.366    118.174     8.06012     118.174     
1 1 1 32 3  16 o 3  48.8148 3.9084  42.6766     8.921    43.4962     9.84637  21.9734    164.661     1.05838     344.661     
1 1 1 32 3  17 o 14 157.618 2.70951 451.156     21.1584  433.048     21.6094  144.374    249.652     61.3575     249.652     
1 1 1 32 3  18 f 0  108.237 2.97462 197.873     15.6666  220.248     16.5421  76.0442    338.952     0           0           
1 1 1 32 3  19 o 1  20.2564 5.46465 -3.71986    8.38684  10.2364     8.49029  13.1635    28.1495     36.2996     28.1495     
1 1 1 32 3  20 o 11 67.1697 3.66828 83.7975     12.2192  78.3645     12.2718  8.26417    49.5474     111.074     49.5473     
1 1 1 32 3  21 o 2  72.2891 3.55884 97.1742     12.789   90.4249     12.8202  53.6626    71.9575     12.4453     71.9575     
1 1 1 32 3  22 o 4  146.248 3.034   392.862     21.9932  370.473     22.4027  123.36     30.2026     36.4173     30.2026     
1 1 1 32 3  23 o 12 196.443 3.05526 684.069     29.5936  692.247     30.5591  163.688    4.77466     41.9151     4.77466     
1 1 1 32 3  24 o 2  74.2903 3.43364 103.038     11.5523  95.101      13.6685  63.6126    264.355     35.388      264.355     
1 1 1 32 3  25 o 13 76.0696 3.07604 107.79      10.7626  99.477      12.4405  54.8936    345.971     7.83204     345.971     
1 1 1 32 3  26 o 13 64.4709 3.34876 77.8945     10.3294  71.5505     11.0914  40.0779    103.673     27.8943     103.673     
1 1 1 32 3  27 o 1  55.0185 3.86414 58.4162     10.2098  51.3135     10.7278  25.8493    56.179      18.3023     236.179     
1 1 1 32 3  28 o 14 146.776 2.69063 386.847     19.2807  381.815     20.2486  100.237    2.39685     10.2106     182.397     
1 1 1 32 3  29 o 9  89.0501 2.96116 141.677     12.938   142.129     13.4136  79.422     21.1367     38.6905     21.1367     
1 1 1 32 3  30 o 7  111.585 3.07891 224.66      16.0108  221.116     18.2602  103.983    255.529     52.188      255.529     
1 1 1 32 3  31 o 6  187.959 2.83172 628.794     26.6277  632.885     26.7186  154.094    29.3301     37.4356     29.3301     
1 1 1 32 3  32 o 4  46.0992 4.80828 33.0417     10.7995  46.0753     10.4236  27.2099    239.361     2.51165     59.3609     
1 1 1 32 3  33 o 8  133.792 3.01042 304.274     20.6628  337.262     19.5367  107.255    32.7526     23.2473     32.7526     
1 1 1 32 3  34 o 8  79.863  3.52089 107.571     14.0163  122.708     13.9733  68.494     271.897     26.1078     271.897     
1 1 1 32 3  35 o 4  74.6555 3.54429 103.495     13.6312  97.9008     12.7374  47.8645    281.67      8.67697     101.67      
1 1 1 32 3  36 o 16 118.459 2.98732 237.143     17.5523  266.854     17.8267  99.3275    225.588     30.6207     225.588     
1 1 1 32 3  37 o 8  31.8129 5.71442 16.2285     8.23907  22.8726     10.0735  9.8404     13.5454     18.7145     193.545     
1 1 1 32 3  38 o 13 141.021 2.71377 341.143     17.6959  371.887     20.6115  120.479    99.9156     40.7322     99.9156     
1 1 1 32 3  39 o 12 63.9825 3.60404 76.3821     10.1983  72.4472     12.5071  46.7744    63.3028     6.16491     63.3028     
1 1 1 32 3  40 o 5  37.0119 5.26475 32.5475     8.39619  20.0289     10.2787  14.4715    228.297     18.4393     48.2966     
1 1 1 32 3  41 o 13 73.9525 3.2023  89.0673     10.8802  109.327     12.7668  70.8033    107.951     41.6784     107.951     
1 1 1 32 3  42 o 17 61.2186 3.56744 63.1741     10.0979  73.6604     11.6125  21.4636    273.565     41.7162     93.5647     
1 1 1 32 3  43 o 17 56.6738 3.72534 54.591      10.14    63.1887     10.771   31.6437    113.206     13.8328     293.206     
1 1 1 32 3  44 o 5  62.0352 3.49166 69.7136     10.5148  70.6253     11.0126  39.0761    40.7878     6.49959     220.788     
1 1 1 32 3  45 o 16 55.466  3.8284  56.8499     10.2039  56.2355     10.7935  47.889     193.522     23.3303     193.522     
1 1 1 32 3  46 f 0  76.5412 3.44316 117.026     13.163   96.7871     13.0288  70.5694    112.745     0           0           
1 1 1 32 3  47 o 6  17.8607 5.43785 -0.477295   8.74161  0.862054    8.89447  0.409011   212.349     10.7528     32.3485     
1 1 1 32 3  48 o 14 80.7708 3.5382  118.094     14.2861  120.289     14.215   63.3974    238.655     16.097      238.655     
1 1 1 32 3  49 o 17 82.4471 3.4749  116.392     14.5758  132.302     13.9017  69.28      194.477     25.8127     194.477     
1 1 1 32 3  50 o 13 27.5296 6.16921 8.95567     9.74035  20.0775     10.0668  12.163     229.42      8.01517     49.4198     
1 1 1 32 3  51 o 5  26.4462 6.27329 4.65871     9.60901  21.1826     11.2538  13.6663    251.052     0.764332    71.0525     
1 1 1 32 3  52 o 1  66.3953 3.9117  83.1979     12.5614  80.9772     13.2097  33.7461    116.411     22.8969     296.411     
1 1 1 32 3  53 o 4  20.828  5.97287 3.22044     9.72231  6.74303     9.79859  2.93131    8.55424     17.4147     188.554     
1 1 1 32 3  54 f 0  15.9066 5.16029 -3.34649    8.9598   -6.77063    9.80558  12.426     328.328     0           0           
1 1 1 32 3  55 o 17 32.3313 6.25857 14.188      10.4278  29.7186     11.2176  21.8792    309.305     6.78344     309.305     
1 1 1 32 3  56 o 6  28.6975 6.39002 22.6656     10.3789  10.6024     11.1719  7.52628    112.22      20.3632     292.22      
1 1 1 32 3  57 o 10 29.0335 6.54833 22.7779     10.8695  11.9143     11.415   3.64523    233.971     28.9324     53.9713     
1 1 1 32 3  58 o 19 20.2596 5.65908 13.4958     9.85502  -11.9947    10.389   4.99521    155.201     5.92389     335.201     
1 1 1 32 3  59 o 4  19.5982 5.91336 -3.52321    10.1096  7.16114     10.9035  3.47544    102.978     7.68153     282.978     
1 1 1 32 3  60 o 7  30.6825 7.10614 26.0497     13.6567  15.2613     11.8186  16.3532    49.6665     1.26623     229.667     
1 1 1 32 3  61 o 3  41.0223 6.55549 29.1086     13.4522  43.3445     13.0736  33.5407    287.038     21.2131     287.038     
1 1 1 32 3  62 o 3  23.8744 7.09243 5.4659      14.3113  8.59962     14.4634  10.3523    87.1381     0.114746    87.1381     
1 1 1 32 3  63 o 1  36.3192 7.7277  33.1298     15.9773  27.9948     14.4549  17.7682    14.1538     9.33919     194.154     
1 1 1 32 3  64 o 4  27.2439 7.20104 3.35127     14.737   23.795      13.9549  8.53214    233.283     15.0004     53.283      
1 1 1 32 3  65 o 18 34.7406 7.56573 11.0015     19.7899  41.414      14.658   10.3244    89.9008     22.4882     269.901     
1 1 1 32 3  66 o 14 29.8758 8.18953 25.5299     16.0415  15.2466     20.5456  10.3343    194.37      14.0872     14.3697     
1 1 1 32 3  67 o 11 21.2322 6.79274 -11.9658    15.3816  10.1182     16.5169  0.771894   180.622     0.197074    0.621925    
1 1 1 32 3  68 o 5  46.7861 7.79488 67.9455     17.787   43.1036     18.9962  36.3601    4.04999     19.019      4.04999     
1 1 1 32 3  69 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 3  70 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 4  0  o 14 84.6219 2.77409 127.923     11.7065  127.923     11.7065  88.0611    180         54.8821     180         
1 1 1 32 4  1  o 13 39.696  4.34463 35.2398     8.2593   23.0185     8.20528  4.03864    66.3095     33.3746     246.309     
1 1 1 32 4  2  o 2  192.973 2.61938 649.855     24.776   674.181     25.8881  151.116    77.311      17.8042     77.311      
1 1 1 32 4  3  o 2  43.6241 4.03479 35.0132     8.79743  34.0819     8.42129  4.17922    138.647     43.6145     318.647     
1 1 1 32 4  4  o 9  229.123 2.84486 945.466     32.6372  922.208     32.6894  186.6      292.672     34.2826     292.672     
1 1 1 32 4  5  o 12 72.8983 2.96498 100.302     10.4107  89.5879     11.0827  52.7111    134.012     10.2674     134.012     
1 1 1 32 4  6  o 10 19.213  5.33381 3.84424     7.16972  3.97293     7.83103  8.8399     175.187     22.8709     175.187     
1 1 1 32 4  7  o 10 239.283 2.83772 1020.38     33.345   1016.76     34.6958  184.788    215.498     15.3635     215.498     
1 1 1 32 4  8  o 13 125.074 2.66417 290.814     16.1678  266.304     17.1113  78.9681    197.524     23.5789     17.5239     
1 1 1 32 4  9  o 13 32.7793 5.10708 21.8227     7.87831  18.2412     8.45938  0.0701952  220.502     0.482109    40.502      
1 1 1 32 4  10 o 6  138.166 2.54691 348.264     17.2107  330.879     18.0028  97.2596    127.783     6.53159     307.783     
1 1 1 32 4  11 o 1  122.191 2.6048  262.721     15.1972  268.795     16.6488  40.7656    333.724     96.8803     153.724     
1 1 1 32 4  12 o 10 106.587 2.7783  189.758     14.7446  215.492     14.8454  88.932     139.494     27.4378     139.494     
1 1 1 32 4  13 o 10 86.2303 3.01588 134.911     12.2448  130.595     13.6713  69.6386    267.575     21.6473     267.575     
1 1 1 32 4  14 o 7  92.8664 3.06547 149.911     13.9336  158.086     14.5226  36.521     348.163     60.0008     168.163     
1 1 1 32 4  15 o 14 76.0079 3.5743  104.791     12.9747  102.399     14.0611  59.6758    216.148     18.7568     216.148     
1 1 1 32 4  16 o 9  108.699 3.08819 214.035     16.6818  207.83      16.888   66.9316    215.446     22.2898     35.4462     
1 1 1 32 4  17 o 2  79.3065 3.48294 112.216     13.3807  113.24      14.1592  72.2042    0.502709    46.5309     0.502709    
1 1 1 32 4  18 o 4  110.754 3.08713 214.533     17.0392  223.608     17.1594  81.9588    99.7215     5.76065     99.7215     
1 1 1 32 4  19 o 19 240.684 3.3874  1061.16     37.6246  1008.21     43.6806  203.865    64.8208     54.3558     64.8208     
1 1 1 32 4  20 o 1  37.7739 5.13013 30.5937     8.49971  22.6914     10.0427  8.61248    56.075      18.1814     236.075     
1 1 1 32 4  21 o 19 95.1378 2.9318  168.069     13.8704  155.463     13.9966  57.7156    228.539     19.3303     48.5395     
1 1 1 32 4  22 o 5  155.837 2.72648 430.057     21.0421  435.517     21.5431  103.687    265.891     19.0356     85.8908     
1 1 1 32 4  23 o 4  139.542 2.73254 358.222     19.0648  336.657     19.1007  88.9968    233.216     23.8352     53.2164     
1 1 1 32 4  24 o 5  63.904  3.56623 84.4094     11.3174  63.4674     11.1662  46.6647    244.149     13.4492     244.149     
1 1 1 32 4  25 f 0  107.658 2.78524 208.499     14.4394  205.527     15.5342  65.1631    227.827     0           0           
1 1 1 32 4  26 o 3  36.4962 4.92908 24.0367     8.27525  25.7174     9.09902  4.41032    151.377     31.9289     331.377     
1 1 1 32 4  27 o 6  29.0792 5.77386 16.752      8.43813  14.9644     9.12033  1.95943    270.095     14.5092     90.0948     
1 1 1 32 4  28 o 6  22.3409 5.79307 6.3729      8.40973  8.56628     8.60047  19.9435    251.734     63.5311     251.734     
1 1 1 32 4  29 o 4  118.611 3.14555 256.762     18.1412  247.5       19.1487  126.805    237.355     87.5725     237.355     
1 1 1 32 4  30 f 0  83.3281 3.36257 115.76      13.3743  134.376     14.5986  51.2047    161.165     0           0           
1 1 1 32 4  31 o 15 71.1136 3.51901 82.1759     12.3231  100.813     12.5122  68.1002    184.89      40.1772     184.89      
1 1 1 32 4  32 o 16 61.4853 3.51487 65.6806     10.4123  71.1224     11.0671  40.3681    28.3796     4.25492     208.38      
1 1 1 32 4  33 o 16 134.776 2.63535 308.622     16.8984  341.531     18.6781  95.4122    174.009     2.88077     354.009     
1 1 1 32 4  34 o 14 87.9685 2.91763 137.911     12.1794  139.976     13.449   86.8994    208.648     51.5821     208.648     
1 1 1 32 4  35 o 13 25.2753 5.75129 14.128      8.21335  8.8341      8.59626  5.25573    175.114     2.8005      355.114     
1 1 1 32 4  36 o 19 40.9474 4.68119 37.1746     8.93199  25.9819     9.34897  28.7895    16.3205     7.99102     16.3205     
1 1 1 32 4  37 o 13 96.1627 2.96861 172.855     14.05    160.03      14.4566  79.5719    272.703     23.666      272.703     
1 1 1 32 4  38 o 6  61.8032 4.14048 69.6461     11.5689  70.627      13.6778  60.0923    309.034     40.1181     309.034     
1 1 1 32 4  39 o 6  97.6786 2.95883 153.253     14.1811  191.567     14.6252  78.487     219.461     19.5717     219.461     
1 1 1 32 4  40 o 12 82.123  3.27884 122.618     12.2695  121.653     14.4953  80.2569    116.454     47.7637     116.454     
1 1 1 32 4  41 o 18 71.3474 3.50332 90.3773     11.3399  94.9355     13.5007  52.6245    308.093     6.64011     308.093     
1 1 1 32 4  42 o 11 66.3777 3.64936 79.2518     10.8672  81.7439     13.1306  60.8758    309.475     32.3821     309.475     
1 1 1 32 4  43 o 1  67.3845 3.67526 73.667      11.4106  92.951      13.239   46.0338    11.5232     0.660896    191.523     
1 1 1 32 4  44 o 8  63.022  3.87964 61.8193     10.7106  85.1344     13.6091  43.7789    231.626     1.47976     231.626     
1 1 1 32 4  45 o 11 34.0791 5.81618 15.1635     8.83099  31.542      11.2015  12.5505    61.8911     18.2996     241.891     
1 1 1 32 4  46 o 12 19.5673 5.61022 2.03712     7.88293  5.62573     9.27466  2.72455    232.276     4.55231     52.2759     
1 1 1 32 4  47 o 4  41.8879 4.98501 31.4569     9.2978   35.8227     10.8945  27.1012    160.75      0.297045    340.75      
1 1 1 32 4  48 o 3  38.1565 5.61634 27.7137     9.78342  29.6083     10.9956  21.254     38.0787     6.95114     218.079     
1 1 1 32 4  49 o 19 34.8945 5.75673 30.4796     9.09585  17.9661     11.066   25.0067    88.3348     16.9226     88.3348     
1 1 1 32 4  50 o 10 54.1859 4.5     60.4728     10.4324  50.8709     12.9472  43.8845    113.263     15.6037     113.263     
1 1 1 32 4  51 o 12 38.5401 5.85508 32.3295     10.3902  27.5567     11.5521  21.6935    70.4816     6.6127      250.482     
1 1 1 32 4  52 o 16 76.9333 3.94625 121.603     13.6283  100.147     16.0534  67.2163    296.74      30.0398     296.74      
1 1 1 32 4  53 o 18 27.7272 6.02833 5.78785     8.70492  25.5379     11.1106  12.96      147.386     7.0605      327.386     
1 1 1 32 4  54 o 15 86.9029 3.50027 138.671     14.2907  141.738     16.0298  61.8537    288.036     5.37868     288.036     
1 1 1 32 4  55 o 10 23.1088 6.30955 8.7001      9.98454  9.09489     10.7347  4.1468     253.338     18.4525     73.3378     
1 1 1 32 4  56 o 10 30.6036 6.4201  24.5876     10.6687  14.9054     10.9695  19.348     158.08      7.87006     158.08      
1 1 1 32 4  57 o 7  37.3535 6.13997 33.8083     11.0532  24.9931     11.6321  25.4556    151.508     5.91359     151.508     
1 1 1 32 4  58 o 10 24.0749 6.32601 14.9686     10.3234  5.37182     10.7715  7.59415    244.483     9.73396     64.4835     
1 1 1 32 4  59 o 18 19.9684 5.92299 7.67076     10.1197  -1.95029    10.5054  3.95481    284.698     9.66474     104.698     
1 1 1 32 4  60 o 8  39.577  6.36005 32.1843     12.5055  34.4087     12.156   30.5928    289.825     14.1012     289.825     
1 1 1 32 4  61 o 18 18.9232 5.98946 -5.91298    13.3803  1.52889     10.4356  4.94627    335.939     5.54167     155.939     
1 1 1 32 4  62 o 17 51.7455 6.52143 51.4068     17.38    62.7777     14.7442  36.5153    75.7793     6.49383     75.7793     
1 1 1 32 4  63 o 5  71.0942 5.0345  104.991     18.911   96.915      16.4491  49.097     188.622     4.78335     188.622     
1 1 1 32 4  64 o 16 48.1382 6.92376 38.235      16.9686  66.9016     15.2476  37.6564    1.16707     15.3757     1.16707     
1 1 1 32 4  65 o 5  29.0946 7.97371 13.7408     19.1691  24.4511     15.4605  15.7097    300.481     2.7608      300.481     
1 1 1 32 4  66 o 2  17.5462 5.93621 -20.0815    14.4276  -4.52266    15.2706  1.21779    310.756     4.33467     130.756     
1 1 1 32 4  67 o 13 17.5031 5.99061 -11.4927    14.8525  -19.3227    17.5997  0.376072   295.966     9.24601     115.966     
1 1 1 32 4  68 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 4  69 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 5  0  f 0  64.2642 3.23871 74.4974     10.3063  74.4974     10.3063  21.3499    2.31363e-05 0           0           
1 1 1 32 5  1  o 1  95.1896 2.87438 162.634     12.9732  160.559     14.3418  94.606     4.79664     63.9206     4.79664     
1 1 1 32 5  2  o 13 104.561 2.75241 187.427     13.8389  202.364     14.9613  80.523     237.213     11.7755     237.213     
1 1 1 32 5  3  o 1  23.5391 5.59034 12.393      7.86762  5.76003     8.11841  11.3936    78.2929     37.4312     78.2929     
1 1 1 32 5  4  o 17 91.7955 2.89044 161.992     13.1744  139.083     13.2833  73.6291    150.857     19.0978     150.857     
1 1 1 32 5  5  o 2  77.6884 3.0052  102.369     11.4078  113.415     11.8999  56.7789    356.976     7.651       356.976     
1 1 1 32 5  6  o 3  99.1557 2.90752 178.323     13.6386  172.448     15.1252  72.5646    7.77187     3.94929     7.77185     
1 1 1 32 5  7  o 2  206.12  3.03325 760.679     31.3249  753.209     31.3388  175.382    61.6585     46.1944     61.6585     
1 1 1 32 5  8  o 10 114.799 2.89844 233.34      16.6878  236.661     16.6071  101.963    335.913     40.0817     335.913     
1 1 1 32 5  9  o 10 85.758  3.05782 118.549     12.7207  144.895     13.4385  60.4912    315.526     0.907308    315.526     
1 1 1 32 5  10 o 9  63.2934 3.92321 64.6033     12.2839  80.2298     12.2168  34.172     42.1121     16.5062     222.112     
1 1 1 32 5  11 o 6  121.072 3.10342 280.003     18.4725  243.966     19.0132  98.9318    64.3404     23.227      64.3404     
1 1 1 32 5  12 o 9  62.1895 3.97442 63.9013     11.901   75.9362     12.5807  42.8391    257.568     6.79387     257.568     
1 1 1 32 5  13 o 4  93.384  3.31355 152.505     15.0246  159.636     15.8918  91.0281    206.715     56.7046     206.715     
1 1 1 32 5  14 o 1  23.145  5.51514 -6.81201    8.9102   17.9903     9.56736  16.2752    326.295     51.5886     326.295     
1 1 1 32 5  15 o 7  57.2869 3.82951 49.4327     10.6721  69.9976     10.7804  30.1062    58.6051     14.15       238.605     
1 1 1 32 5  16 o 6  216.387 2.90753 834.372     30.1273  835.331     32.8718  158.065    57.5785     2.91378     237.578     
1 1 1 32 5  17 o 19 208.257 2.89544 776.9       29.4292  769.923     30.9799  179.907    204.197     53.8815     204.197     
1 1 1 32 5  18 o 19 101.278 2.79988 180.028     13.7102  186.286     14.6534  49.2302    259.114     47.3196     79.1144     
1 1 1 32 5  19 o 13 97.4887 2.87779 167.869     13.1899  171.792     14.835   61.937     291.228     14.989      111.228     
1 1 1 32 5  20 o 18 69.1949 3.22325 81.7034     10.6772  90.2783     11.5582  42.3507    317.969     9.09285     137.969     
1 1 1 32 5  21 o 8  117.315 2.84668 242.298     15.8324  249.429     17.5663  78.186     8.2379      12.4835     188.238     
1 1 1 32 5  22 o 1  33.4728 5.44258 18.239      8.99086  24.1479     8.94448  3.76483    53.1522     23.0833     233.152     
1 1 1 32 5  23 o 16 75.9933 3.10288 99.9376     11.2436  107.249     12.292   45.1921    64.3174     15.3824     244.317     
1 1 1 32 5  24 o 17 37.9112 5.77335 36.108      9.30838  18.348      12.1294  8.11428    187.093     28.4163     7.09323     
1 1 1 32 5  25 o 17 28.8651 6.18683 13.5047     9.23258  17.5215     10.2537  4.32828    309.767     40.3584     309.767     
1 1 1 32 5  26 o 11 34.2491 5.79983 17.6683     9.27343  27.3136     10.5138  3.92958    57.7015     0.514928    57.7015     
1 1 1 32 5  27 o 17 74.4066 3.54099 95.168      12.5847  104.625     13.6759  57.8332    89.9475     11.9524     89.9475     
1 1 1 32 5  28 o 1  89.4967 3.17343 132.102     13.1612  156.122     15.2371  41.8554    84.4884     45.0267     264.488     
1 1 1 32 5  29 o 10 102.186 2.92962 181.375     14.2123  193.044     15.7277  100.263    28.8391     55.3026     28.8391     
1 1 1 32 5  30 o 11 52.8811 4.13106 48.7313     9.69543  53.6542     11.8037  24.6599    225.191     23.8902     45.1905     
1 1 1 32 5  31 o 10 90.0045 2.95853 142.85      12.6708  148.106     13.9335  60.8327    99.9806     6.87619     279.981     
1 1 1 32 5  32 o 9  68.2031 3.34136 90.487      10.6391  77.8514     11.8667  53.0781    19.3723     11.2451     19.3723     
1 1 1 32 5  33 o 19 49.8636 4.02191 42.4323     9.25019  48.9174     10.5034  32.3289    312.706     2.50543     132.706     
1 1 1 32 5  34 o 9  113.109 2.8669  216.515     15.9538  243.442     16.4791  92.1293    72.0753     22.6335     72.0753     
1 1 1 32 5  35 f 0  65.2341 3.5453  76.5317     11.2216  78.1358     11.7785  41.2363    225.173     0           0           
1 1 1 32 5  36 o 1  52.9472 3.97426 55.2551     9.70448  47.8713     10.863   34.5054    192.851     3.00663     12.8515     
1 1 1 32 5  37 f 0  53.5323 4.22336 62.905      10.9067  43.7873     10.986   22.9829    155.767     0           0           
1 1 1 32 5  38 o 1  21.2414 5.7358  8.22906     8.26838  3.86669     8.95442  1.29217    238.639     17.467      58.6389     
1 1 1 32 5  39 o 12 39.198  5.11748 29.5973     9.10524  29.0496     10.23    13.9385    57.6517     24.2047     237.652     
1 1 1 32 5  40 o 2  50.9295 4.09646 50.4414     9.90547  45.5945     10.55    32.3687    312.694     4.14424     132.694     
1 1 1 32 5  41 o 10 61.1803 3.64264 68.7788     10.9089  68.2205     11.2162  44.2854    53.5122     4.69381     53.5122     
1 1 1 32 5  42 o 10 125.35  2.75803 268.856     17.0936  297.431     17.4994  98.0361    45.0215     18.955      45.0215     
1 1 1 32 5  43 o 14 87.9323 3.14632 140.721     13.1836  139.687     14.4195  73.5872    260.68      24.704      260.68      
1 1 1 32 5  44 f 0  19.3813 5.47457 8.80194     7.89181  -7.77298    10.4167  25.7032    162.401     0           0           
1 1 1 32 5  45 o 18 37.6829 5.6031  30.1207     8.98322  25.4238     11.4421  13.5992    193.731     22.6876     13.7311     
1 1 1 32 5  46 o 6  43.9839 5.13015 33.512      9.34497  41.2248     12.4795  24.7329    274.86      9.33575     94.8601     
1 1 1 32 5  47 o 4  28.7816 6.15079 8.7661      8.95753  24.4449     11.1206  12.2199    44.7012     11.1001     224.701     
1 1 1 32 5  48 o 12 36.3436 5.90856 25.1028     9.29514  28.039      11.786   21.9605    347.956     2.73403     167.956     
1 1 1 32 5  49 o 17 32.5678 6.3566  30.7402     11.1211  12.2623     11.7923  23.4935    24.4621     12.7265     24.462      
1 1 1 32 5  50 o 19 75.0566 3.4627  107.169     12.1021  101.001     13.681   59.5738    62.1438     16.2647     62.1438     
1 1 1 32 5  51 o 7  56.1603 4.31738 51.6708     10.6617  68.9807     13.2979  39.6161    242.057     3.48231     242.057     
1 1 1 32 5  52 o 10 42.4655 5.24569 30.3893     9.93429  41.7647     11.6002  29.3298    55.0426     3.44868     55.0426     
1 1 1 32 5  53 o 4  23.2664 6.14608 3.67894     8.78916  15.2568     10.9829  8.10652    303.041     9.32519     123.041     
1 1 1 32 5  54 o 15 21.7178 5.52025 15.955      8.69363  -8.47524    10.442   7.87106    181.213     4.0797      1.21312     
1 1 1 32 5  55 o 15 40.4432 5.60491 30.0662     10.3961  36.8715     11.5288  19.015     29.7329     14.4417     209.733     
1 1 1 32 5  56 o 2  23.5365 6.0377  14.8008     9.01313  3.61097     10.6819  7.27219    345.728     10.3199     165.728     
1 1 1 32 5  57 o 11 18.6856 5.57068 6.94944     8.6811   -5.64455    10.4386  2.26206    131.528     10.7527     311.528     
1 1 1 32 5  58 o 9  28.074  6.43922 18.4247     9.70778  14.5013     11.3057  7.16761    45.0992     19.775      225.099     
1 1 1 32 5  59 o 12 24.2738 6.59618 10.6864     11.7095  10.4669     10.863   11.2674    103.598     0.683492    103.598     
1 1 1 32 5  60 o 18 61.9639 4.70536 85.2441     14.662   65.4622     13.95    46.493     152.161     11.2884     152.161     
1 1 1 32 5  61 o 18 23.6986 6.51091 17.8244     12.2761  -1.41038    11.6916  10.7472    347.338     2.5369      167.338     
1 1 1 32 5  62 o 6  28.1548 7.27745 5.763       16.1479  24.7056     13.2973  16.1602    215.855     2.24245     215.855     
1 1 1 32 5  63 o 4  22.2756 6.8305  -14.734     15.9635  14.7945     15.0604  3.50823    69.1557     17.8549     249.156     
1 1 1 32 5  64 o 3  21.5158 6.84807 -4.35159    16.8701  5.88816     14.7587  6.06253    265.835     2.94558     85.8347     
1 1 1 32 5  65 o 11 17.7356 6.05528 -22.3642    18.6529  -9.13302    14.3714  1.36632    128.722     6.48238     308.722     
1 1 1 32 5  66 o 14 18.8405 6.3139  0.803578    15.2767  -26.3312    18.5342  1.33502    322.245     3.81719     142.245     
1 1 1 32 5  67 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 6  0  o 7  93.5085 3.32412 156.683     15.4869  156.683     15.4869  57.9295    180         24.3873     8.57136e-06 
1 1 1 32 6  1  o 16 41.8021 4.68739 33.4255     9.56021  30.9325     9.41879  15.5808    110.788     9.44195     290.788     
1 1 1 32 6  2  o 9  62.9845 3.47724 81.7574     11.1582  61.5598     10.5232  42.1992    1.01265     2.04301     1.01265     
1 1 1 32 6  3  o 2  58.8092 3.62626 60.3979     10.8765  64.2263     10.2421  41.122     339.146     11.1845     339.146     
1 1 1 32 6  4  o 8  91.9149 3.15119 152.613     14.7527  149.561     14.19    71.7404    79.3523     13.5933     79.3523     
1 1 1 32 6  5  o 4  61.0334 3.77983 65.5189     11.7209  68.8319     11.1366  30.1391    200.966     22.1226     20.966      
1 1 1 32 6  6  o 19 55.9966 3.71237 55.5606     10.33    57.6171     10.2577  27.3173    355.111     18.8134     175.111     
1 1 1 32 6  7  o 19 104.537 3.01015 193.861     16.4498  196.578     14.9755  66.3785    212.555     18.5173     32.5549     
1 1 1 32 6  8  o 16 78.4183 3.26165 112.548     13.2729  107.847     12.2459  57.9582    139.478     7.69028     139.478     
1 1 1 32 6  9  o 1  85.5965 3.11355 136.836     13.6629  125.492     12.9615  63.9775    208.083     7.98797     208.083     
1 1 1 32 6  10 o 9  58.3195 3.83964 52.7586     10.7531  70.8111     11.3032  27.6359    216.356     22.6051     36.3556     
1 1 1 32 6  11 o 6  121.302 2.78792 263.534     17.3944  261.6       16.4454  85.9018    239.469     4.65514     59.4686     
1 1 1 32 6  12 o 14 71.2149 3.07273 89.0174     10.7887  92.7317     11.0395  59.1778    52.6197     26.3861     52.6197     
1 1 1 32 6  13 o 16 38.2443 4.62415 23.3289     8.45702  31.0564     8.54981  11.0833    325.05      9.36178     145.05      
1 1 1 32 6  14 o 13 95.036  2.73856 161.756     12.235   160.827     13.7454  43.6282    227.339     49.8613     47.3392     
1 1 1 32 6  15 o 7  55.0571 3.58664 56.4225     9.11899  53.0843     10.352   35.4608    298.55      4.82599     298.55      
1 1 1 32 6  16 o 14 90.098  2.88761 142.005     12.5256  148.365     13.4812  58.6076    245.868     10.7207     65.8682     
1 1 1 32 6  17 o 17 141.949 2.65001 352.491     17.4488  366.346     20.1788  116.611    52.3675     26.7197     52.3675     
1 1 1 32 6  18 o 6  16.4508 5.00266 1.18048     6.87269  -2.54069    8.17252  7.61218    258.677     19.5721     258.677     
1 1 1 32 6  19 f 0  53.9362 3.52098 52.121      9.05425  53.0148     9.75588  35.787     213.969     0           0           
1 1 1 32 6  20 o 1  80.8925 3.15924 114.637     12.4496  120.195     13.0669  53.3057    72.7363     7.54437     252.736     
1 1 1 32 6  21 o 8  98.4191 3.05859 184.081     14.8172  163.304     15.2102  89.1494    130.26      38.9772     130.26      
1 1 1 32 6  22 o 14 23.205  5.82074 12.3013     8.07446  2.74563     9.95133  0.622806   224.188     10.3236     224.188     
1 1 1 32 6  23 o 4  48.8022 4.52711 35.9471     10.0407  52.4276     11.4749  30.2858    287.077     2.88946     107.077     
1 1 1 32 6  24 o 6  61.7322 3.77182 62.4528     11.0536  76.0113     12.044   32.772     47.0897     21.1476     227.09      
1 1 1 32 6  25 o 3  36.2855 5.73717 13.6202     10.3584  37.6802     10.7543  19.8035    264.312     3.53337     84.3121     
1 1 1 32 6  26 o 1  99.8979 2.99602 169.008     13.4715  189.336     16.4398  108.945    39.8661     76.8876     39.8661     
1 1 1 32 6  27 o 18 27.5594 5.59905 17.8383     7.94663  10.3554     8.78987  6.65018    202.132     17.5728     22.1325     
1 1 1 32 6  28 o 14 65.0015 3.29719 77.3394     10.4134  75.2716     10.9093  41.6441    7.45239     8.3681      187.452     
1 1 1 32 6  29 o 6  73.415  3.21014 96.8604     11.8752  97.5461     11.6278  63.1876    274.207     23.4041     274.207     
1 1 1 32 6  30 o 8  74.1103 3.22359 98.874      11.97    99.3752     11.8581  52.3419    281.386     0.358185    101.387     
1 1 1 32 6  31 o 2  41.2156 4.56074 27.6848     8.8182   35.9939     9.34998  10.1859    224.68      35.844      44.6797     
1 1 1 32 6  32 o 18 14.5792 4.67644 -1.56303    7.06198  -7.45227    8.00086  6.08611    253.313     21.0284     253.313     
1 1 1 32 6  33 o 4  104.249 2.74469 187.038     13.8205  203.586     14.8134  75.1161    58.8548     0.691518    58.8549     
1 1 1 32 6  34 o 4  122.012 2.64583 263.304     15.6109  271.134     16.7012  113.465    204.19      52.2599     204.19      
1 1 1 32 6  35 o 19 35.8805 5.19344 22.7158     8.37442  26.7308     9.68596  5.52995    257.7       36.9808     77.7004     
1 1 1 32 6  36 o 12 45.2352 4.55103 35.2476     9.29477  41.4778     10.7736  34.5853    82.0625     10.5354     82.0625     
1 1 1 32 6  37 o 14 129.212 2.77177 294.006     16.4677  306.918     19.3229  109.916    259.713     35.1579     259.713     
1 1 1 32 6  38 o 17 63.6946 3.49815 65.1784     10.3334  83.4346     11.8295  41.3432    337.594     6.0645      157.594     
1 1 1 32 6  39 o 12 98.4094 2.94561 183.283     13.6081  166.651     15.2223  78.9226    62.7394     18.5971     62.7394     
1 1 1 32 6  40 o 17 63.1332 3.74522 81.6855     11.2293  65.0119     11.9943  43.2072    128.922     1.07984     308.922     
1 1 1 32 6  41 o 5  22.795  5.92311 6.39875     8.43042  10.4724     9.39724  6.26191    28.4507     3.53289     208.451     
1 1 1 32 6  42 o 4  56.1009 4.00719 58.3032     10.7556  58.258      11.4527  21.8819    211.85      34.1505     31.8497     
1 1 1 32 6  43 o 1  21.1332 5.85336 8.27294     8.54539  2.40001     9.91889  3.81913    48.8772     14.3387     228.877     
1 1 1 32 6  44 o 3  54.412  4.63605 61.1501     10.8027  50.7886     13.3427  45.9115    253.715     18.5444     253.715     
1 1 1 32 6  45 o 8  64.9417 3.64338 73.0146     11.1749  82.7222     12.3553  58.1925    229.757     27.4802     229.757     
1 1 1 32 6  46 o 13 57.0001 4.18054 61.3087     11.6261  60.5871     11.906   42.0169    121.639     6.11228     121.639     
1 1 1 32 6  47 o 9  40.0914 5.27306 27.6156     9.43197  35.9333     11.0057  27.8591    56.3543     3.30941     56.3543     
1 1 1 32 6  48 o 1  43.7864 5.01461 34.0285     10.1379  40.9714     11.1203  38.4763    161.755     20.9911     161.755     
1 1 1 32 6  49 o 3  39.0119 5.97117 35.3451     10.6688  26.9596     12.0303  29.1053    110.754     8.44893     110.754     
1 1 1 32 6  50 o 19 19.8665 5.9057  3.50652     8.78978  3.09046     11.1642  3.35085    244.635     14.7187     64.6351     
1 1 1 32 6  51 o 10 18.8046 5.75148 -0.441944   8.58176  3.44748     11.1904  3.38893    126.715     11.3662     306.715     
1 1 1 32 6  52 o 11 30.5022 6.52008 17.771      9.64386  21.9702     11.985   20.0005    338.522     9.52466     338.522     
1 1 1 32 6  53 o 8  16.2832 5.34439 -8.02104    8.45465  -2.46995    11.9089  0.650305   225.702     10.6018     45.7021     
1 1 1 32 6  54 o 5  24.613  6.31876 13.1376     9.54354  9.89225     10.7799  10.6932    313.617     1.78803     133.617     
1 1 1 32 6  55 o 17 40.8514 5.67924 40.654      10.544   28.3574     11.7284  22.6756    247.175     7.06504     67.175      
1 1 1 32 6  56 o 16 21.4538 6.12063 2.6355      9.40266  10.2714     11.0584  6.21533    337.429     7.24663     157.429     
1 1 1 32 6  57 o 3  40.4873 5.82708 34.3548     10.7662  33.6449     12.0554  22.588     214.417     6.90519     34.4168     
1 1 1 32 6  58 o 4  36.189  6.42838 39.6675     12.2126  17.3405     12.3232  21.8015    299.922     1.78145     119.922     
1 1 1 32 6  59 o 3  24.9304 6.94655 10.1842     14.1176  11.8555     11.5818  12.0895    20.3779     3.87903     20.3779     
1 1 1 32 6  60 o 18 27.6402 7.02825 9.74557     13.9546  21.3869     12.1126  12.8407    221.54      7.20429     221.54      
1 1 1 32 6  61 o 5  64.9475 5.38986 91.3827     15.8965  81.3315     18.0918  47.8535    329.28      10.0665     329.28      
1 1 1 32 6  62 o 3  25.131  7.11927 -4.90774    14.8842  23.4161     15.2598  7.13774    292.081     2.85654     292.081     
1 1 1 32 6  63 f 0  56.253  6.70511 86.8314     17.7045  57.5422     18.0617  14.2414    235.189     0           0           
1 1 1 32 6  64 o 2  20.764  6.8062  -5.42472    15.7685  2.09443     17.8418  4.14513    237.759     5.6284      57.759      
1 1 1 32 6  65 o 14 31.5319 7.62809 -0.309731   20.0034  43.8106     16.7061  16.2009    96.3246     6.01783     96.3246     
1 1 1 32 6  66 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 7  0  o 4  87.4167 3.01915 136.873     13.1541  136.873     13.1541  85.3066    360         39.5303     360         
1 1 1 32 7  1  o 12 38.0764 4.9192  25.333      8.5611   28.6784     9.52893  14.6108    351.331     79.0383     351.331     
1 1 1 32 7  2  o 17 32.1732 5.46719 19.3734     8.41544  19.6825     8.99608  3.37685    355.846     13.2583     175.846     
1 1 1 32 7  3  o 1  48.4011 4.17444 48.1491     10.0569  37.5979     9.67955  24.4501    253.6       8.67032     73.6004     
1 1 1 32 7  4  o 15 139.802 2.72528 361.741     18.9435  335.964     19.1774  120.617    286.474     36.4626     286.474     
1 1 1 32 7  5  o 18 54.1487 3.79915 46.7649     9.91635  59.8096     10.346   32.9199    303.957     16.6403     303.957     
1 1 1 32 7  6  f 0  80.1544 3.2405  120.371     13.4244  110.196     12.5058  60.3822    194.43      0           0           
1 1 1 32 7  7  o 6  63.6645 3.43758 68.9731     11.1674  77.0569     10.5227  45.2561    86.1937     7.1278      86.1937     
1 1 1 32 7  8  o 14 50.5216 3.96079 56.1941     9.9376   37.5157     9.4991   29.4231    198.394     0.124257    198.394     
1 1 1 32 7  9  o 7  37.9618 4.49961 28.3885     8.35338  24.9793     8.15164  6.06663    59.7986     60.2789     59.7986     
1 1 1 32 7  10 o 1  45.7882 3.97153 44.6644     9.22541  32.2649     8.51524  23.1702    50.692      1.03473     230.692     
1 1 1 32 7  11 o 16 58.7058 3.50496 68.2035     10.1217  56.4143     10.2179  39.6563    64.04       4.19457     64.04       
1 1 1 32 7  12 o 9  41.5471 4.1698  32.5143     8.54423  30.82       8.33207  13.9734    228.805     20.9682     48.8045     
1 1 1 32 7  13 o 2  69.255  3.06047 91.1302     10.9875  81.1224     10.1551  42.0319    54.4412     12.2368     234.441     
1 1 1 32 7  14 o 8  125.456 2.5686  290.002     16.4273  271.865     15.8378  112.075    72.6199     41.9014     72.6199     
1 1 1 32 7  15 o 1  45.8598 4.0123  42.763      9.13685  34.2663     8.84082  26.305     150.789     10.1995     150.789     
1 1 1 32 7  16 o 6  64.6804 3.65747 71.5054     12.8187  79.7495     10.3631  54.5375    351.124     23.9597     351.124     
1 1 1 32 7  17 o 1  52.6843 4.10093 55.0393     10.8604  46.3426     10.4027  32.345     97.5188     5.18389     277.519     
1 1 1 32 7  18 o 18 94.4999 3.23247 160.056     15.8383  160.612     14.6607  81.454     122.675     27.4451     122.675     
1 1 1 32 7  19 o 3  47.8032 4.6156  42.4866     10.6422  41.7766     10.8898  19.3385    116.254     26.5034     296.254     
1 1 1 32 7  20 o 2  52.9106 4.32216 52.4981     11.6648  50.0513     10.8339  36.6295    247.86      1.61867     247.86      
1 1 1 32 7  21 o 9  31.3291 5.59823 10.8658     8.82547  26.8141     9.51132  12.2691    324.422     2.29334     324.422     
1 1 1 32 7  22 f 0  15.2667 4.84134 -1.04107    7.16425  -6.41251    8.41866  9.10374    276.417     0           0           
1 1 1 32 7  23 o 13 102.409 3.20765 190.62      17.7504  186.515     14.9974  79.1393    307.12      9.40202     307.12      
1 1 1 32 7  24 o 4  76.067  3.34785 111.979     13.3382  97.0859     12.0698  57.6278    241.77      6.48661     241.77      
1 1 1 32 7  25 o 15 13.8562 4.53759 -6.02458    7.1159   -5.7219     7.79841  11.0824    246.785     32.4407     246.785     
1 1 1 32 7  26 o 12 123.64  2.81125 280.879     17.3179  267.5       17.4624  94.3983    207.535     8.58104     207.535     
1 1 1 32 7  27 o 14 86.0649 3.13193 126.877     12.5755  140.237     14.354   58.9899    98.9683     6.01353     278.968     
1 1 1 32 7  28 o 11 14.4887 4.68402 -3.39126    7.08174  -6.22709    8.18945  20.0497    41.8193     55.372      41.8193     
1 1 1 32 7  29 o 15 68.3679 3.48721 77.7714     11.1181  92.2231     12.6332  50.866     34.5508     5.13832     34.5509     
1 1 1 32 7  30 o 13 102.612 2.84717 191.658     14.101   187.081     15.0917  66.5152    329.355     15.3309     149.355     
1 1 1 32 7  31 o 8  75.0788 3.21244 100.444     11.5097  103.604     12.541   56.5507    125.925     6.50221     125.925     
1 1 1 32 7  32 o 16 44.0509 4.53134 33.7046     9.14901  39.0022     10.2826  27.4266    81.898      4.15432     261.898     
1 1 1 32 7  33 o 18 66.3447 3.58387 78.1376     11.754   82.4326     11.8934  33.2252    104.556     27.7305     284.556     
1 1 1 32 7  34 o 9  72.1892 3.38731 98.6554     11.9089  90.9007     12.4144  53.2462    317.109     4.52352     317.109     
1 1 1 32 7  35 o 14 56.1715 3.94995 61.0907     10.7299  55.2389     11.1546  40.6961    269.917     3.88286     269.917     
1 1 1 32 7  36 o 19 87.8575 3.20739 138.87      13.4213  141.03      14.7039  67.6981    258.656     10.5213     258.656     
1 1 1 32 7  37 o 10 68.9083 3.50393 87.8095     11.6241  85.5255     12.3867  43.6766    39.7747     9.72438     219.775     
1 1 1 32 7  38 o 10 42.4028 4.91224 33.3021     9.69652  35.1385     10.4579  22.089     153.04      12.9074     333.04      
1 1 1 32 7  39 o 11 52.3717 4.20123 46.0011     10.4192  56.3471     11.2173  35.0133    172.996     1.78349     352.996     
1 1 1 32 7  40 o 3  30.1151 6.06214 17.2184     9.20541  18.6729     9.97002  11.3906    66.7407     15.1247     246.741     
1 1 1 32 7  41 o 7  17.9469 5.32464 5.86957     8.24207  -6.13082    9.01299  2.08469    180.828     8.86841     0.828184    
1 1 1 32 7  42 o 11 44.9648 4.76369 39.0669     10.1231  38.0497     10.6652  19.5207    313.659     22.6661     133.659     
1 1 1 32 7  43 o 13 24.6414 6.25097 12.5065     9.46714  8.87138     10.3328  5.08808    315.228     20.3011     135.228     
1 1 1 32 7  44 o 12 19.6435 5.74277 -0.0674375  9.14213  6.24916     9.51488  7.40455    38.9467     39.2581     38.9467     
1 1 1 32 7  45 o 10 43.1125 5.5995  41.3432     10.973   32.6455     12.1522  28.7367    74.5229     0.193166    254.523     
1 1 1 32 7  46 f 0  23.4048 6.26638 5.0337      10.9492  12.1622     9.77304  10.3383    332.335     0           0           
1 1 1 32 7  47 o 10 59.8806 4.2529  57.1827     12.5138  79.6662     12.2543  48.9855    281.265     16.1072     281.265     
1 1 1 32 7  48 o 10 59.8698 4.08844 68.8722     11.9097  66.858      12.3035  49.2246    18.479      16.882      18.479      
1 1 1 32 7  49 o 19 17.9548 5.43294 -6.16965    8.4605   6.66093     9.67246  2.7686     350.625     11.349      170.625     
1 1 1 32 7  50 o 15 72.3254 3.64812 102.527     12.6451  93.4407     13.5314  62.8207    150.871     26.7837     150.871     
1 1 1 32 7  51 o 14 30.7902 5.87012 30.8904     10.0329  7.46378     10.9643  19.3747    3.84647     2.62491     3.84647     
1 1 1 32 7  52 o 2  14.9068 4.91775 -3.14337    8.47204  -11.7536    10.0003  0.0984474  144.243     7.06084     144.243     
1 1 1 32 7  53 o 1  30.5171 6.32037 27.0057     9.87958  10.7844     12.8643  16.3493    349.423     3.18202     169.423     
1 1 1 32 7  54 o 13 81.2027 3.66808 120.166     13.4645  127.947     16.1618  71.1783    200.494     32.4544     200.494     
1 1 1 32 7  55 o 15 20.7551 6.22547 6.84751     10.6138  -0.534243   12.3903  6.09823    305.387     6.24023     125.387     
1 1 1 32 7  56 o 16 21.8066 6.4222  1.77301     10.6691  9.59575     12.6808  8.36326    123.434     3.55846     303.434     
1 1 1 32 7  57 o 5  39.5029 6.8799  41.7553     13.2815  27.4157     14.2751  20.7353    69.3137     9.63374     249.314     
1 1 1 32 7  58 o 2  23.4792 6.73206 9.15903     12.0343  8.5031      12.6619  10.2418    72.0269     4.26417     252.027     
1 1 1 32 7  59 o 7  32.338  7.4987  28.2615     14.4943  21.0756     13.7014  22.3102    36.0768     8.25271     36.0768     
1 1 1 32 7  60 o 17 44.2326 6.84632 52.2707     14.2965  36.807      15.364   33.1703    147.92      10.5928     147.92      
1 1 1 32 7  61 o 7  27.5032 7.71846 13.2768     15.8501  21.0528     16.1163  9.23055    201.175     13.5185     21.1754     
1 1 1 32 7  62 o 19 33.872  8.02684 39.7333     16.61    21.0466     17.0815  20.7153    40.0398     3.63052     40.0398     
1 1 1 32 7  63 o 19 28.5106 7.94459 20.9061     16.6193  21.3521     16.7722  11.6924    90.5959     3.55428     90.5959     
1 1 1 32 7  64 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 7  65 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 8  0  o 3  113.492 3.3043  230.571     18.7208  230.571     18.7208  138.844    180         107.123     180         
1 1 1 32 8  1  o 7  79.1465 3.7472  125.035     14.4769  101.52      14.8932  53.4283    22.5869     5.86111     202.587     
1 1 1 32 8  2  o 18 32.4478 5.79328 23.7712     9.77254  16.3384     9.20228  5.68566    251.365     18.7732     71.3651     
1 1 1 32 8  3  o 1  81.656  3.2207  119.124     13.9644  120.258     12.2177  33.9069    76.637      50.6903     256.637     
1 1 1 32 8  4  o 18 95.3419 2.93729 168.332     14.7075  157.205     13.2937  62.5633    5.03956     13.5342     185.04      
1 1 1 32 8  5  o 1  52.9017 3.97582 52.6718     11.2947  49.1501     9.42419  37.3587    149.96      9.37604     149.96      
1 1 1 32 8  6  o 2  50.8277 3.86087 49.6253     9.53052  44.3676     9.7811   35.3581    218.577     9.79106     218.577     
1 1 1 32 8  7  o 8  54.3707 3.69543 53.262      9.80852  53.865      10.0812  33.1271    263.875     6.38398     83.8749     
1 1 1 32 8  8  o 14 112.77  2.83106 228.82      15.5368  226.054     16.3932  95.2562    122.738     25.8383     122.738     
1 1 1 32 8  9  f 0  21.5926 5.70294 6.60893     7.81147  6.69928     8.77915  10.8642    337.189     0           0           
1 1 1 32 8  10 o 14 96.8399 2.94239 162.462     13.8362  173.552     14.6599  77.3695    294.205     14.243      294.205     
1 1 1 32 8  11 o 4  115.481 3.02231 234.925     17.4114  242.893     17.5076  105.288    315.011     41.9627     315.011     
1 1 1 32 8  12 o 4  81.2435 3.34027 112.912     13.8142  124.713     13.2001  51.4635    83.9384     14.6563     263.938     
1 1 1 32 8  13 o 11 148.67  3.02522 416.284     22.3118  375.985     22.6553  114.802    314.151     9.3755      314.151     
1 1 1 32 8  14 o 11 37.7303 5.41953 20.8505     9.8664   33.4936     9.93378  15.9722    6.54708     15.9666     186.547     
1 1 1 32 8  15 o 14 90.0961 3.43771 148.025     14.5281  144.348     16.317   68.5316    66.5263     5.87932     66.5263     
1 1 1 32 8  16 o 2  66.5351 3.84249 82.1587     13.0802  78.4617     12.3221  33.8212    185.146     28.4959     5.1455      
1 1 1 32 8  17 o 2  136.054 2.92032 342.436     18.4955  321.02      21.0891  131.284    260.71      62.2763     260.71      
1 1 1 32 8  18 o 14 76.6457 3.07846 121.792     11.7351  90.6291     11.6263  65.1884    291.811     20.3869     291.811     
1 1 1 32 8  19 o 11 42.0344 4.39971 34.5851     9.19265  30.9121     8.78087  13.7938    196.758     30.5218     16.7584     
1 1 1 32 8  20 o 5  26.621  5.48586 9.18024     7.92025  17.273      8.01925  5.8097     339.006     18.5782     159.006     
1 1 1 32 8  21 o 12 57.4957 3.47101 62.0833     9.84915  57.8663     9.94692  40.3037    237.753     0.219466    57.7533     
1 1 1 32 8  22 o 4  112.58  2.8736  228.007     16.1332  226.992     16.2379  91.8029    88.8852     18.9211     88.8852     
1 1 1 32 8  23 o 10 47.8451 4.75101 48.8257     10.4886  36.8292     11.3007  29.4493    263.729     6.81151     83.729      
1 1 1 32 8  24 o 5  59.092  3.92418 72.6031     11.8972  55.6408     11.0062  36.5704    3.09383     10.5669     183.094     
1 1 1 32 8  25 o 16 58.6405 3.76959 68.0417     10.8443  57.723      10.9869  24.0992    306.231     35.6065     126.231     
1 1 1 32 8  26 o 19 44.0439 4.75373 35.9801     10.3417  36.7533     9.96968  32.6213    288.696     7.55773     288.696     
1 1 1 32 8  27 o 14 80.6317 3.3751  128.874     13.287   107.265     13.7245  59.5443    260.92      3.10536     260.92      
1 1 1 32 8  28 o 2  123.875 2.83002 281.676     17.1952  270.444     17.8687  107.55     87.7297     34.8868     87.7297     
1 1 1 32 8  29 o 7  56.1113 4.08405 51.1753     10.6959  65.3249     11.9272  36.3207    131.301     6.02299     311.301     
1 1 1 32 8  30 o 18 47.8244 4.3418  40.2147     9.90091  44.9757     10.4285  25.9628    187.321     14.29       7.3212      
1 1 1 32 8  31 o 13 102.134 2.96125 197.014     14.8855  179.681     15.3137  91.8149    293.428     36.6556     293.428     
1 1 1 32 8  32 o 8  106.508 2.85231 202.974     15.2508  206.078     15.1412  90.7502    174.774     28.0045     174.774     
1 1 1 32 8  33 o 5  32.5078 5.68996 18.5155     9.00887  22.9315     9.46841  19.2681    232.075     0.118682    232.075     
1 1 1 32 8  34 o 2  70.6983 3.35505 94.3855     11.7696  87.6758     11.8495  38.141     65.4307     24.5319     245.431     
1 1 1 32 8  35 o 17 25.8137 5.68674 18.6939     8.41067  4.43515     9.51212  10.9381    216.66      3.33936     36.6599     
1 1 1 32 8  36 o 15 53.9875 3.99798 59.2183     10.2116  48.9407     10.9045  47.4961    198.744     22.0335     198.744     
1 1 1 32 8  37 o 5  31.578  5.74961 18.0303     8.748    21.3952     9.57457  13.6112    234.146     13.1209     54.1464     
1 1 1 32 8  38 o 3  47.8379 4.4444  44.1325     9.9712   41.961      10.7666  37.1198    17.8953     9.59094     17.8953     
1 1 1 32 8  39 o 10 38.4733 5.25512 27.5186     9.43316  30.0795     10.1017  25.0504    8.97578     0.652066    188.976     
1 1 1 32 8  40 o 4  19.5407 5.64325 3.81702     8.22091  3.67976     9.2743   1.38004    139.219     19.0419     319.219     
1 1 1 32 8  41 o 15 26.714  6.1096  13.737      8.72605  14.1239     9.94782  15.3482    34.1046     1.61336     34.1047     
1 1 1 32 8  42 o 11 27.7287 6.12978 18.8182     9.0503   11.0224     10.5173  9.99375    36.0596     15.2668     216.06      
1 1 1 32 8  43 o 11 60.9734 4.00306 50.5444     11.0722  91.7149     12.6043  41.0741    325.128     2.90226     145.128     
1 1 1 32 8  44 o 15 59.6177 4.00184 64.3557     11.6519  69.3364     11.9706  36.0353    53.7655     11.0344     233.766     
1 1 1 32 8  45 o 13 44.9799 5.15399 35.5282     10.7281  44.4896     11.6996  32.6444    144.826     4.75343     144.826     
1 1 1 32 8  46 o 15 58.1457 4.54605 63.1474     13.4358  66.9611     12.5408  48.7335    108.351     17.9927     108.351     
1 1 1 32 8  47 o 7  46.3048 5.03742 46.1866     11.1143  38.6726     11.4003  34.4188    83.2025     6.84575     83.2025     
1 1 1 32 8  48 o 12 53.1379 4.53157 54.2429     11.654   55.1362     11.9933  30.6312    272.442     11.4957     92.4418     
1 1 1 32 8  49 o 9  53.0349 4.79816 41.8036     11.9325  69.8897     12.221   33.6399    280.218     4.79087     100.218     
1 1 1 32 8  50 o 9  24.0239 6.10707 15.6404     9.38618  4.64938     10.5003  9.4012     332.921     7.24669     152.921     
1 1 1 32 8  51 o 7  101.948 3.18567 195.714     15.8335  189.336     16.6079  83.7547    160.719     26.52       160.719     
1 1 1 32 8  52 o 2  21.216  6.13998 10.8109     10.8228  -1.16309    10.8026  2.81591    311.942     17.3787     131.942     
1 1 1 32 8  53 f 0  29.4935 6.7771  23.9281     11.9854  13.7128     11.4282  17.536     73.9711     0           0           
1 1 1 32 8  54 o 10 51.4152 6.28179 65.1787     16.3188  46.7901     14.8197  31.8284    43.9811     5.00847     223.981     
1 1 1 32 8  55 o 9  47.9197 5.95693 53.798      13.2312  42.012      14.1002  29.2044    171.127     5.33749     351.127     
1 1 1 32 8  56 o 15 49.9632 5.79753 48.9975     13.5501  54.7289     14.4817  39.8781    46.7737     14.2831     46.7738     
1 1 1 32 8  57 o 14 34.9948 6.93196 35.8914     12.7515  19.8258     13.6691  15.0496    193.826     14.7924     13.8262     
1 1 1 32 8  58 o 12 65.1385 5.78118 72.4515     17.8932  106.654     18.2777  59.1807    262.025     32.3345     262.025     
1 1 1 32 8  59 o 10 24.0874 7.09018 13.4442     12.9332  4.51778     16.4001  9.5821     345.601     1.84904     345.601     
1 1 1 32 8  60 o 5  23.2342 7.3318  5.27816     18.6495  6.33683     16.1482  6.69173    247.886     10.5945     67.8856     
1 1 1 32 8  61 o 13 22.4887 7.28024 10.6853     19.023   -7.58848    18.4852  5.38423    52.2572     10.7561     232.257     
1 1 1 32 8  62 o 1  26.8459 8.14492 7.23175     20.0457  25.5092     20.1848  8.87117    196.775     1.29447     196.775     
1 1 1 32 8  63 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 9  0  f 0  68.7183 3.74738 85.8058     12.7239  85.8058     12.7239  69.4418    180         0           0           
1 1 1 32 9  1  o 5  79.7159 3.27373 114.656     12.2733  114.029     13.7218  76.0014    356.287     38.267      356.287     
1 1 1 32 9  2  o 9  82.1183 3.41193 118.043     12.4925  124.965     15.3803  53.4742    90.9074     13.251      270.907     
1 1 1 32 9  3  o 4  101.85  3.18089 177.662     15.673   195.125     16.7237  75.1363    250.951     0.112258    70.95       
1 1 1 32 9  4  o 14 98.5181 3.12595 170.035     14.7174  178.524     16.0663  59.6834    158.973     26.4159     338.973     
1 1 1 32 9  5  o 19 63.9368 3.79609 77.2125     11.4545  71.1152     12.5478  21.4259    126.922     50.305      306.922     
1 1 1 32 9  6  o 4  63.8752 3.71098 71.5862     12.1745  76.3031     11.3133  41.3944    232.649     9.04211     52.6494     
1 1 1 32 9  7  o 6  55.2572 4.37868 53.1907     12.1983  58.8092     11.5519  52.4836    165.237     36.1333     165.237     
1 1 1 32 9  8  o 8  81.0599 3.36965 119.948     14.7055  116.852     12.4791  59.3755    8.26449     0.127576    8.26409     
1 1 1 32 9  9  o 13 56.1267 4.06436 59.9989     11.6874  55.0375     10.8588  38.3753    69.8972     2.72349     249.897     
1 1 1 32 9  10 o 7  70.8434 3.33741 92.4385     12.0436  88.6394     11.5199  26.2434    49.9181     51.4911     229.918     
1 1 1 32 9  11 o 6  36.1944 5.30693 19.7007     9.74386  30.2431     8.85985  22.097     170.287     0.312733    170.287     
1 1 1 32 9  12 o 12 74.6415 3.4318  94.1596     12.8981  107.274     12.5652  51.4758    273.283     5.739       93.2832     
1 1 1 32 9  13 o 11 84.9832 2.93985 126.576     12.0763  132.9       12.8893  64.5981    169.389     4.85929     169.389     
1 1 1 32 9  14 o 3  128.306 2.63734 290.544     16.8919  298.801     16.9866  102.714    243.047     15.1995     243.047     
1 1 1 32 9  15 o 15 39.614  4.615   33.2822     8.76686  25.5539     8.81438  21.9542    357.602     8.87573     177.602     
1 1 1 32 9  16 f 0  91.3313 2.82775 165.968     12.8444  134.342     12.8622  52.7271    43.745      0           0           
1 1 1 32 9  17 o 3  101.443 2.76645 190.212     13.3248  179.114     14.664   69.7501    133.981     9.93541     313.981     
1 1 1 32 9  18 o 17 71.3719 3.13568 93.8818     10.8692  89.9726     11.4262  41.9494    207.062     19.8259     27.0616     
1 1 1 32 9  19 o 12 28.4931 5.60788 21.512      8.35574  8.65614     9.28126  7.92655    137.715     1.84492     137.715     
1 1 1 32 9  20 o 15 50.9485 3.73271 42.632      9.09895  52.5705     9.64845  33.0186    111.431     5.2348      291.431     
1 1 1 32 9  21 o 7  103.93  2.72256 189.316     13.6166  198.651     14.6935  77.9363    66.1021     3.38173     66.1021     
1 1 1 32 9  22 o 9  55.5288 3.93366 58.5608     10.1097  54.6016     11.3727  37.7896    324.027     2.73799     144.027     
1 1 1 32 9  23 o 19 17.0318 4.97004 5.93017     7.26119  -6.2769     7.70096  1.40689    328.006     12.3258     328.006     
1 1 1 32 9  24 f 0  53.0677 4.36524 69.4416     10.5403  37.311      11.0131  36.7053    123.636     0           0           
1 1 1 32 9  25 o 6  39.7159 4.73622 35.6475     8.8618   24.3957     9.09588  26.9988    74.2335     18.596      74.2335     
1 1 1 32 9  26 o 11 53.5159 3.95493 55.733      9.51712  49.8315     11.1495  51.6341    5.3715      33.0573     5.3715      
1 1 1 32 9  27 o 14 56.3841 4.17779 73.4138     10.8644  45.6853     11.5484  35.2374    125.672     9.30308     305.672     
1 1 1 32 9  28 o 6  169.904 2.81122 522.795     21.709   516.47      25.9149  151.132    276.118     53.1626     276.118     
1 1 1 32 9  29 o 3  40.7614 5.20546 38.9589     9.17218  25.2105     10.8461  18.4401    72.4931     18.9153     252.493     
1 1 1 32 9  30 o 5  18.8005 5.51974 2.73987     7.73175  2.1233      9.37958  0.482374   1.73658     14.8576     181.737     
1 1 1 32 9  31 o 7  77.5954 3.18139 108.345     12.0717  110.248     12.563   72.2786    210.865     34.3348     210.865     
1 1 1 32 9  32 f 0  42.2317 4.86537 32.1268     9.22543  35.7679     10.6615  20.8677    48.1849     0           0           
1 1 1 32 9  33 o 1  65.3349 3.52355 83.7425     11.0638  72.6942     11.7201  44.4007    135.382     3.99302     315.382     
1 1 1 32 9  34 f 0  30.4338 5.69708 23.3859     8.51787  12.6508     9.7982   33.3875    156.54      0           0           
1 1 1 32 9  35 o 11 66.4075 3.47733 76.1755     10.847   85.5032     12.1428  54.0276    4.25884     14.3235     4.25885     
1 1 1 32 9  36 o 4  22.9104 5.86703 10.4797     8.20725  6.91512     9.34468  8.27778    66.2258     0.664543    246.226     
1 1 1 32 9  37 o 17 43.8393 4.91584 27.2223     9.38913  47.9706     11.3623  32.1355    218.713     4.834       218.713     
1 1 1 32 9  38 o 7  54.6855 4.00177 48.6783     10.1779  63.4499     11.4156  36.7722    158.786     3.14202     338.786     
1 1 1 32 9  39 o 2  17.9547 5.49279 0.0563315   8.24189  0.870477    9.86822  2.79615    116.793     11.6258     296.793     
1 1 1 32 9  40 o 1  35.4247 5.64983 26.849      9.22974  23.5244     10.3731  26.6481    158.835     8.12557     158.835     
1 1 1 32 9  41 o 3  53.9617 4.14805 48.4902     10.4438  61.9261     11.6083  40.4756    150.399     6.03197     150.399     
1 1 1 32 9  42 o 14 20.6312 5.91287 7.68433     9.52347  1.95289     9.77987  5.30074    206.144     12.641      26.1439     
1 1 1 32 9  43 o 12 20.5374 5.8187  7.62655     8.58954  2.59135     9.95727  6.75287    225.188     0.426595    45.1883     
1 1 1 32 9  44 o 9  91.7819 3.41983 152.682     14.9999  159.826     16.3417  94.538     263.124     60.5563     263.124     
1 1 1 32 9  45 o 1  63.0019 3.93589 73.0351     11.3504  77.1809     13.2064  59.9024    278.704     33.5194     278.704     
1 1 1 32 9  46 o 17 23.2916 6.28688 10.5555     8.97238  7.79568     11.7573  7.23483    131.331     12.8117     311.331     
1 1 1 32 9  47 o 19 15.3071 4.96881 -0.484822   8.23795  -11.8516    9.88167  0.241821   167.973     12.4836     167.973     
1 1 1 32 9  48 o 15 23.2714 6.27339 1.20643     10.9488  15.4103     10.7024  9.68194    148.266     2.309       328.266     
1 1 1 32 9  49 o 19 23.4316 6.47727 8.37206     11.3318  10.391      10.7693  9.2257     26.9844     1.6761      206.984     
1 1 1 32 9  50 o 11 22.8138 6.24041 -2.57695    11.5807  15.754      10.8304  7.53834    322.949     8.18128     142.949     
1 1 1 32 9  51 o 10 21.447  6.40507 7.54424     12.0801  1.75409     11.7034  6.47044    245.69      1.30302     65.69       
1 1 1 32 9  52 o 3  72.5579 4.18061 93.3032     14.2925  108.949     15.8599  57.8189    136.873     16.309      136.873     
1 1 1 32 9  53 o 8  24.214  6.75744 10.8823     11.6455  9.4746      12.5941  0.377138   207.361     31.3339     207.361     
1 1 1 32 9  54 o 17 19.2154 5.98954 -13.0364    11.2098  8.66272     12.5918  0.73325    272.392     20.6498     92.3923     
1 1 1 32 9  55 o 9  31.6055 6.86647 10.8923     12.4269  34.023      13.3985  17.1207    314.58      12.1376     314.58      
1 1 1 32 9  56 o 9  23.0376 6.66703 -5.5864     12.1158  18.669      14.1919  9.51223    206.049     2.43923     206.049     
1 1 1 32 9  57 o 10 21.965  6.72949 8.13718     14.4767  2.62871     12.8423  8.42062    251.572     2.38976     71.5721     
1 1 1 32 9  58 o 2  16.8045 5.67589 -16.1625    13.3728  -6.09015    13.5719  1.57567    61.2446     7.90398     241.245     
1 1 1 32 9  59 o 16 38.3696 7.31161 8.33092     20.1246  63.6301     17.1381  26.9845    3.41772     8.32475     3.41772     
1 1 1 32 9  60 o 19 27.9845 8.87828 37.7984     31.1229  8.32066     19.2895  11.9912    63.6662     0.822276    63.6662     
1 1 1 32 9  61 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 9  62 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 10 0  o 4  59.8242 3.57378 65.2992     10.5317  65.2992     10.5317  68.0543    180         46.6763     180         
1 1 1 32 10 1  o 13 96.4473 2.8997  169.774     14.6724  164.288     13.2781  60.2927    149.047     22.8059     329.047     
1 1 1 32 10 2  o 14 77.8637 3.18934 106.282     12.8278  112.319     11.901   62.4692    37.3932     11.0237     37.3932     
1 1 1 32 10 3  o 19 61.8841 3.64942 60.8691     11.3898  78.81       10.7732  60.5289    281.918     35.3606     281.918     
1 1 1 32 10 4  o 11 102.822 3.01212 179.118     15.7355  201.219     15.1564  95.1311    346.15      38.3361     346.15      
1 1 1 32 10 5  o 15 61.7218 3.85159 76.1043     11.564   63.0109     11.8853  36.1158    239.807     17.3626     59.8071     
1 1 1 32 10 6  o 8  64.3541 3.76055 71.737      11.7954  79.015      12.2393  58.4363    9.08236     25.5879     9.08236     
1 1 1 32 10 7  o 12 68.687  3.59994 75.2809     12.0127  96.547      12.494   71.5274    197.32      47.3611     197.32      
1 1 1 32 10 8  o 6  60.1234 3.85157 56.7102     10.997   75.8321     11.8721  61.6208    100.287     43.3816     100.287     
1 1 1 32 10 9  o 19 45.6601 4.5705  40.3705     9.41165  37.1506     10.773   18.7221    210.364     27.1844     30.3638     
1 1 1 32 10 10 o 17 75.3052 3.55447 110.131     11.6537  95.6926     14.5572  54.0625    138.334     2.02493     318.334     
1 1 1 32 10 11 o 15 84.7796 2.93825 131.763     12.3779  126.898     12.5068  60.939     296.401     2.92478     116.401     
1 1 1 32 10 12 o 15 30.0303 5.63711 16.4949     8.83789  18.1905     8.43404  12.1886    2.64818     11.9385     182.648     
1 1 1 32 10 13 o 15 55.5859 3.74073 55.0281     10.0752  57.8306     10.516   22.781     40.1208     34.8822     220.121     
1 1 1 32 10 14 o 2  45.3586 4.19239 38.1598     9.36642  37.9575     9.23708  39.3773    77.5406     26.3049     77.5406     
1 1 1 32 10 15 o 14 43.6064 4.19423 31.9001     8.80175  38.7381     8.99456  14.4455    218.956     32.7593     38.9556     
1 1 1 32 10 16 o 14 68.5286 3.30896 93.2976     11.6089  77.3011     10.9559  33.1696    81.5687     33.8716     261.569     
1 1 1 32 10 17 o 12 17.7741 5.17266 3.66521     7.41753  0.613883    7.51747  27.2422    184.166     77.298      184.166     
1 1 1 32 10 18 o 7  53.5858 3.94673 59.0014     9.96545  46.901      10.6696  29.5271    65.6259     17.5364     245.626     
1 1 1 32 10 19 o 6  12.5002 4.17482 -3.80087    6.86573  -14.3344    7.32748  4.51359    74.4304     13.8308     74.4304     
1 1 1 32 10 20 o 15 48.8448 3.86487 43.3856     9.05625  44.484      9.53856  24.3389    239.523     20.6094     59.5228     
1 1 1 32 10 21 o 3  28.408  5.75417 17.813      8.65373  13.3576     8.68347  9.10973    347.592     16.9669     167.592     
1 1 1 32 10 22 o 6  65.1474 3.29204 81.2449     10.3397  73.1204     10.9431  45.085     101.556     3.71874     281.556     
1 1 1 32 10 23 o 19 20.2831 5.47101 3.97033     7.72876  7.38533     7.82771  2.90514    212.798     7.35349     32.7975     
1 1 1 32 10 24 f 0  55.5288 3.80934 56.0528     10.405   57.3489     10.5301  62.1456    250.853     0           0           
1 1 1 32 10 25 o 13 22.7454 5.53283 13.7119     8.23507  3.41346     7.84861  5.07457    229.964     13.6524     49.9643     
1 1 1 32 10 26 o 15 20.0713 5.44775 2.78001     7.7905   7.8392      7.83306  3.0879     5.52083     8.4808      185.521     
1 1 1 32 10 27 o 1  25.3669 5.70131 12.5829     8.19023  11.7286     8.11025  6.25055    280.105     17.9788     100.105     
1 1 1 32 10 28 o 5  60.6903 3.5992  62.4412     10.8768  72.7675     10.7456  44.2058    181.075     2.05261     181.075     
1 1 1 32 10 29 o 12 66.1969 3.68326 84.6876     11.4296  76.2264     12.666   57.8907    122.76      21.9442     122.76      
1 1 1 32 10 30 o 3  33.3424 5.75365 28.5789     9.28354  15.2461     10.3321  21.1554    249.286     1.02056     249.286     
1 1 1 32 10 31 o 4  36.2068 5.56672 28.1605     9.09513  23.2502     10.5352  19.1195    345.01      10.1665     165.01      
1 1 1 32 10 32 o 12 35.3779 5.56762 16.1233     9.03477  34.2908     10.5589  8.51777    35.4712     31.5874     215.471     
1 1 1 32 10 33 o 8  81.7292 3.34432 124.923     12.1972  119.14      14.8529  70.5689    5.59867     23.7938     5.59866     
1 1 1 32 10 34 o 17 18.2444 5.5046  -0.481218   7.95874  3.00531     9.76172  2.60902    245.168     11.8145     65.1679     
1 1 1 32 10 35 o 2  22.895  6.04194 9.64734     8.36086  7.14535     10.4598  3.07172    182.352     1.01147     182.352     
1 1 1 32 10 36 o 4  102.056 3.11791 195.153     15.3076  185.063     16.4443  72.9483    271.977     1.50324     91.9766     
1 1 1 32 10 37 o 12 24.9154 5.95951 16.5446     8.60476  4.50081     10.6345  13.5315    237.5       0.200039    237.5       
1 1 1 32 10 38 o 19 37.3031 5.73262 36.1546     9.46019  20.2783     11.5569  20.2388    328.455     10.1967     148.455     
1 1 1 32 10 39 o 13 35.0503 5.96376 23.9336     9.2773   26.5432     11.4311  27.2784    335.577     10.1398     335.577     
1 1 1 32 10 40 o 12 85.3672 3.46639 151.416     13.3511  119.432     15.5942  71.6451    319.233     21.7198     319.233     
1 1 1 32 10 41 o 15 19.5038 5.71933 6.54728     8.47798  -1.14772    10.5408  4.9972     64.4069     10.6427     244.407     
1 1 1 32 10 42 o 11 35.368  6.00071 18.6074     9.50116  34.5956     11.8037  21.3007    274.454     4.11277     94.4543     
1 1 1 32 10 43 o 10 24.3639 6.38253 7.38319     9.26616  15.098      11.5399  11.5674    145.606     4.0834      325.606     
1 1 1 32 10 44 o 14 51.5836 4.80072 41.6085     10.6932  64.1341     13.5362  41.8809    8.93704     13.3943     8.93704     
1 1 1 32 10 45 o 15 49.7483 5.33317 51.0819     12.7203  48.5354     13.0173  33.2941    251.008     1.41342     71.0076     
1 1 1 32 10 46 o 1  24.6567 6.44249 8.50502     10.464   14.6914     10.8218  10.375     263.592     6.64282     83.5917     
1 1 1 32 10 47 o 5  39.6223 6.37725 39.341      11.5564  28.2522     13.4017  25.2427    18.968      1.18686     198.968     
1 1 1 32 10 48 o 17 25.8416 6.78849 13.9206     11.1277  12.6775     12.3842  12.5381    312.233     0.654424    132.233     
1 1 1 32 10 49 o 12 38.8755 6.51832 39.0576     12.184   26.8422     13.1282  26.6374    181.747     3.25542     181.747     
1 1 1 32 10 50 o 9  24.2575 6.6696  11.5342     10.9969  9.48945     12.3876  9.66944    258.226     8.46303     78.2263     
1 1 1 32 10 51 o 17 17.8092 5.79077 -2.3063     11.4442  -7.72235    12.4348  4.15802    334.832     2.9227      154.832     
1 1 1 32 10 52 o 11 44.3286 6.37327 58.6187     13.6284  27.9523     13.8722  31.0637    269.529     3.3695      269.529     
1 1 1 32 10 53 o 14 25.2534 7.02855 14.6948     13.203   9.6658      13.0337  11.8981    229.365     5.24132     229.365     
1 1 1 32 10 54 o 16 18.6841 6.04736 -6.24517    13.0566  -0.422658   12.5604  3.59318    24.5833     12.1979     204.583     
1 1 1 32 10 55 o 19 22.1435 6.75988 3.11781     12.77    8.59997     14.5862  8.98433    353.246     1.54825     173.246     
1 1 1 32 10 56 f 0  18.9232 6.1779  -9.91896    13.8551  1.89672     13.8938  7.20524    70.3068     0           0           
1 1 1 32 10 57 o 10 48.148  7.95413 69.1957     20.5832  50.3571     17.2026  34.6197    103.199     7.42814     103.199     
1 1 1 32 10 58 o 13 29.5479 8.7783  46.0842     26.621   8.85314     17.127   14.9971    251.98      1.64994     251.98      
1 1 1 32 10 59 o 7  26.5861 8.62728 24.6414     31.0009  9.33432     20.7666  10.0985    178.309     3.01638     358.309     
1 1 1 32 10 60 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 11 0  o 11 14.4791 6.19678 3.8582      8.28314  3.8582      8.28314  0.210643   0.000240873 0.882706    0.000240873 
1 1 1 32 11 1  o 17 55.2126 4.21628 52.979      10.9881  59.4908     11.9817  39.0457    264.488     0.94558     84.488      
1 1 1 32 11 2  o 4  146.529 2.84615 404.397     19.659   367.427     21.8997  98.7896    149.646     22.6382     329.646     
1 1 1 32 11 3  o 14 53.1986 3.8815  47.2677     9.68318  56.7591     10.7185  45.4465    75.3012     16.6816     75.3012     
1 1 1 32 11 4  o 1  30.5169 5.38916 24.7343     8.11647  10.8501     9.10313  16.2829    248.347     1.81945     68.3468     
1 1 1 32 11 5  f 0  22.0057 5.31921 14.5857     7.8071   -2.98788    8.74957  23.0063    85.3113     0           0           
1 1 1 32 11 6  o 18 45.8788 4.13581 39.3912     9.02221  38.4867     9.54428  20.9573    271.666     23.4363     91.6659     
1 1 1 32 11 7  o 13 52.7445 3.62022 55.6094     9.44227  46.2799     9.38682  50.3392    141.454     29.689      141.454     
1 1 1 32 11 8  o 5  35.4473 4.95332 26.832      8.63021  21.1673     8.34265  22.2517    326.145     0.583106    146.145     
1 1 1 32 11 9  o 1  87.2962 2.93425 132.04      12.6177  142.792     12.9787  55.3922    42.9986     18.7392     222.999     
1 1 1 32 11 10 f 0  35.8682 5.09012 22.5443     8.53039  26.7323     9.1408   4.18874    38.7594     0           0           
1 1 1 32 11 11 o 18 16.7835 5.0508  3.57578     7.42957  -4.55054    8.03637  0.778273   41.7622     8.73354     41.7622     
1 1 1 32 11 12 o 11 77.3366 3.0803  112.256     11.6331  104.099     12.1081  45.8937    212.197     22.3622     32.1972     
1 1 1 32 11 13 o 3  54.1415 4.05106 59.6466     10.7951  48.7391     10.7514  51.8167    264.339     29.9421     264.339     
1 1 1 32 11 14 o 3  21.8695 5.74794 4.82402     8.29208  9.64343     8.68715  0.955528   327.758     22.3141     147.758     
1 1 1 32 11 15 o 17 47.8327 4.10345 46.8861     9.90689  38.1241     9.3257   42.5054    212.787     20.9486     212.787     
1 1 1 32 11 16 o 2  91.6206 3.1191  156.54      14.6463  147.287     13.9151  53.3769    258.388     28.9886     78.3883     
1 1 1 32 11 17 o 11 19.2266 5.53388 7.26954     8.76372  -2.71608    8.73402  0.750548   295.109     20.2568     295.109     
1 1 1 32 11 18 o 3  44.0294 4.68922 49.1524     9.92908  25.6756     9.4771   20.4069    237.128     16.734      237.128     
1 1 1 32 11 19 o 8  30.1983 5.71984 20.7988     9.07208  14.921      8.70721  14.8485    343.829     7.53597     163.829     
1 1 1 32 11 20 o 2  21.6022 5.76759 7.05337     8.51093  6.87657     8.55244  0.920123   117.354     22.6078     297.354     
1 1 1 32 11 21 o 3  53.0237 3.95307 54.2669     9.87373  49.6993     10.7266  29.9958    241.319     16.0218     61.3194     
1 1 1 32 11 22 o 16 53.1808 3.80472 45.2525     9.74799  59.4822     10.1342  54.0507    341.298     38.8748     341.298     
1 1 1 32 11 23 o 14 77.3436 3.1372  104.811     11.6297  112.415     12.5911  46.6873    34.535      19.8315     214.535     
1 1 1 32 11 24 o 15 22.358  5.83871 9.22972     8.73631  6.73703     8.60575  3.2204     100.553     19.0067     280.553     
1 1 1 32 11 25 o 9  22.4969 5.82887 7.13611     8.08535  9.49085     9.10131  6.85342    217.69      6.54169     37.6904     
1 1 1 32 11 26 o 19 28.2468 5.47481 7.46318     8.53757  23.2608     8.64674  10.009     116.799     15.9714     296.799     
1 1 1 32 11 27 o 7  19.6348 5.48941 0.614698    8.03799  7.82084     8.36242  2.85701    30.4474     2.98825     210.447     
1 1 1 32 11 28 o 2  86.4421 3.06337 148.238     13.3543  123.718     13.0424  72.026     320.866     18.341      320.866     
1 1 1 32 11 29 o 15 39.3148 5.28947 23.8936     9.51397  36.8705     10.5633  10.5746    319.275     34.118      139.275     
1 1 1 32 11 30 o 12 46.0704 4.44125 38.559      9.91555  41.7082     10.0493  31.4141    84.9771     1.6295      264.977     
1 1 1 32 11 31 o 2  24.9378 6.07587 13.277      8.77156  9.44953     9.86258  12.9272    46.9302     1.54547     46.9302     
1 1 1 32 11 32 o 14 48.3169 5.12528 65.7382     10.5851  27.8844     11.5497  35.5704    212.522     3.42362     212.522     
1 1 1 32 11 33 o 2  18.2844 5.46423 -2.89049    8.09801  5.68341     9.44322  0.515678   187.038     19.8369     7.03753     
1 1 1 32 11 34 o 3  90.3873 3.1709  145.857     13.3872  153.419     15.2248  56.8925    78.8832     17.3927     258.883     
1 1 1 32 11 35 o 17 19.3945 5.56981 8.1244      8.36878  -3.20815    9.71803  0.757432   145.294     21.8105     325.294     
1 1 1 32 11 36 o 9  54.2566 4.20378 49.1347     10.3944  63.0111     12.1071  38.1675    115.051     0.439542    295.051     
1 1 1 32 11 37 o 15 18.7515 5.68399 -1.91362    8.33829  5.35533     10.7706  0.292309   139.101     23.1066     139.101     
1 1 1 32 11 38 o 15 53.4406 4.36649 54.0159     10.6724  55.4944     12.2299  31.5504    128.874     12.4779     308.874     
1 1 1 32 11 39 o 7  76.7741 3.49501 112.211     12.4944  107.409     14.1435  68.6073    136.65      28.0638     136.65      
1 1 1 32 11 40 o 9  100.314 3.25896 189.122     14.7607  183.512     17.7038  84.901     95.8992     26.1435     95.8992     
1 1 1 32 11 41 o 15 26.2107 6.41714 12.6319     9.68326  15.4581     10.8599  13.9824    9.6452      2.72752     189.645     
1 1 1 32 11 42 o 8  53.2709 4.83397 56.1825     12.0931  55.5705     13.0798  37.7463    178.54      1.51134     178.54      
1 1 1 32 11 43 o 10 21.6242 6.34458 2.36222     10.8561  8.86381     11.8616  6.73763    263.501     9.52557     83.5008     
1 1 1 32 11 44 o 2  41.261  6.42985 35.4065     11.6812  37.861      14.1877  29.4048    58.7624     4.45734     58.7624     
1 1 1 32 11 45 o 3  25.6796 6.78847 10.8176     11.0737  15.4859     12.4667  11.0698    87.1239     6.74477     267.124     
1 1 1 32 11 46 o 17 32.6216 7.08683 16.4473     11.4926  32.3524     14.3644  15.0567    111.137     11.6942     291.137     
1 1 1 32 11 47 o 15 19.2847 6.08828 -0.451665   10.5787  -0.287425   13.3253  4.57303    75.3329     8.67152     255.333     
1 1 1 32 11 48 o 13 20.1652 6.24128 1.60924     10.7725  1.96138     13.2092  6.80368    148.766     4.29252     328.766     
1 1 1 32 11 49 o 18 40.0689 7.023   31.0846     13.1285  41.2313     15.0072  33.8257    339.824     16.9158     339.824     
1 1 1 32 11 50 o 18 46.6396 6.77125 60.2084     13.8363  36.3642     16.6436  34.832     88.1946     7.30638     88.1946     
1 1 1 32 11 51 o 19 76.6824 4.68985 126.264     17.0125  106.737     18.3429  62.2211    191.453     18.3722     191.453     
1 1 1 32 11 52 o 5  23.0055 7.0108  -0.155449   12.6931  13.7362     16.6378  9.27946    125.816     2.55594     125.816     
1 1 1 32 11 53 o 17 29.5333 7.82867 13.0285     13.9116  30.3488     17.7385  18.2439    134.313     3.02177     134.313     
1 1 1 32 11 54 o 14 24.5329 7.54607 13.9581     17.5765  5.31664     17.2851  11.0547    160.497     0.766567    340.497     
1 1 1 32 11 55 o 7  38.7503 8.83567 52.5238     20.4546  35.6527     19.1235  25.4792    311.595     3.2358      311.595     
1 1 1 32 11 56 o 18 19.8378 6.53956 9.22669     16.8465  -24.698     16.6876  3.70197    181.517     5.62956     1.51731     
1 1 1 32 11 57 o 12 33.7775 9.87055 75.5973     33.7397  17.6966     20.0653  14.236     288.564     7.72564     288.564     
1 1 1 32 11 58 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 12 0  o 14 50.0831 4.12721 46.9105     9.99183  46.9105     9.99183  22.2723    0.000286758 19.4937     0.000286758 
1 1 1 32 12 1  o 16 133.25  2.76515 319.652     18.0453  319.446     18.8352  114.9      346.392     29.6842     346.392     
1 1 1 32 12 2  o 7  33.1469 5.39645 17.9969     9.00714  24.7027     8.63513  11.5869    14.144      21.7747     194.144     
1 1 1 32 12 3  o 3  84.4183 2.99572 121.767     12.7371  136.003     12.481   84.8901    225.258     45.8822     225.258     
1 1 1 32 12 4  o 5  27.1058 5.66294 9.58445     8.82479  18.1309     8.19781  12.6063    295.394     1.50062     115.394     
1 1 1 32 12 5  o 12 16.8956 5.07748 3.88197     7.32653  -5.20272    8.43209  2.52875    101.345     18.8747     101.345     
1 1 1 32 12 6  o 16 54.7014 3.79139 49.2922     9.74275  61.0172     10.7693  41.6668    32.5565     4.84298     32.5565     
1 1 1 32 12 7  o 15 46.6367 4.42798 32.9482     9.3485   49.1699     10.7207  24.5612    23.9946     17.6266     203.995     
1 1 1 32 12 8  o 11 39.6377 4.73424 24.9158     8.74658  35.0234     9.31673  27.8432    278.567     2.32086     278.567     
1 1 1 32 12 9  o 16 58.1992 3.57204 60.6142     9.9786   63.3669     10.6513  27.7371    222.103     29.8633     42.1029     
1 1 1 32 12 10 o 7  30.8257 5.5162  18.2864     8.15677  18.7837     8.90119  15.7406    342.921     7.44283     342.921     
1 1 1 32 12 11 o 3  17.4267 5.23226 0.0104396   7.61204  1.8577      8.30207  0.418896   36.4654     6.68924     216.465     
1 1 1 32 12 12 o 6  28.6726 5.72304 16.1308     8.25818  15.8976     8.91449  11.2611    96.4784     13.6431     276.478     
1 1 1 32 12 13 o 16 30.2034 5.54315 17.2736     8.60112  18.3747     8.33282  11.5141    180.996     16.4494     0.995689    
1 1 1 32 12 14 o 4  73.1879 3.25215 95.8545     11.2248  98.9514     12.4917  80.0572    63.4624     55.9204     63.4624     
1 1 1 32 12 15 o 8  27.2441 5.77344 8.64696     8.33127  19.9393     9.28355  7.22393    0.978775    20.3938     180.979     
1 1 1 32 12 16 o 8  28.5581 5.95029 15.9266     8.73104  15.9116     9.46257  12.1105    6.28673     11.3641     186.287     
1 1 1 32 12 17 o 14 74.519  3.14572 97.1425     11.2587  104.636     12.1333  64.148     93.6679     19.4009     93.6679     
1 1 1 32 12 18 o 5  25.6283 5.90942 15.5789     8.73202  8.60793     9.12685  10.9503    74.2012     5.81728     254.201     
1 1 1 32 12 19 f 0  36.6041 5.43238 29.978      9.34593  22.3658     9.94993  40.534     298.657     0           0           
1 1 1 32 12 20 o 19 53.7776 3.91099 53.6178     10.7145  53.416      10.053   32.808     352.514     11.8872     172.514     
1 1 1 32 12 21 o 3  56.0629 4.00754 55.7007     11.0838  60.9166     11.1053  48.6506    302.154     17.8481     302.154     
1 1 1 32 12 22 o 18 17.1133 5.16109 5.08465     8.3785   -7.08072    8.15242  0.447885   161.195     1.8617      341.195     
1 1 1 32 12 23 o 1  88.1133 3.13217 135.728     13.95    146.682     13.5877  79.6758    169.428     30.2644     169.428     
1 1 1 32 12 24 o 6  50.9589 4.38593 46.9885     11.6667  50.6008     10.0935  43.29      339.594     15.0772     339.594     
1 1 1 32 12 25 o 6  18.3267 5.3069  6.55162     8.09505  -2.50432    8.08604  1.5576     155.723     1.61281     335.723     
1 1 1 32 12 26 o 11 86.2336 3.14649 139.707     13.458   131.358     13.6283  70.0895    279.224     13.8519     279.224     
1 1 1 32 12 27 o 5  45.0244 4.63991 35.1426     10.1596  42.3302     10.0688  26.4543    155.676     10.9782     335.676     
1 1 1 32 12 28 o 6  55.9102 3.77649 61.32       10.3939  54.9323     10.4754  43.6742    113.433     7.21856     113.433     
1 1 1 32 12 29 o 4  33.5411 5.84019 13.7595     10.2019  32.0638     10.1905  20.3445    210.805     4.38172     30.8047     
1 1 1 32 12 30 o 16 21.9549 5.82692 6.95873     8.84044  8.72826     8.55896  8.22398    281.326     8.73421     101.326     
1 1 1 32 12 31 o 16 37.5201 5.28147 23.6506     9.5156   32.4595     9.63402  28.8077    135.338     7.11969     135.338     
1 1 1 32 12 32 o 19 34.4244 5.4726  20.7412     9.3045   27.091      9.16958  17.3363    3.48669     12.5801     183.487     
1 1 1 32 12 33 f 0  27.1431 5.93968 16.011      8.94061  13.8872     8.89383  9.46423    27.0214     0           0           
1 1 1 32 12 34 o 6  52.3072 4.47262 55.8269     10.6799  49.4278     12.057   36.6691    271.445     0.987985    91.4455     
1 1 1 32 12 35 o 16 23.6108 6.15732 2.82313     10.023   15.7135     10.2854  12.4432    18.3659     0.570452    18.3659     
1 1 1 32 12 36 o 18 33.4664 6.06217 20.228      9.54163  27.0417     10.9382  24.3513    99.615      5.56792     99.615      
1 1 1 32 12 37 o 5  46.2327 5.01457 31.8902     10.4128  54.2917     11.7958  31.9081    208.308     0.628809    28.3077     
1 1 1 32 12 38 o 15 84.885  3.53031 140.64      14.449   128.974     15.3641  64.0706    326.275     6.09962     326.275     
1 1 1 32 12 39 o 9  36.5739 6.54887 37.1687     11.7804  20.9492     13.126   21.2026    325.93      6.7104      145.93      
1 1 1 32 12 40 o 12 48.7331 5.7417  61.8819     12.2814  36.8338     13.7646  31.4087    287.902     4.8559      107.902     
1 1 1 32 12 41 o 1  19.409  5.94463 -4.21798    10.1079  6.88445     11.5812  3.41955    46.1846     13.3201     226.185     
1 1 1 32 12 42 o 13 27.1894 6.89288 8.08645     11.3865  22.7246     13.2224  14.8017    345.198     4.34772     345.198     
1 1 1 32 12 43 o 19 29.5312 6.95033 20.9418     11.5021  17.4576     12.776   16.4492    241.645     2.27211     61.6449     
1 1 1 32 12 44 o 13 54.3328 5.48153 46.0992     13.0447  76.1904     15.7847  44.2954    272.476     14.1323     272.476     
1 1 1 32 12 45 f 0  26.0825 7.02433 13.1078     12.456   14.0372     12.9837  14.001     35.8596     0           0           
1 1 1 32 12 46 o 8  48.2017 6.19187 49.2915     13.5526  49.1485     15.2067  40.975     244.67      17.1741     244.67      
1 1 1 32 12 47 o 7  14.9549 5.10795 -12.5947    11.2317  -16.0413    11.9605  1.68777    57.0221     6.44937     237.022     
1 1 1 32 12 48 o 3  17.9879 5.88965 -13.0384    11.4518  1.42976     13.717   3.87116    248.637     1.35842     68.6365     
1 1 1 32 12 49 o 19 53.0393 6.47004 64.8198     15.0706  57.9569     17.7191  42.4508    300.856     12.8449     300.856     
1 1 1 32 12 50 o 19 36.3462 8.12264 33.6758     16.388   33.7963     16.7328  22.6172    316.102     1.68692     136.102     
1 1 1 32 12 51 o 2  40.4149 7.84684 52.7615     16.891   30.3757     17.2258  26.0329    65.5115     0.790472    245.511     
1 1 1 32 12 52 o 1  26.6266 7.55873 23.8609     15.9466  6.82918     16.1171  13.5936    318.132     1.72988     138.132     
1 1 1 32 12 53 o 6  19.1089 6.47721 -14.054     20.6167  -7.04579    15.1503  2.89462    296.952     2.59606     116.952     
1 1 1 32 12 54 o 14 24.0111 7.7372  3.29772     26.9436  9.99801     16.0083  4.42141    98.4925     0.526235    98.4925     
1 1 1 32 12 55 o 3  20.9562 6.79496 -6.7266     17.9369  6.93794     15.3643  4.27341    40.3455     4.81915     220.346     
1 1 1 32 12 56 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 13 0  o 11 58.5533 3.46808 62.7892     10.0063  62.7892     10.0063  46.0903    180         3.27503     180         
1 1 1 32 13 1  o 17 29.8326 5.50413 15.8369     8.35132  19.006      8.3193   8.25924    156.601     23.6394     336.601     
1 1 1 32 13 2  o 17 56.1679 3.66027 63.0614     9.88382  53.0935     10.3627  38.1917    341.47      5.55329     161.47      
1 1 1 32 13 3  o 15 14.5278 4.65703 -1.94825    7.34953  -5.56241    7.38086  2.13068    295.949     11.6428     295.949     
1 1 1 32 13 4  o 1  64.4121 3.3558  77.9309     10.9888  73.5175     10.5255  40.4027    59.3004     14.3378     239.3       
1 1 1 32 13 5  o 5  129.288 2.66693 290.585     17.5811  311.699     16.8913  121.313    153.515     48.3592     153.515     
1 1 1 32 13 6  o 2  64.5    3.56076 78.7299     11.2291  73.7028     11.5801  57.1725    179.519     20.4261     179.519     
1 1 1 32 13 7  o 18 84.1023 3.05588 129.212     12.8887  127.267     12.7843  76.4696    73.3878     28.322      73.3878     
1 1 1 32 13 8  o 18 55.334  3.86461 48.3385     10.5896  65.3347     10.2702  51.0214    96.2459     23.4654     96.2459     
1 1 1 32 13 9  o 5  22.7569 5.74221 7.96488     8.17772  9.74079     8.37693  2.37217    252.479     33.9513     252.479     
1 1 1 32 13 10 o 12 48.3131 4.08477 38.9126     9.50381  48.2101     9.80971  41.2922    27.4941     14.9845     27.4941     
1 1 1 32 13 11 o 7  53.0657 3.81029 51.5157     9.8387   52.5007     10.146   55.1015    161.171     39.1975     161.171     
1 1 1 32 13 12 o 13 42.1292 4.82192 33.2508     9.56676  34.3833     10.0978  26.1009    250.152     7.07708     70.1524     
1 1 1 32 13 13 o 8  15.9265 4.99787 0.164478    7.67146  -5.01124    8.46546  2.48158    207.258     18.4109     207.258     
1 1 1 32 13 14 o 18 71.2376 3.34134 92.1783     11.7314  93.1044     11.9906  61.1721    162.603     17.8578     162.603     
1 1 1 32 13 15 o 13 28.0461 6.21337 15.1784     9.44179  15.5235     9.97998  0.132377   295.324     38.5633     295.325     
1 1 1 32 13 16 o 12 83.1946 3.14246 131.41      12.4707  120.459     13.5408  64.582     315.702     5.91485     315.702     
1 1 1 32 13 17 o 16 68.9465 3.35159 84.2775     11.1478  89.5906     11.8746  47.9581    258.406     5.58961     78.4061     
1 1 1 32 13 18 o 19 57.2733 4.22744 57.2886     11.1205  65.3829     12.8011  56.0225    246.605     30.9988     246.605     
1 1 1 32 13 19 o 19 42.8933 5.21384 34.1325     9.81245  37.128      11.7688  30.4252    174.205     0.787947    174.205     
1 1 1 32 13 20 o 15 114.399 2.86113 233.13      15.9925  241.045     16.7618  110.697    191.585     51.4962     191.585     
1 1 1 32 13 21 o 5  34.0712 5.87395 26.0814     8.93367  20.1684     11.1531  26.7341    148.173     11.2504     148.173     
1 1 1 32 13 22 o 8  94.1606 3.01179 158.003     13.6856  164.639     14.6628  63.897     108.891     11.9027     288.891     
1 1 1 32 13 23 o 16 24.6842 5.88029 17.1321     9.11627  4.07771     9.40265  9.06228    10.7956     3.94477     10.7956     
1 1 1 32 13 24 o 11 56.9326 4.05788 61.6132     12.1347  59.8354     10.6641  29.6494    205.961     23.9097     25.9609     
1 1 1 32 13 25 o 15 19.0947 5.54758 5.29027     8.84933  1.55252     8.25638  5.11621    159.727     9.56471     339.727     
1 1 1 32 13 26 o 6  39.8117 5.24202 33.315      10.4585  29.2482     9.69589  19.587     66.0162     17.3163     246.016     
1 1 1 32 13 27 o 9  18.1783 5.41977 6.1936      9.10662  -3.7869     8.33113  4.73034    141.359     3.46742     321.359     
1 1 1 32 13 28 o 9  55.3974 4.11277 56.6698     11.7419  59.3902     10.6755  36.3032    131.778     7.555       311.778     
1 1 1 32 13 29 o 11 57.4116 4.55513 69.4538     13.6566  57.423      12.1151  39.9723    42.5673     3.02343     222.567     
1 1 1 32 13 30 o 9  24.4602 5.76106 2.01122     8.82496  19.412      9.52427  10.8712    260.475     9.01504     80.4754     
1 1 1 32 13 31 f 0  96.5232 2.99547 179.641     14.1372  162.566     14.7036  58.707     313.923     0           0           
1 1 1 32 13 32 o 14 28.3714 5.68412 6.55202     9.44107  25.6745     9.33553  20.2242    226.592     7.97415     226.592     
1 1 1 32 13 33 o 10 20.4845 5.58266 11.723      8.67793  -1.50942    8.87891  6.07385    85.5681     11.5153     265.568     
1 1 1 32 13 34 o 11 25.2283 6.25211 12.5799     10.2602  12.8703     9.29492  11.6645    256.09      5.5291      256.09      
1 1 1 32 13 35 f 0  19.0889 5.78804 2.34377     10.2734  2.1679      9.53862  22.4646    121.344     0           0           
1 1 1 32 13 36 o 10 57.2687 4.72939 53.0973     12.618   76.6339     13.7925  51.7416    236.638     23.0547     236.638     
1 1 1 32 13 37 o 15 29.5441 6.80208 15.9814     11.1061  22.2356     12.1041  16.7073    12.4662     3.70839     192.466     
1 1 1 32 13 38 o 9  39.2967 6.33989 31.4477     11.7714  35.1277     12.653   20.453     140.45      12.9283     320.45      
1 1 1 32 13 39 o 18 36.0666 6.64372 27.1695     11.625   30.3328     12.6328  27.2373    247.8       9.05343     247.8       
1 1 1 32 13 40 o 5  24.9556 6.74473 9.85038     11.5525  14.1313     12.0345  10.1662    118.771     8.23752     298.771     
1 1 1 32 13 41 o 13 44.8747 6.59176 45.1231     14.1298  42.6481     14.5452  26.1106    242.21      9.50459     62.2096     
1 1 1 32 13 42 o 19 36.8671 7.00729 31.1141     12.9055  30.3551     13.5571  24.2729    76.9324     0.0617139   76.9327     
1 1 1 32 13 43 o 19 63.2837 4.97161 68.2478     14.9864  92.0681     15.7803  49.2509    158.906     9.5265      158.906     
1 1 1 32 13 44 o 1  27.7813 7.10525 10.9544     12.7282  21.8205     13.2454  15.6469    67.0959     2.93362     247.096     
1 1 1 32 13 45 o 9  23.8364 7.02101 4.59589     13.3509  12.4048     14.592   12.673     25.2906     2.18434     25.2906     
1 1 1 32 13 46 o 4  26.8591 7.26391 17.7066     13.1267  12.4745     14.4855  16.5455    139.831     2.92388     139.831     
1 1 1 32 13 47 o 4  25.1031 7.51069 -1.5911     20.1595  16.5504     14.9757  13.9125    108.637     1.59518     108.637     
1 1 1 32 13 48 o 12 33.8849 7.6834  14.9572     16.7892  41.2263     15.8111  22.7472    95.6383     2.58731     95.6383     
1 1 1 32 13 49 o 17 46.5994 7.46901 73.7127     17.9723  34.8467     17.3694  37.3736    191.362     13.0835     191.362     
1 1 1 32 13 50 o 10 29.2298 7.90919 21.1216     16.8028  23.5346     15.673   17.5845    27.2154     3.44467     27.2154     
1 1 1 32 13 51 o 3  19.9174 6.39917 13.2017     15.4272  -25.071     15.0508  2.13961    247.757     0.816798    67.7566     
1 1 1 32 13 52 o 16 21.0048 6.69114 12.5625     15.6506  -10.3611    15.3119  5.29298    147.516     6.85399     327.516     
1 1 1 32 13 53 o 2  20.7982 6.78715 8.55645     17.6216  -7.11148    15.401   3.7436     110.001     3.43664     290.001     
1 1 1 32 13 54 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 14 0  o 2  60.3596 3.47592 66.7477     10.3485  66.7477     10.3485  61.4561    180         31.0804     180         
1 1 1 32 14 1  o 8  49.8488 4.04523 38.633      9.5685   54.628      10.0813  46.9788    243.55      24.1938     243.55      
1 1 1 32 14 2  o 16 77.8808 3.10473 116.343     11.7852  104.438     12.2866  64.2404    139.392     12.5052     139.391     
1 1 1 32 14 3  o 2  31.1334 5.61711 17.8468     9.06032  20.4613     8.56352  21.457     136.86      8.25368     136.86      
1 1 1 32 14 4  o 2  59.743  3.53149 64.4225     10.559   66.7505     10.3865  51.1015    298.279     14.9821     298.279     
1 1 1 32 14 5  o 8  82.8365 3.09099 129.273     12.4121  120.312     13.1083  83.5834    344.403     44.4874     344.403     
1 1 1 32 14 6  o 15 85.636  3.00887 137.64      13.1296  128.734     12.6164  78.0482    230.919     28.4726     230.919     
1 1 1 32 14 7  o 12 84.6775 3.01236 122.677     12.7693  137.975     12.6723  69.8354    266.301     13.2081     266.301     
1 1 1 32 14 8  o 19 50.1486 4.15847 44.9775     10.553   49.1216     9.87369  46.9652    74.6062     23.3478     74.6062     
1 1 1 32 14 9  o 6  21.6812 5.76861 12.2739     9.58241  1.39247     8.11624  3.29573    161.214     0.0728824   341.214     
1 1 1 32 14 10 o 8  41.6065 4.68376 33.6853     9.6504   32.3979     9.22802  32.2388    314.203     6.44814     314.203     
1 1 1 32 14 11 o 5  28.3555 5.80463 14.7804     8.88616  17.0053     8.59567  11.2302    78.8226     15.2142     258.823     
1 1 1 32 14 12 o 6  29.0297 5.85526 15.1071     8.95191  18.3853     8.97451  11.0934    92.9929     16.9005     272.993     
1 1 1 32 14 13 f 0  51.0934 4.12407 53.4771     10.5467  44.4534     10.1471  34.1538    271.441     0           0           
1 1 1 32 14 14 o 1  38.4079 5.27094 14.0646     10.0408  46.3038     9.59459  31.9979    122.914     24.0279     122.914     
1 1 1 32 14 15 o 8  70.0798 3.62648 98.6964     12.3844  82.7833     12.7804  72.1439    136.815     41.9748     136.815     
1 1 1 32 14 16 o 15 23.6534 5.82349 5.44883     8.50031  14.3378     8.97955  9.12357    116.993     2.87429     116.993     
1 1 1 32 14 17 o 1  70.8656 3.45    84.8189     12.3089  100.331     11.9309  68.3922    76.6796     32.6952     76.6796     
1 1 1 32 14 18 o 12 42.9232 4.69934 34.6957     9.63644  36.1493     9.92865  30.5202    151.698     0.219076    331.697     
1 1 1 32 14 19 o 11 80.29   3.22757 114.809     12.3426  121.629     13.5214  77.6987    47.1345     36.8009     47.1345     
1 1 1 32 14 20 o 9  40.6313 5.17524 36.5429     9.70466  28.4749     10.4485  30.5258    71.8116     3.93612     71.8116     
1 1 1 32 14 21 o 9  31.7683 5.89116 22.616      9.12689  18.4596     9.97855  10.9143    282.797     22.624      102.797     
1 1 1 32 14 22 o 13 46.6865 4.65249 47.5392     9.97182  36.7241     10.8428  24.4969    289.847     18.7983     109.847     
1 1 1 32 14 23 o 7  63.3534 3.95282 77.7605     11.393   73.0725     13.2661  49.4757    40.183      6.13048     40.183      
1 1 1 32 14 24 o 2  30.5741 6.20248 21.8008     9.15947  16.6441     11.2392  23.3209    19.3406     13.2498     19.3406     
1 1 1 32 14 25 o 12 24.3461 6.27862 11.0811     8.73605  10.765      11.2822  13.9548    216.835     3.39803     216.835     
1 1 1 32 14 26 o 1  40.8295 5.72619 31.9601     10.6499  36.1061     11.9635  39.9232    19.8995     27.6861     19.8995     
1 1 1 32 14 27 o 3  28.222  5.95159 23.7372     9.09071  6.74253     11.2636  20.2237    1.12102     7.52849     1.12102     
1 1 1 32 14 28 o 2  55.0482 4.52612 59.2483     12.3132  58.0826     12.1939  40.0623    302.699     0.538968    302.699     
1 1 1 32 14 29 o 16 21.506  5.94371 8.45698     9.50681  6.17417     9.0744   9.58352    165.866     0.0145393   345.865     
1 1 1 32 14 30 o 13 18.7203 5.67747 -5.07184    10.8751  5.78531     9.15175  3.98064    187.785     0.833058    7.7845      
1 1 1 32 14 31 o 6  45.3551 5.57827 53.525      12.794   31.8781     11.4716  43.5978    158.323     25.9875     158.323     
1 1 1 32 14 32 o 4  15.9618 5.23007 -9.63069    10.9035  -2.86708    9.26655  1.98985    340.173     4.20501     160.173     
1 1 1 32 14 33 o 2  19.7833 6.0285  2.59643     11.4004  2.44466     10.2936  1.84392    212.901     19.9467     32.9006     
1 1 1 32 14 34 o 18 48.4094 5.42649 54.0749     13.2826  41.829      12.1344  46.0881    45.2819     26.4546     45.2819     
1 1 1 32 14 35 o 19 31.5581 6.77739 21.5366     12.1686  22.7853     11.2062  16.0011    13.4798     9.52174     193.48      
1 1 1 32 14 36 o 13 16.758  5.4182  -10.8318    10.7923  0.634178    10.1723  1.88476    290.186     5.19884     110.186     
1 1 1 32 14 37 o 6  23.823  6.45739 15.3982     11.4645  5.06983     10.6671  10.6296    175.577     0.871051    355.577     
1 1 1 32 14 38 o 1  25.1918 6.64905 15.9397     11.8485  9.41285     10.8425  12.8958    274.586     2.47389     274.586     
1 1 1 32 14 39 o 16 29.6773 7.20292 19.6182     12.4965  20.0773     13.3704  13.8023    324.336     10.7387     144.336     
1 1 1 32 14 40 o 7  23.3581 6.78924 6.80959     12.3207  9.95911     13.2134  11.5598    260.257     0.220184    260.257     
1 1 1 32 14 41 o 10 24.2231 6.7913  15.8064     12.0883  1.90538     13.9337  1.73345    193.669     35.6481     193.669     
1 1 1 32 14 42 o 11 30.9975 7.46618 24.9284     13.2235  19.3494     14.9874  15.6604    271.754     9.41315     91.7543     
1 1 1 32 14 43 o 6  25.0279 7.12204 21.7107     15.0842  -3.95143    14.8212  14.3974    202.681     4.52667     202.681     
1 1 1 32 14 44 o 2  22.8177 6.97901 8.06945     15.17    4.24556     14.1257  10.7046    189.975     2.39805     189.975     
1 1 1 32 14 45 o 4  22.1906 6.90341 -8.33021    15.3416  12.9295     15.7012  10.219     349.082     0.781461    349.082     
1 1 1 32 14 46 o 10 66.9578 5.95613 119.041     19.1965  76.1256     18.7832  53.602     270.681     13.4666     270.681     
1 1 1 32 14 47 o 11 31.0861 7.97625 31.5269     16.5687  19.7897     15.9764  17.9316    335.784     2.54442     155.784     
1 1 1 32 14 48 o 10 18.286  6.06216 -18.9398    14.8486  2.80686     14.2166  3.09027    307.05      9.9106      127.05      
1 1 1 32 14 49 o 14 22.9634 7.1604  3.39365     16.7173  12.0108     15.8295  8.29714    293.214     5.0347      113.214     
1 1 1 32 14 50 o 14 29.7267 8.16729 26.5398     18.2547  25.1461     16.6551  16.5933    296.86      3.25801     296.86      
1 1 1 32 14 51 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 14 52 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 15 0  o 1  56.1127 3.78368 58.3806     10.4038  58.3806     10.4038  46.0503    360         6.54785     360         
1 1 1 32 15 1  o 4  48.4937 4.17923 41.4239     10.05    47.2012     9.77011  46.1898    350.532     23.3845     350.532     
1 1 1 32 15 2  o 10 28.8008 5.77067 17.8582     8.75923  15.326      8.68698  19.4416    88.7947     3.21515     88.7947     
1 1 1 32 15 3  o 6  43.5692 4.69176 35.99       9.45501  36.801      10.3703  34.0388    299.03      5.69211     299.03      
1 1 1 32 15 4  o 18 39.5421 5.03755 30.5746     9.43499  30.2987     9.7917   20.4383    248.878     16.2553     68.8781     
1 1 1 32 15 5  o 11 26.4799 5.8111  10.054      8.66639  17.3344     8.72425  15.5174    33.2086     1.60185     213.209     
1 1 1 32 15 6  o 14 35.1804 5.27381 21.9        9.04126  27.0749     8.98786  13.5063    332.73      23.4715     152.73      
1 1 1 32 15 7  o 15 62.267  3.50599 73.2398     10.8303  69.9567     10.8636  48.6203    303.097     4.76136     303.097     
1 1 1 32 15 8  o 4  51.7894 3.96893 48.9583     10.1399  51.5557     10.1254  54.7874    186.983     36.5404     186.983     
1 1 1 32 15 9  o 2  36.767  5.22031 26.9742     9.38345  26.3381     9.18525  26.7005    124.007     1.96959     124.007     
1 1 1 32 15 10 o 4  53.8647 3.93895 47.7761     10.4064  61.277      10.3856  45.7184    112.083     12.5713     112.083     
1 1 1 32 15 11 o 19 77.4644 3.13702 104.852     12.0657  115.087     12.1718  62.1952    324         8.45355     324         
1 1 1 32 15 12 o 4  35.8652 5.39162 18.5981     9.67446  33.2352     9.23041  30.8711    359.596     14.0099     359.596     
1 1 1 32 15 13 o 4  119.101 2.96575 252.222     17.1761  265.368     18.1741  111.817    306.017     44.267      306.017     
1 1 1 32 15 14 o 4  54.9957 4.1396  57.2535     11.0779  56.9716     11.3856  46.0143    277.646     11.4798     277.646     
1 1 1 32 15 15 o 5  48.4567 4.47309 44.7453     11.1247  45.1839     10.0292  32.0705    161.99      6.725       341.99      
1 1 1 32 15 16 o 14 16.6154 5.23056 -7.10069    9.42444  1.56753     8.64517  2.81999    53.9998     9.87733     234         
1 1 1 32 15 17 o 4  68.8096 3.5273  89.2308     12.1852  86.6962     11.9765  70.58      323.898     40.1198     323.898     
1 1 1 32 15 18 o 14 35.7076 5.54761 34.2381     9.79436  18.1747     9.78343  12.5339    349.952     26.2265     169.952     
1 1 1 32 15 19 o 17 60.9177 3.884   66.0039     11.093   73.8554     12.3755  39.857     279.667     10.4257     99.6666     
1 1 1 32 15 20 o 5  34.1127 5.81886 27.256      9.36458  20.7831     10.4518  29.214     316.057     14.403      316.057     
1 1 1 32 15 21 o 3  42.3985 4.89514 32.8851     9.82467  38.0889     10.2481  37.5141    301.73      15.6006     301.73      
1 1 1 32 15 22 o 4  34.6203 5.62961 29.7377     9.46388  19.7829     9.83341  27.3145    198.362     7.94693     198.362     
1 1 1 32 15 23 o 11 25.2348 6.06523 13.0695     9.13664  12.4918     9.19244  15.1373    209.891     0.245004    209.891     
1 1 1 32 15 24 o 7  42.3664 4.97713 37.8722     10.1963  33.6195     10.1723  32.4232    55.2115     4.83821     55.2115     
1 1 1 32 15 25 o 6  37.6305 5.67092 25.7908     10.7066  32.9186     10.041   30.8437    190.711     10.483      190.711     
1 1 1 32 15 26 f 0  16.8142 5.27063 -12.3685    9.8399   4.46934     9.20098  2.05461    216.538     0           0           
1 1 1 32 15 27 o 14 45.1314 5.58676 37.5537     11.703   46.2685     12.6434  32.9045    44.4796     1.68277     44.4796     
1 1 1 32 15 28 o 14 22.5065 6.84465 1.806       10.4169  10.2255     16.9635  10.3799    33.6395     0.649889    213.64      
1 1 1 32 15 29 o 16 24.9021 6.94074 12.8831     11.3093  8.68665     14.6843  13.5858    317.984     2.45146     317.984     
1 1 1 32 15 30 o 18 26.8295 7.10985 16.4111     11.6028  12.4533     14.7245  7.12297    70.9864     21.2433     250.986     
1 1 1 32 15 31 o 14 39.3283 7.41399 29.9415     12.6256  42.2351     17.1766  21.4423    138.781     11.6914     318.781     
1 1 1 32 15 32 f 0  24.357  6.98014 6.40708     11.4391  14.4724     15.0143  16.6618    182.954     0           0           
1 1 1 32 15 33 o 18 21.7263 6.37476 -5.25239    12.9792  12.5258     11.658   8.01627    113.157     4.61726     293.157     
1 1 1 32 15 34 o 11 16.3047 5.45969 -9.36896    12.4711  -9.42813    11.2388  0.779785   23.2905     12.088      203.291     
1 1 1 32 15 35 o 19 22.7801 6.66003 11.7398     12.9896  2.92315     12.0462  9.00221    175.063     7.33666     355.063     
1 1 1 32 15 36 o 16 25.2397 6.50697 24.8222     13.2543  -1.74278    10.606   14.4082    58.5279     2.34365     58.5279     
1 1 1 32 15 37 o 8  24.938  6.86226 17.8306     13.5399  5.58726     11.5515  5.32043    251.166     21.9118     71.1658     
1 1 1 32 15 38 o 16 30.3887 7.77348 33.7594     18.7087  11.2706     12.0045  20.6992    133.993     3.63086     133.993     
1 1 1 32 15 39 o 6  30.0425 7.16859 38.4418     16.5303  2.34726     12.2076  12.1833    109.708     15.9124     289.708     
1 1 1 32 15 40 o 11 46.4604 6.77692 62.3299     16.8524  36.0416     13.8573  30.4497    90.794      4.06928     270.794     
1 1 1 32 15 41 o 9  31.0091 7.73682 16.3909     15.82    29.8438     15.1625  19.1709    171.516     1.4707      351.516     
1 1 1 32 15 42 o 7  34.3281 8.33268 37.0707     17.595   25.1134     17.5985  20.861     52.6935     3.47831     232.693     
1 1 1 32 15 43 o 4  32.6489 8.27135 29.3846     16.8222  27.7361     17.5739  19.5091    280.784     3.12421     100.784     
1 1 1 32 15 44 o 18 26.0966 7.50833 -2.09419    16.425   27.4741     17.1093  14.5509    139.523     4.16534     139.523     
1 1 1 32 15 45 o 3  56.3303 7.50652 71.0512     19.582   86.2056     21.2612  49.2153    126.124     21.5008     126.124     
1 1 1 32 15 46 o 5  30.9881 8.39634 28.025      18.1398  28.8083     18.3538  16.0658    50.3338     6.01341     230.334     
1 1 1 32 15 47 o 7  19.2905 6.42787 -1.54184    15.9219  -7.48346    16.3754  3.09724    180.848     3.15365     0.848242    
1 1 1 32 15 48 o 19 32.9883 8.15714 47.7791     18.0699  14.739      20.0655  18.811     136.828     2.16533     316.828     
1 1 1 32 15 49 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 15 50 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 16 0  o 12 11.7928 5.47144 -0.563856   8.1042   -0.563856   8.1042   0.874729   360         6.52694     360         
1 1 1 32 16 1  o 15 31.2002 5.76407 25.4515     9.18759  14.4041     9.54225  19.907     88.7467     3.02421     268.747     
1 1 1 32 16 2  o 13 58.6907 3.8098  55.3059     11.0074  74.4962     10.8953  62.066     140.819     38.5271     140.819     
1 1 1 32 16 3  o 17 14.2619 4.66531 -2.67736    7.92328  -8.57834    7.97197  0.820171   209.144     7.81587     29.1445     
1 1 1 32 16 4  o 13 40.1433 5.19837 31.8443     10.0429  32.1361     10.1022  29.2123    6.07979     0.753671    6.07977     
1 1 1 32 16 5  o 1  29.1935 5.92907 17.7634     9.26602  17.2989     8.99623  16.2903    130.61      11.1055     130.61      
1 1 1 32 16 6  o 2  55.483  3.86824 62.0382     10.5541  53.9443     10.6193  48.8133    137.894     15.7902     137.894     
1 1 1 32 16 7  o 3  42.4522 4.77584 34.3301     9.79509  36.0638     9.84201  26.7315    168.752     8.50284     348.752     
1 1 1 32 16 8  o 9  15.8031 4.98854 0.59048     8.22967  -4.97079    8.03512  2.60993    318.948     7.48226     138.948     
1 1 1 32 16 9  o 15 22.0975 5.57625 15.4726     8.82753  -1.18301    8.71176  6.45623    153.021     15.7877     333.021     
1 1 1 32 16 10 o 13 39.1065 5.15952 35.2071     9.89038  26.05       9.54974  16.3149    56.4686     24.5193     236.469     
1 1 1 32 16 11 o 6  45.8362 4.67898 45.1142     10.8353  36.9117     10.0207  39.3451    147.421     12.4906     147.421     
1 1 1 32 16 12 o 11 33.6333 5.74868 22.4771     9.46846  24.2287     9.69832  29.5908    200.313     19.2999     200.313     
1 1 1 32 16 13 o 8  102.786 3.11501 191.808     16.091   197.446     15.9194  96.3654    124.991     37.8798     124.991     
1 1 1 32 16 14 o 10 46.4894 4.58767 37.5765     10.2243  46.7752     10.4765  34.1154    340.799     0.368063    340.799     
1 1 1 32 16 15 o 6  29.7773 6.26187 17.67       10.7307  19.7113     9.4455   8.43511    140.374     25.1601     320.374     
1 1 1 32 16 16 o 19 24.3811 6.04433 12.2344     9.14487  11.06       9.11861  11.4248    171.595     8.48718     351.595     
1 1 1 32 16 17 o 8  56.7984 4.10039 69.5308     11.4343  54.186      11.4004  59.6865    133.574     37.4699     133.574     
1 1 1 32 16 18 o 10 64.745  3.76734 73.7132     12.2156  84.8278     11.9309  59.978     247.6       24.4686     247.6       
1 1 1 32 16 19 o 9  30.9906 6.26348 19.9868     9.97151  21.2418     10.4575  15.5353    129.856     11.8015     309.856     
1 1 1 32 16 20 o 17 72.8655 3.50512 101.361     12.9359  97.7746     12.5112  69.0045    150.994     30.2281     150.994     
1 1 1 32 16 21 f 0  15.4757 4.98218 -8.92814    8.9004   0.273839    8.53975  10.4919    167.81      0           0           
1 1 1 32 16 22 o 13 25.2238 6.43863 7.38462     11.765   16.6067     10.0551  11.6353    198.203     9.04878     18.2029     
1 1 1 32 16 23 o 8  39.6834 6.32661 40.6986     13.0251  27.6814     11.6628  37.6497    171.204     27.0219     171.204     
1 1 1 32 16 24 o 17 34.387  6.61735 25.2865     11.8756  26.9631     11.5556  28.788     278.735     14.7189     278.735     
1 1 1 32 16 25 f 0  45.6507 6.10032 46.2825     14.5321  42.0862     12.3407  22.2485    19.7124     0           0           
1 1 1 32 16 26 o 17 18.1068 5.68915 2.60035     10.6443  -4.07499    10.2096  2.49626    199.976     14.4752     19.9759     
1 1 1 32 16 27 o 8  32.3522 6.30847 36.6586     12.0791  8.92666     11.7369  24.4927    253.774     14.7339     253.774     
1 1 1 32 16 28 o 10 25.8198 6.80742 4.52987     13.668   19.6129     11.7745  14.0603    354.07      1.02273     174.07      
1 1 1 32 16 29 o 12 20.1817 6.07514 9.7284      11.7801  -4.00418    10.4566  5.49232    212.938     9.83391     32.9384     
1 1 1 32 16 30 o 9  48.4229 5.61259 45.9087     13.4128  51.5856     12.7913  40.7712    241.641     13.6846     241.641     
1 1 1 32 16 31 o 6  45.4267 6.02578 41.7995     13.429   46.0612     12.9687  29.0306    322.284     6.31968     142.284     
1 1 1 32 16 32 o 5  26.1837 7.11175 15.2722     12.4808  12.5194     13.9038  12.8078    120.255     5.95375     120.255     
1 1 1 32 16 33 o 13 28.6531 6.9761  26.1604     12.1746  6.12867     15.1941  16.3342    2.70566     9.92734     2.70566     
1 1 1 32 16 34 o 17 39.4542 8.25393 26.3102     20.47    50.5612     17.3735  13.0462    279.723     29.6096     99.7232     
1 1 1 32 16 35 o 11 35.9885 7.96714 26.7798     16.0789  36.8413     16.2207  14.9964    348.921     20.0879     168.921     
1 1 1 32 16 36 o 12 25.6117 7.7938  3.86281     15.0696  18.1007     20.8067  15.1965    50.2968     1.43026     50.2968     
1 1 1 32 16 37 o 2  27.4366 7.91151 21.5145     15.6514  5.31506     21.294   17.9889    25.7451     7.00637     25.7451     
1 1 1 32 16 38 o 17 22.7192 7.24648 -3.61417    21.1018  6.36011     14.8965  11.2422    255.411     1.6397      255.411     
1 1 1 32 16 39 o 1  26.9766 8.06221 18.2157     21.2189  13.1034     16.2437  12.0979    93.5597     6.8886      93.5597     
1 1 1 32 16 40 o 17 45.8597 8.68798 74.4128     22.8717  41.7792     18.5498  29.0939    274.787     5.46068     94.7872     
1 1 1 32 16 41 o 9  28.1337 8.12285 39.0743     21.8751  0.660487    15.9494  17.5568    5.45634     4.56749     5.45634     
1 1 1 32 16 42 o 3  29.564  8.44382 24.4343     22.6197  25.1075     16.8927  17.6014    197.087     0.29279     197.088     
1 1 1 32 16 43 o 10 25.5072 8.21227 2.95967     21.9912  22.003      24.3013  1.80466    36.009      0.735444    36.009      
1 1 1 32 16 44 o 13 40.364  8.75236 37.0899     19.0479  63.1344     20.8775  31.7666    305.083     13.208      305.083     
1 1 1 32 16 45 o 2  22.5545 7.15652 7.53402     16.6623  7.60788     16.9192  5.81548    232.212     0.853944    52.2122     
1 1 1 32 16 46 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 16 47 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 17 0  o 18 25.518  7.44078 17.4874     9.42769  17.4874     9.42769  5.44895    180         28.0891     2.2356e-05  
1 1 1 32 17 1  o 18 83.6655 3.18139 133.421     13.3118  125.848     13.2601  62.1249    28.4612     2.52246     208.461     
1 1 1 32 17 2  o 7  76.7326 3.29316 117.689     12.562   101.413     12.583   74.6555    328.22      33.9802     328.22      
1 1 1 32 17 3  o 3  62.7846 3.66281 80.9162     11.44    67.7376     11.3309  61.5512    105.978     29.8188     105.978     
1 1 1 32 17 4  o 18 24.559  5.91165 5.37791     9.3141   17.4203     9.19293  6.93816    241.546     19.6419     61.546      
1 1 1 32 17 5  o 4  67.4146 3.7077  80.2962     12.8557  91.1123     11.8454  49.9917    7.55499     1.43519     187.555     
1 1 1 32 17 6  o 4  27.2378 5.95068 10.0526     9.30129  20.5236     9.2864   18.1442    233.749     1.42284     233.749     
1 1 1 32 17 7  o 17 36.457  5.44294 19.1639     9.66251  36.2652     9.76613  15.078     56.3514     22.9352     236.351     
1 1 1 32 17 8  o 17 15.8767 4.97233 -9.44964    8.40048  3.47599     8.20745  2.2723     293.685     2.60816     113.685     
1 1 1 32 17 9  o 19 83.6804 3.19057 139.687     13.2602  120.51      13.332   74.6337    236.065     23.1205     236.065     
1 1 1 32 17 10 o 4  28.0398 6.09655 16.5346     9.42755  16.7863     9.3682   16.032     218.707     5.59155     38.7067     
1 1 1 32 17 11 o 3  49.9881 4.35334 51.8856     10.6551  45.2977     10.6413  25.71      3.60306     22.9333     183.603     
1 1 1 32 17 12 o 16 31.8365 6.23439 23.5926     10.0539  20.1025     10.6118  26.1606    82.463      12.3438     82.463      
1 1 1 32 17 13 o 14 28.3918 6.2535  19.1917     9.99912  15.3638     9.77424  20.5943    341.83      10.4879     341.83      
1 1 1 32 17 14 o 10 22.9203 6.18017 5.56425     10.3066  12.5933     9.84671  7.84608    111.106     3.23678     111.106     
1 1 1 32 17 15 o 5  33.9454 6.00735 27.5702     10.2878  21.7575     10.1841  16.2202    274.639     15.8487     94.6391     
1 1 1 32 17 16 o 6  15.3759 4.96212 1.29797     8.89514  -11.7194    8.7652   1.2715     189.914     19.4648     189.914     
1 1 1 32 17 17 o 7  23.3834 6.5328  6.69054     11.4669  11.87       11.3535  8.93158    128.519     11.7045     308.519     
1 1 1 32 17 18 o 19 31.8137 6.77715 23.5411     11.8664  21.7534     11.5245  13.1576    45.4209     18.2034     225.421     
1 1 1 32 17 19 o 6  47.5973 6.31941 60.3362     14.4789  37.8415     14.35    28.5475    326.671     12.2957     146.671     
1 1 1 32 17 20 o 15 21.574  6.21616 0.537378    11.1573  11.1422     10.7761  7.06509    345.378     11.591      165.378     
1 1 1 32 17 21 o 9  32.7388 6.7571  25.9848     11.8846  22.2888     11.7083  15.9015    304.34      13.5303     124.34      
1 1 1 32 17 22 o 18 22.9093 6.39996 6.43333     11.1931  11.379      10.7443  6.66895    50.3135     15.3063     230.313     
1 1 1 32 17 23 o 12 28.5131 6.78332 25.3293     12.5155  10.4893     11.2992  14.1284    94.0974     9.08324     274.097     
1 1 1 32 17 24 o 15 31.2947 7.07984 19.9029     12.8364  25.0761     12.447   22.7348    235.296     8.97317     235.296     
1 1 1 32 17 25 o 6  23.4923 6.65639 0.743789    14.6016  14.1524     11.0621  7.70044    350.669     13.4091     170.669     
1 1 1 32 17 26 o 8  21.2877 6.29013 0.753313    11.9993  9.29861     10.9955  8.28205    324.175     4.55632     144.175     
1 1 1 32 17 27 o 4  19.5497 6.02238 -2.38837    11.8292  5.22406     10.7393  5.87963    240.312     8.3202      60.3124     
1 1 1 32 17 28 o 2  29.9013 7.18752 15.8814     13.256   24.7945     12.9699  19.9106    127.132     1.9624      127.132     
1 1 1 32 17 29 o 3  37.7694 7.40026 41.6689     15.7219  26.069      13.5917  28.2746    85.4194     4.9803      85.4194     
1 1 1 32 17 30 o 14 26.2764 7.24661 19.0006     15.1468  9.46586     12.4772  10.6019    265.798     6.26421     265.798     
1 1 1 32 17 31 o 15 25.9679 7.31074 9.79542     15.8713  15.8596     13.252   1.13506    322.231     38.1928     322.231     
1 1 1 32 17 32 o 17 20.4454 6.44475 8.86238     15.0519  -7.33915    11.8573  7.44639    293.79      1.35067     293.79      
1 1 1 32 17 33 o 17 20.9768 6.61298 7.34501     15.5431  -3.44978    12.5504  6.793      181.639     11.8297     1.63877     
1 1 1 32 17 34 o 12 63.082  5.92068 85.7801     19.3791  84.4834     16.9845  42.1542    77.285      7.43072     257.285     
1 1 1 32 17 35 o 16 17.3942 5.82755 -1.83477    14.985   -13.9428    11.4645  4.55274    247.491     8.03482     67.4911     
1 1 1 32 17 36 f 0  24.6602 7.24186 15.6957     16.364   8.48178     12.996   19.5361    117.803     0           0           
1 1 1 32 17 37 f 0  26.7784 7.43201 29.9817     16.3552  -3.43713    16.7613  9.68175    206.559     0           0           
1 1 1 32 17 38 o 16 21.7563 7.01974 0.198263    17.322   4.52842     16.7276  9.06372    266.102     2.54977     86.1021     
1 1 1 32 17 39 o 4  22.3389 7.08342 0.219221    17.2856  10.1555     16.0497  8.71802    292.508     0.195548    112.508     
1 1 1 32 17 40 o 12 23.0645 7.26086 -2.29063    18.1827  15.5477     16.9034  9.46137    69.3138     1.60519     249.314     
1 1 1 32 17 41 o 18 22.701  7.22448 4.41962     18.1537  10.0676     16.6109  5.89754    331.975     0.243078    331.975     
1 1 1 32 17 42 o 19 23.6827 7.59703 11.7123     26.737   9.26494     13.6799  8.00982    142.725     0.581776    322.725     
1 1 1 32 17 43 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 17 44 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 18 0  o 16 9.97679 4.90343 -6.56714    8.65919  -6.56714    8.65919  1.89682    8.63209e-06 7.04659     8.63209e-06 
1 1 1 32 18 1  o 3  128.049 2.93256 299.458     18.8135  306.092     18.7712  115.338    221.429     35.2556     221.429     
1 1 1 32 18 2  o 8  41.1707 5.61111 24.4775     11.2913  47.3533     10.7996  25.7544    314.267     8.60002     134.267     
1 1 1 32 18 3  o 17 34.2454 6.17704 26.833      10.7506  24.0149     10.5319  20.8042    276.634     6.90432     96.6344     
1 1 1 32 18 4  o 9  24.4626 5.92865 20.2652     9.96221  1.34885     9.72911  14.5974    198.657     0.393768    198.657     
1 1 1 32 18 5  o 8  25.3909 6.32395 10.0463     10.4625  16.1645     9.90067  16.0002    145.029     3.04231     145.029     
1 1 1 32 18 6  o 14 32.6432 6.29025 23.9779     10.7313  22.6226     10.4083  7.40206    93.3853     32.4265     273.385     
1 1 1 32 18 7  o 3  55.768  4.478   64.3704     12.4516  57.6837     12.1174  38.2783    275         6.71577     95.0005     
1 1 1 32 18 8  o 13 18.2921 5.58251 4.68276     9.61428  -1.80202    9.27498  2.30272    75.6666     17.0616     255.667     
1 1 1 32 18 9  o 7  22.7288 6.1419  5.22073     10.0297  12.8589     9.91944  11.6815    21.3375     0.71742     201.337     
1 1 1 32 18 10 o 2  28.1839 6.44402 19.9965     10.588   14.6377     10.3142  16.7205    192.14      3.61751     12.1397     
1 1 1 32 18 11 o 6  24.8668 6.51644 7.03448     11.056   16.9654     11.155   10.8594    185.717     10.3303     5.71655     
1 1 1 32 18 12 o 2  18.3241 5.7204  4.50241     10.9248  -4.81166    9.93129  5.01039    295.424     6.30672     115.424     
1 1 1 32 18 13 o 5  26.7626 6.81344 27.588      14.1945  1.14456     11.4233  12.7433    9.98952     6.74686     9.98952     
1 1 1 32 18 14 o 17 50.227  5.54374 50.5625     13.9435  53.9407     12.9656  32.0202    74.0705     9.95669     254.07      
1 1 1 32 18 15 o 10 40.4344 6.50444 34.3326     13.0471  37.8579     12.733   26.666     89.7976     4.39871     269.798     
1 1 1 32 18 16 o 13 18.8155 5.91714 -5.9504     11.9082  4.02083     11.0724  2.33499    188.99      16.9098     8.9897      
1 1 1 32 18 17 o 13 39.1822 6.67754 40.1112     13.3877  29.0424     12.6793  27.7314    323.678     0.494955    323.678     
1 1 1 32 18 18 f 0  79.0219 4.47694 125.561     17.5056  119.761     17.6413  57.9895    262.794     0           0           
1 1 1 32 18 19 o 13 31.7593 6.98602 23.914      12.7127  22.6517     11.8856  23.533     196.164     7.73347     196.164     
1 1 1 32 18 20 o 13 41.0687 6.51015 35.7043     13.4523  38.992      12.6962  29.8995    129.315     1.79007     129.315     
1 1 1 32 18 21 o 3  50.524  5.62185 57.1424     14.4541  49.5699     13.0873  48.6369    98.8941     25.4708     98.8941     
1 1 1 32 18 22 o 6  21.8319 6.40904 7.75118     12.2059  5.79752     10.8295  9.8207     154.652     3.47081     334.652     
1 1 1 32 18 23 o 7  21.6685 6.46644 16.9854     14.5291  -9.84007    11.1394  5.69231    133.293     15.8774     313.293     
1 1 1 32 18 24 o 10 25.2235 7.05546 15.0521     14.959   10.1111     11.4148  11.175     121.931     10.2947     301.931     
1 1 1 32 18 25 o 2  61.4624 6.32342 82.492      20.4347  80.203      17.1467  48.2163    206.834     6.04069     206.834     
1 1 1 32 18 26 o 16 26.9764 7.6706  21.9394     16.9621  7.42231     15.3327  12.0139    232.367     7.45277     232.367     
1 1 1 32 18 27 o 4  22.4683 6.81553 -3.26969    17.0953  10.4115     12.1728  12.1763    329.87      0.68038     329.87      
1 1 1 32 18 28 o 7  38.616  8.14048 25.4332     22.9661  48.5227     15.7723  29.8299    346.886     6.49066     346.886     
1 1 1 32 18 29 o 5  31.9782 8.29226 37.1264     20.4617  17.3891     14.3821  18.8705    155.447     5.46982     335.447     
1 1 1 32 18 30 o 4  46.9052 8.00032 54.6515     22.0332  55.5177     15.5471  42.0171    161.293     18.4945     161.293     
1 1 1 32 18 31 o 14 29.3714 8.08675 28.1545     20.7824  16.8158     13.4478  21.0802    289.134     6.93807     289.134     
1 1 1 32 18 32 o 8  20.9026 6.52556 -24.1528    19.5181  11.3636     12.5523  7.72293    262.446     1.84662     262.446     
1 1 1 32 18 33 o 6  23.4702 7.05688 -20.3127    23.8044  16.9173     12.9441  12.6035    73.6513     1.30047     73.6513     
1 1 1 32 18 34 o 15 23.7997 7.46572 12.4687     18.5132  5.10562     16.9524  8.52181    271.559     12.3902     91.5593     
1 1 1 32 18 35 o 9  21.3089 6.85031 6.04527     18.592   1.61956     13.0861  4.53354    333.26      0.660411    333.26      
1 1 1 32 18 36 o 4  34.626  8.44955 43.9257     20.441   29.3076     15.1566  24.1083    329.059     3.944       329.059     
1 1 1 32 18 37 o 11 25.3818 7.61208 28.3044     19.4713  4.27956     14.3046  10.8347    331.273     3.06837     331.273     
1 1 1 32 18 38 o 6  20.6118 6.72874 7.1799      18.6858  -1.29748    13.2138  1.56617    91.6052     0.31858     271.605     
1 1 1 32 18 39 f 0  23.217  7.22805 10.5134     19.3505  10.6793     13.7398  12.1841    125.238     0           0           
1 1 1 32 18 40 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 18 41 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 19 0  o 8  86.7572 3.75681 139.709     16.1919  139.709     16.1919  71.8318    180         10.1811     180         
1 1 1 32 19 1  f 0  28.257  6.74914 22.2879     11.0063  12.3446     12.7148  17.8763    70.824      0           0           
1 1 1 32 19 2  o 4  36.8917 6.47822 36.3753     11.8433  24.5635     12.3696  26.8456    127.755     2.09122     127.755     
1 1 1 32 19 3  o 7  50.3769 5.58992 46.8369     12.7768  59.4793     14.5313  43.4589    114.258     13.3504     114.258     
1 1 1 32 19 4  o 2  21.6366 5.98425 15.5398     10.5935  -4.22743    10.3641  4.40407    352.442     18.7387     172.442     
1 1 1 32 19 5  o 3  25.6597 6.71022 20.8072     12.8317  6.64836     10.666   11.9845    329.799     8.81058     149.799     
1 1 1 32 19 6  o 8  40.0036 6.39865 29.8575     11.932   41.2415     13.2125  21.8814    201.962     14.2502     21.9621     
1 1 1 32 19 7  o 12 59.4503 6.35967 107.503     17.264   49.0743     17.1512  53.1685    146.511     18.5939     146.511     
1 1 1 32 19 8  o 3  27.7904 6.72398 26.784      12.602   5.85261     11.9968  13.9066    326.109     7.64492     326.109     
1 1 1 32 19 9  o 17 24.3749 6.68031 16.2922     12.0212  5.91139     11.9029  11.2999    155.1       7.1919      335.1       
1 1 1 32 19 10 o 10 28.0263 7.15959 25.4142     13.4207  7.59356     14.2668  18.5409    273.569     5.7459      273.569     
1 1 1 32 19 11 o 19 33.3249 7.11822 29.444      13.2844  22.6649     12.6108  27.0103    315.207     12.7013     315.207     
1 1 1 32 19 12 o 12 21.654  6.55463 10.2345     13.6164  -0.347765   11.967   9.32244    352.603     1.46808     172.603     
1 1 1 32 19 13 o 19 59.1964 5.67819 86.7809     17.6074  60.9216     15.1397  60.2231    240.416     34.0079     240.416     
1 1 1 32 19 14 o 14 48.1661 6.12873 57.4138     14.2734  42.925      14.0954  30.5768    333.954     9.80944     153.954     
1 1 1 32 19 15 o 13 39.6581 6.72076 37.6314     13.4202  33.426      12.9619  37.274     309.13      21.5005     309.13      
1 1 1 32 19 16 o 9  43.907  6.39893 47.9354     14.1065  37.0709     13.1485  44.2359    193.84      28.6023     193.84      
1 1 1 32 19 17 o 5  80.7382 4.88614 118.95      21.059   142.008     17.0712  74.8359    168.549     28.4591     168.549     
1 1 1 32 19 18 o 1  32.3864 7.22544 2.95117     16.4779  41.5171     15.3329  26.5861    29.7176     11.8707     29.7176     
1 1 1 32 19 19 f 0  40.3036 7.20797 52.1219     16.8039  25.6825     12.9421  26.7385    331.167     0           0           
1 1 1 32 19 20 o 8  25.7089 7.5083  3.06801     17.686   18.207      15.257   12.3945    13.0438     9.14597     193.044     
1 1 1 32 19 21 o 11 18.8144 6.03667 -27.4696    17.0889  5.72309     11.56    5.495      54.1601     11.2743     234.16      
1 1 1 32 19 22 o 2  38.0214 8.03098 49.6402     19.3671  25.2559     13.9532  31.1655    295.613     9.94614     295.613     
1 1 1 32 19 23 o 19 21.0607 6.70103 8.20409     17.3843  -3.23606    11.6297  9.53893    287.455     1.66193     287.455     
1 1 1 32 19 24 f 0  23.2835 7.16806 8.6561      18.0542  5.98222     13.201   9.88815    256.828     0           0           
1 1 1 32 19 25 o 7  55.7863 7.52727 80.018      21.4384  69.1209     19.1325  47.2962    350.5       13.3151     350.5       
1 1 1 32 19 26 o 18 26.1872 7.64514 20.0427     19.7194  10.9862     12.6978  5.67355    158.974     24.5789     338.974     
1 1 1 32 19 27 f 0  24.1522 7.29104 8.02195     18.6879  11.5611     13.1973  6.95219    121.45      0           0           
1 1 1 32 19 28 o 3  29.459  8.02586 31.4833     19.4168  15.7997     13.9888  21.0081    332.587     6.01482     332.587     
1 1 1 32 19 29 o 9  40.5032 8.20654 43.0567     21.1542  46.7809     15.2183  25.6034    28.2186     5.87782     208.219     
1 1 1 32 19 30 o 10 22.0126 6.95602 5.55918     18.8915  5.76152     12.7034  9.74219    8.78208     3.96702     188.782     
1 1 1 32 19 31 o 17 19.0749 6.35699 1.68641     18.4729  -6.35424    11.8822  5.2568     239.218     8.2616      59.2177     
1 1 1 32 19 32 o 4  25.1038 7.75851 17.918      19.8274  11.4115     17.0951  10.7026    161.64      8.88402     341.64      
1 1 1 32 19 33 o 1  29.6966 8.23079 25.2505     24.0789  27.6834     14.6438  16.3915    294.184     4.43574     114.184     
1 1 1 32 19 34 o 11 23.8    7.25939 -0.514104   22.0653  17.3519     13.5994  9.70365    69.837      6.55514     249.837     
1 1 1 32 19 35 o 19 25.557  7.44679 0.594827    23.3436  23.3793     13.752   8.57559    35.1971     14.1093     215.197     
1 1 1 32 19 36 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 19 37 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 19 38 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 20 0  o 11 23.7468 8.08436 17.0404     11.14    17.0404     11.14    0.0246239  180         36.5925     180         
1 1 1 32 20 1  o 15 16.5984 5.50389 -15.3095    13.006   -2.47767    10.8299  3.599      201.757     9.05069     21.757      
1 1 1 32 20 2  o 1  96.799  4.29066 179.113     21.2771  186.811     20.0724  102.572    341.174     57.8889     341.174     
1 1 1 32 20 3  o 11 19.8516 6.15552 10.0439     12.7138  -12.6077    12.4829  7.64452    279.2       7.20687     99.2002     
1 1 1 32 20 4  o 7  112.139 4.11111 253.673     23.6413  233.606     22.4127  119.827    200.066     68.4974     200.066     
1 1 1 32 20 5  o 1  21.1979 6.46953 6.37323     12.6411  2.15928     12.5033  9.54566    326.532     5.67036     146.532     
1 1 1 32 20 6  o 9  51.6884 6.61259 74.4278     17.6491  45.4992     15.2835  50.7954    61.7304     26.2332     61.7304     
1 1 1 32 20 7  o 9  24.2741 6.94162 11.3943     13.4894  10.1973     12.6706  13.297     27.183      3.99311     207.183     
1 1 1 32 20 8  o 14 54.8271 6.29334 57.3864     16.1975  73.5509     17.0991  52.4709    350.6       24.0321     350.6       
1 1 1 32 20 9  o 9  35.855  7.66864 17.7074     16.1829  45.2113     16.2691  15.4497    12.0514     21.2641     192.051     
1 1 1 32 20 10 o 10 38.0436 7.45632 34.723      15.316   34.6893     14.1287  36.1893    188.302     21.6419     188.302     
1 1 1 32 20 11 o 7  23.7413 7.46044 0.908366    24.1963  7.70779     12.8475  13.3233    111.358     2.1567      291.358     
1 1 1 32 20 12 o 5  20.5895 6.56564 -1.84299    17.0266  2.08386     11.8709  9.90324    238.276     2.70884     58.2756     
1 1 1 32 20 13 o 11 34.6722 8.04049 39.1217     18.6088  23.1998     13.7118  15.1777    203.48      19.6625     23.4799     
1 1 1 32 20 14 o 7  56.9284 6.99569 69.3612     21.1156  77.8315     16.5551  60.2934    148.608     37.7763     148.608     
1 1 1 32 20 15 o 14 22.1979 7.19011 4.62514     18.6475  -4.59219    17.4933  7.77404    355.035     13.1348     175.035     
1 1 1 32 20 16 o 16 73.6508 6.3885  146.12      26.2165  95.8589     20.0759  74.9844    23.1216     39.8929     23.1216     
1 1 1 32 20 17 o 8  34.9914 8.54665 15.7141     22.0063  48.2637     19.2639  18.9949    84.0089     11.7181     264.009     
1 1 1 32 20 18 o 7  39.9396 8.5495  59.4904     21.8685  29.5296     15.7651  34.6742    191.916     14.112      191.916     
1 1 1 32 20 19 o 7  30.2778 8.07178 18.8625     19.3077  27.5402     15.4364  20.4476    303.358     0.577278    303.358     
1 1 1 32 20 20 o 9  23.3113 7.22677 8.64171     18.6394  6.80959     13.6969  12.4019    249.667     3.36157     69.6673     
1 1 1 32 20 21 o 17 21.0715 6.7471  13.5103     17.6388  -10.016     12.8801  10.2706    155.007     2.11773     335.007     
1 1 1 32 20 22 o 15 20.0544 6.57601 -5.40843    18.9221  0.38356     12.985   8.26124    36.3872     5.47062     216.387     
1 1 1 32 20 23 o 13 25.214  7.39348 31.2151     18.6953  -7.78991    14.4135  13.4979    207.6       4.68371     27.6004     
1 1 1 32 20 24 o 10 20.5945 6.63959 -14.6078    20.1212  7.46269     13.1518  8.42643    90.6981     0.778296    270.698     
1 1 1 32 20 25 o 18 19.8918 6.52698 -2.4466     18.245   0.17589     13.013   7.3201     270.124     3.45623     90.1243     
1 1 1 32 20 26 o 14 27.3849 7.6348  9.12924     19.3369  26.7928     14.7256  16.9032    324.958     1.1684      324.958     
1 1 1 32 20 27 o 18 25.3961 7.735   18.1697     20.9398  14.0238     14.9725  11.8931    169.905     7.12237     349.905     
1 1 1 32 20 28 o 6  39.3191 9.65622 87.0219     30.3223  31.8606     16.1544  32.9741    200.097     20.6593     200.097     
1 1 1 32 20 29 o 14 18.6445 6.26847 -3.68286    18.3444  -5.32572    13.2009  3.95984    246.403     4.54477     66.4026     
1 1 1 32 20 30 o 4  25.5787 7.72198 16.7551     19.9305  18.2216     15.612   11.6082    62.5337     2.56519     62.5337     
1 1 1 32 20 31 o 13 17.3228 5.85349 -30.8574    18.2228  1.09203     13.2284  1.9123     56.7121     5.83567     236.712     
1 1 1 32 20 32 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 20 33 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 20 34 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 21 0  o 3  14.6704 7.13008 -6.02749    17.0845  -6.02749    17.0845  1.8004     180         14.2675     360         
1 1 1 32 21 1  o 19 75.753  6.7754  136.79      24.9064  124.356     25.2581  69.6718    177.803     24.3964     177.803     
1 1 1 32 21 2  o 12 18.892  6.26731 -6.79342    15.4265  -5.46033    14.5997  5.90977    91.9317     0.504659    91.9317     
1 1 1 32 21 3  o 15 31.1998 8.87479 21.7194     28.1791  29.6496     17.8103  22.1684    72.7886     2.68617     72.7885     
1 1 1 32 21 4  o 11 25.6107 7.74963 -0.273499   27.4141  15.8801     13.2435  16.2354    38.7354     0.777088    38.7353     
1 1 1 32 21 5  o 12 24.2744 7.51983 -9.65409    27.7202  13.5907     13.2239  12.5237    86.3898     6.26271     266.39      
1 1 1 32 21 6  o 8  21.1259 6.79582 9.90505     18.2057  -5.70094    12.6454  10.5351    335.551     1.26044     335.551     
1 1 1 32 21 7  o 16 32.7797 8.25167 33.0119     19.9835  25.8528     14.353   18.959     106.424     8.44879     286.424     
1 1 1 32 21 8  o 6  18.0771 6.15879 -20.913     19.609   -8.17695    14.0689  6.62275    133.216     4.10067     313.216     
1 1 1 32 21 9  o 15 36.0401 8.74777 34.4722     22.8232  39.9229     17.0384  28.0998    253.931     6.23275     253.931     
1 1 1 32 21 10 o 6  26.1483 8.22635 10.7747     30.7685  13.271      15.3362  17.2343    307.485     5.68724     307.485     
1 1 1 32 21 11 o 1  34.1558 8.56522 31.4636     21.293   34.9234     16.5176  26.7861    186.252     7.21351     186.252     
1 1 1 32 21 12 o 9  24.0238 7.42534 2.68948     20.2414  13.1552     15.0499  11.1343    45.3827     9.07214     225.383     
1 1 1 32 21 13 o 6  68.5275 7.32809 130.232     26.9243  98.0024     21.9233  58.1278    28.0442     13.1014     28.0442     
1 1 1 32 21 14 o 5  23.1841 7.27974 5.05606     20.202   8.8545      14.2448  13.089     166.925     2.42674     166.925     
1 1 1 32 21 15 o 15 23.9544 7.46097 17.9627     20.4087  3.85459     13.8882  13.1803    249.424     2.36013     69.4239     
1 1 1 32 21 16 o 13 26.8582 7.97123 31.2979     21.2031  6.58837     15.0364  17.7719    294.379     5.51308     294.379     
1 1 1 32 21 17 o 4  27.4102 8.30574 20.1623     21.2187  19.9488     19.5812  15.2345    278.119     4.95638     98.1191     
1 1 1 32 21 18 o 12 23.2187 7.32597 17.4713     20.1765  2.06394     13.8957  5.91614    142.274     18.6714     322.274     
1 1 1 32 21 19 o 8  29.1599 8.11734 22.4236     20.9741  26.4837     15.3199  10.5306    97.8865     6.7967      97.8865     
1 1 1 32 21 20 o 13 20.2121 6.64202 -2.74723    19.3377  1.9377      13.5211  4.66104    262.894     0.0299936   262.894     
1 1 1 32 21 21 o 6  22.0508 6.95156 -10.1818    20.296   14.3359     14.4322  9.38637    27.5292     0.679035    207.529     
1 1 1 32 21 22 o 4  22.5627 7.22681 9.08824     20.7628  7.05536     14.5688  8.2524     74.3894     0.904387    74.3894     
1 1 1 32 21 23 o 10 22.9225 7.28534 19.7561     20.1287  1.32185     14.2549  8.03571    43.9151     1.06506     43.9151     
1 1 1 32 21 24 o 1  25.3963 7.74237 27.1788     20.9174  9.82252     14.517   11.1885    168.486     3.14784     168.486     
1 1 1 32 21 25 o 2  26.7739 7.69018 46.0279     20.7977  -7.34944    14.8866  1.1197     274.427     0.560001    274.427     
1 1 1 32 21 26 o 3  16.8845 5.83039 -13.3881    19.0064  -11.2933    12.6967  1.57121    275.31      5.95718     95.3095     
1 1 1 32 21 27 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 21 28 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 21 29 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 22 0  o 13 19.3848 9.35297 3.90735     28.2265  3.90735     28.2265  7.1848     7.60395e-06 0.612662    180         
1 1 1 32 22 1  o 11 26.6233 8.86253 14.1227     30.9481  17.2649     30.0324  5.49062    263.821     3.06639     263.821     
1 1 1 32 22 2  o 10 34.2734 10.3543 50.9541     32.127   52.4756     30.9455  21.3605    216.355     4.33517     36.3545     
1 1 1 32 22 3  o 3  27.6719 9.12507 30.8501     31.0062  11.2379     31.6129  16.9772    327.417     0.0241191   327.416     
1 1 1 32 22 4  o 6  30.0376 9.83924 41.2007     37.4962  31.9911     32.8123  20.4948    98.6738     5.05574     98.6738     
1 1 1 32 22 5  o 2  25.8998 8.97558 19.5406     37.1634  -16.2271    44.1844  12.9619    221.513     6.54703     41.5128     
1 1 1 32 22 6  o 3  32.4143 10.7749 61.8936     42.0027  61.0321     48.4758  17.6954    229.219     8.48498     49.219      
1 1 1 32 22 7  o 17 28.0756 9.63393 123.177     106.15   16.1933     19.9518  14.3794    232.09      7.60182     52.0896     
1 1 1 32 22 8  o 17 27.0657 9.00015 53.5896     37.7057  0.344448    20.8472  16.2628    178.305     1.07762     178.305     
1 1 1 32 22 9  o 13 25.18   8.54383 34.432      37.6067  -2.20748    21.143   13.4179    334.932     2.8007      334.932     
1 1 1 32 22 10 o 2  23.2043 7.91067 31.3203     34.1361  -5.06939    13.9295  8.20715    38.1769     2.13831     38.1769     
1 1 1 32 22 11 o 6  26.561  8.6503  38.1092     39.7043  13.1256     15.9248  13.7482    119.252     5.28898     119.252     
1 1 1 32 22 12 o 2  34.1545 8.7588  37.6807     23.2031  40.4615     17.2654  25.9624    223.686     7.31285     223.686     
1 1 1 32 22 13 o 8  38.8244 9.34955 57.1887     25.0863  49.4052     19.147   22.7377    200.161     9.77574     20.1606     
1 1 1 32 22 14 o 13 20.1905 6.72621 8.91999     20.0741  -7.28694    13.943   6.68853    351.131     3.18874     171.131     
1 1 1 32 22 15 o 13 21.8365 7.10053 17.1946     20.5608  -2.83804    14.1709  8.66518    162.009     2.00554     342.009     
1 1 1 32 22 16 f 0  21.7194 7.21128 10.818      21.3097  -3.67993    18.2827  8.6317     270.354     0           0           
1 1 1 32 22 17 o 8  18.8457 6.28688 -21.1624    19.8388  4.35615     13.8822  4.49804    61.6818     5.28639     241.682     
1 1 1 32 22 18 o 15 25.7624 7.91517 29.2673     22.3732  11.8792     15.245   12.6629    51.2556     4.67823     231.256     
1 1 1 32 22 19 o 7  25.8147 7.95087 26.0039     23.0568  15.2369     15.5614  13.1863    128.546     0.0428525   308.549     
1 1 1 32 22 20 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 22 21 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 22 22 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 22 23 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 23 0  x 1  ?       ?       ?           ?        ?           ?        9.92751    360         0           0           
1 1 1 32 23 1  x 13 ?       ?       ?           ?        ?           ?        2.56156    292.952     0           0           
1 1 1 32 23 2  o 12 22.9936 11.4509 -7.09709    37.0413  0           0        3.49722    357.466     1.49707     177.466     
1 1 1 32 23 3  o 5  22.1723 7.89595 -32.8406    35.7532  -6.86201    42.696   6.9156     278.392     0.760971    98.3924     
1 1 1 32 23 4  o 14 25.807  9.09976 6.79034     43.3446  36.2614     50.5424  12.4349    348.11      3.88699     168.11      
1 1 1 32 23 5  o 4  26.8551 9.35756 68.2747     43.7129  -33.4966    50.88    13.2471    45.0352     5.06688     225.035     
1 1 1 32 23 6  o 14 25.4313 12.6878 0           0        16.1104     46.3494  6.44962    80.892      1.755       260.892     
1 1 1 32 23 7  o 12 24.4323 8.65736 -24.8497    42.4644  30.7047     46.1705  6.07856    177.546     1.3044      177.546     
1 1 1 32 23 8  o 18 24.3098 12.0442 6.79728     38.9609  0           0        7.03787    77.1612     7.93771     257.161     
1 1 1 32 23 9  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 23 10 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 23 11 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 23 12 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 23 13 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 23 14 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 32 23 15 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 0  0  o 7  113.986 3.75516 231.973     21.3442  231.973     21.3442  47.534     180         74.827      360         
1 1 1 33 0  1  o 6  207.36  2.76791 763.64      28.7402  763.64      28.7402  174.908    240         40.5589     240         
1 1 1 33 0  2  o 16 81.0883 2.90405 117.56      11.7317  117.56      11.7317  62.5317    300         45.7711     300         
1 1 1 33 0  3  o 17 32.5829 5.90111 22.2155     8.32841  22.2155     8.32841  13.1361    8.66842e-06 60.8274     8.66841e-06 
1 1 1 33 0  4  o 18 172.255 2.69487 527.149     23.2375  527.149     23.2375  75.5807    240         105.633     60          
1 1 1 33 0  5  o 11 92.3963 2.89914 152.37      13.3638  152.37      13.3638  94.8994    300         56.3366     300         
1 1 1 33 0  6  o 18 292.392 3.36858 1518.99     49.3302  1518.99     49.3302  230.902    360         26.1522     360         
1 1 1 33 0  7  o 16 22.354  7.04733 12.8668     8.37186  12.8668     8.37186  11.4917    240         31.3679     240         
1 1 1 33 0  8  o 16 272.514 3.28856 1319.54     44.8818  1319.54     44.8818  204.345    120         2.97003     120         
1 1 1 33 0  9  o 3  18.6792 6.81832 9.10703     8.19091  9.10703     8.19091  9.60588    2.26531e-05 23.3926     2.26531e-05 
1 1 1 33 0  10 f 0  44.9163 4.19678 37.6819     8.9879   37.6819     8.9879   26.4566    240         0           0           
1 1 1 33 0  11 o 8  58.5306 3.43827 62.0804     9.91935  62.0804     9.91935  29.7771    300         23.6796     120         
1 1 1 33 0  12 o 1  37.8436 5.16996 28.1433     8.75066  28.1433     8.75066  3.67342    180         53.2742     180         
1 1 1 33 0  13 o 18 76.8095 2.98009 105.657     11.3916  105.657     11.3916  65.0755    240         18.8015     240         
1 1 1 33 0  14 o 13 72.8603 3.083   95.2466     11.1639  95.2466     11.1639  3.39385    300         101.278     120         
1 1 1 33 0  15 o 1  81.3038 2.95081 118.258     11.9503  118.258     11.9503  51.1813    180         17.9673     8.67591e-06 
1 1 1 33 0  16 o 16 185.473 2.71388 611.263     25.2006  611.263     25.2006  160.77     240         46.8682     240         
1 1 1 33 0  17 o 13 174.92  2.69491 543.777     23.5982  543.777     23.5982  137.2      300         15.5919     300         
1 1 1 33 0  18 o 16 151.939 2.73969 410.544     20.8302  410.544     20.8302  91.8887    8.22356e-07 40.8109     180         
1 1 1 33 0  19 f 0  97.8978 2.88594 171.034     14.1025  171.034     14.1025  78.7643    60          0           0           
1 1 1 33 0  20 f 0  53.9567 3.90753 53.3756     10.2906  53.3756     10.2906  0.762718   119.998     0           0           
1 1 1 33 0  21 o 7  49.8341 4.18757 46.0222     10.0693  46.0222     10.0693  2.4655     180         0.977611    180         
1 1 1 33 0  22 o 1  158.387 2.88715 446.389     22.8822  446.389     22.8822  144.164    60          55.2428     60          
1 1 1 33 0  23 o 2  151.453 3.17438 408.671     24.0455  408.671     24.0455  123.349    120         24.0924     120         
1 1 1 33 0  24 o 17 100.591 3.15931 180.88      15.8545  180.88      15.8545  62.1248    2.50175e-06 23.4067     180         
1 1 1 33 0  25 o 8  16.5518 6.66311 6.42092     8.62279  6.42092     8.62279  43.6099    60          103.215     60          
1 1 1 33 0  26 o 11 96.9313 3.20655 168.134     15.4983  168.134     15.4983  82.1229    300         22.3741     300         
1 1 1 33 0  27 o 8  11.7355 5.43984 -1.12445    7.98332  -1.12445    7.98332  0.154209   180         0.339133    180         
1 1 1 33 0  28 o 5  68.1549 3.38699 83.8608     11.4347  83.8608     11.4347  63.7725    60          39.0474     60          
1 1 1 33 0  29 o 18 166.725 2.91624 495.06      24.3324  495.06      24.3324  130.442    120         17.9374     120         
1 1 1 33 0  30 o 18 93.293  3.19228 155.932     14.8449  155.932     14.8449  30.9155    360         73.8918     180         
1 1 1 33 0  31 o 17 127.371 2.92747 289.406     18.6416  289.406     18.6416  87.4131    60          10.1609     240         
1 1 1 33 0  32 o 11 97.0818 3.28187 168.928     15.8834  168.928     15.8834  87.0641    120         33.386      120         
1 1 1 33 0  33 o 2  22.6265 7.47454 13.5587     9.45473  13.5587     9.45473  9.00307    180         37.9482     180         
1 1 1 33 0  34 o 15 149.113 3.08612 396.81      23.0168  396.81      23.0168  119.681    240         23.962      240         
1 1 1 33 0  35 o 15 16.7792 7.01651 5.89533     10.1536  5.89533     10.1536  3.28283    120         11.318      120         
1 1 1 33 0  36 o 14 18.3324 7.22973 8.42157     9.88542  8.42157     9.88542  3.77086    180         21.0857     180         
1 1 1 33 0  37 o 8  118.911 3.18031 253.081     18.8902  253.081     18.8902  100.199    240         29.6333     240         
1 1 1 33 0  38 o 4  12.819  5.89159 -0.393046   9.08078  -0.393046   9.08078  2.63156    300         7.4204      300         
1 1 1 33 0  39 o 10 16.8388 6.74729 6.91488     8.78635  6.91488     8.78635  1.26502    360         6.99391     360         
1 1 1 33 0  40 o 12 135.329 2.95834 327.417     20.0197  327.417     20.0197  101.459    240         9.81325     240         
1 1 1 33 0  41 o 18 38.6934 5.88297 30.4532     10.0124  30.4532     10.0124  19.2566    120         16.2234     300         
1 1 1 33 0  42 o 17 10.5888 5.07026 -3.74457    7.97532  -3.74457    7.97532  2.81789    8.6513e-06  7.13406     8.6513e-06  
1 1 1 33 0  43 o 3  94.8982 2.95832 161.655     14.0066  161.655     14.0066  73.4256    60          12.3673     60          
1 1 1 33 0  44 o 9  13.2163 5.87601 1.84822     8.15654  1.84822     8.15654  3.66577    120         11.9581     120         
1 1 1 33 0  45 o 10 59.5175 3.76505 65.0353     11.0134  65.0353     11.0134  57.2015    360         30.534      360         
1 1 1 33 0  46 o 17 76.3876 3.23866 105.502     12.2948  105.502     12.2948  69.3737    60          31.2916     60          
1 1 1 33 0  47 f 0  23.032  7.33504 14.1707     9.07084  14.1707     9.07084  10.8339    300         0           0           
1 1 1 33 0  48 o 10 106.175 2.94963 202.401     15.6394  202.401     15.6394  99.3543    2.95126e-06 50.1242     2.95126e-06 
1 1 1 33 0  49 o 12 56.0108 4.08766 58.2685     11.1694  58.2685     11.1694  33.6861    60          10.8011     240         
1 1 1 33 0  50 o 5  10.9233 5.28217 -5.248      9.11308  -5.248      9.11308  11.7005    120         32.565      120         
1 1 1 33 0  51 o 11 125.247 2.95644 281.747     18.5097  281.747     18.5097  90.3835    2.41134e-06 6.92468     2.41134e-06 
1 1 1 33 0  52 o 9  84.8453 3.26804 130.41      13.8007  130.41      13.8007  62.49      60          7.55024     60          
1 1 1 33 0  53 o 16 20.7944 7.6485  12.1887     10.3608  12.1887     10.3608  4.71513    300         0.0768147   120         
1 1 1 33 0  54 o 10 57.927  4.35256 63.0318     12.2767  63.0318     12.2767  47.6395    180         15.5739     180         
1 1 1 33 0  55 o 12 9.66804 4.81387 -9.68862    9.16325  -9.68862    9.16325  0.649501   240         1.98875     240         
1 1 1 33 0  56 o 15 55.0399 4.51526 57.5382     12.0181  57.5382     12.0181  46.4378    300         17.6025     300         
1 1 1 33 0  57 o 1  77.1663 3.71499 109.529     14.211   109.529     14.211   56.4547    180         7.7044      180         
1 1 1 33 0  58 o 5  15.544  6.74376 4.74527     10.1066  4.74527     10.1066  1.39863    60          18.4726     60          
1 1 1 33 0  59 o 8  13.6107 6.20694 1.13439     9.81753  1.13439     9.81753  1.9294     300         12.0438     300         
1 1 1 33 0  60 o 19 25.9326 8.03578 18.7551     10.891   18.7551     10.891   7.13251    360         49.1997     360         
1 1 1 33 0  61 o 2  15.6022 6.93029 3.90084     11.3173  3.90084     11.3173  0.0316341  60          3.8251      240         
1 1 1 33 0  62 o 1  22.6615 8.47304 15.4787     12.8741  15.4787     12.8741  8.92504    120         0.724663    300         
1 1 1 33 0  63 o 8  26.0864 9.17767 20.7321     14.5378  20.7321     14.5378  15.6089    8.45002e-06 4.58369     8.45002e-06 
1 1 1 33 0  64 o 8  28.3843 9.4359  24.2355     15.0855  24.2355     15.0855  15.8162    240         9.40486     240         
1 1 1 33 0  65 o 1  63.2468 5.61998 78.7242     17.0511  78.7242     17.0511  47.9478    300         11.9627     300         
1 1 1 33 0  66 o 14 19.5388 8.62098 8.93678     17.2065  8.93678     17.2065  3.79025    360         0.639252    180         
1 1 1 33 0  67 o 18 17.3429 7.78453 5.57053     14.7042  5.57053     14.7042  1.61662    240         2.28313     60.0001     
1 1 1 33 0  68 f 0  13.4601 6.53914 -6.06925    14.3358  -6.06925    14.3358  12.6184    120         0           0           
1 1 1 33 0  69 o 5  18.8804 8.60135 7.53509     18.7902  7.53509     18.7902  1.90135    1.22602e-06 12.2636     180         
1 1 1 33 0  70 o 13 13.8667 6.73544 -5.56835    15.1931  -5.56835    15.1931  1.05703    240         4.55231     240         
1 1 1 33 0  71 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 1  0  o 5  59.7884 3.54665 64.8155     10.4482  64.8155     10.4482  36.6001    0.000204219 15.9899     0.000204219 
1 1 1 33 1  1  o 19 42.7534 4.20814 34.3223     8.85106  32.1476     8.68981  3.7804     162.569     39.3597     342.569     
1 1 1 33 1  2  o 19 123.978 2.69203 268.173     16.3301  278.627     17.0829  53.8405    295.478     72.5698     115.478     
1 1 1 33 1  3  o 2  62.3358 3.38721 72.6095     10.1354  66.5867     10.8046  11.6678    51.8593     60.8971     231.859     
1 1 1 33 1  4  o 16 149.837 2.68231 393.41      19.6538  405.024     20.5961  82.9497    33.9663     53.2781     213.966     
1 1 1 33 1  5  o 6  187.101 2.85479 631.235     26.7402  613.429     26.7903  131.892    82.1246     11.1796     262.125     
1 1 1 33 1  6  o 16 74.5028 3.27526 100.311     11.7407  98.0043     12.5688  58.042     291.25      27.1125     291.25      
1 1 1 33 1  7  o 7  177.76  2.66363 569.974     23.7327  553.1       23.7201  105.671    252.493     49.8991     72.4931     
1 1 1 33 1  8  o 14 100.066 2.79495 169.457     13.6698  187.303     14.305   66.4044    273.421     8.24623     93.4214     
1 1 1 33 1  9  o 14 101.964 2.72907 185.902     13.9521  184.206     13.8877  84.2368    61.5864     27.1558     61.5863     
1 1 1 33 1  10 o 7  58.6584 3.59623 67.4374     10.9874  56.3294     9.94963  15.6874    163.974     45.8735     343.974     
1 1 1 33 1  11 o 10 107.064 2.72695 208.467     14.8133  199.637     14.4024  85.1815    299.486     20.0465     299.486     
1 1 1 33 1  12 o 18 160.218 2.69329 453.03      22.1574  459.606     21.0698  138.192    8.92324     44.1465     8.92324     
1 1 1 33 1  13 o 3  106.99  2.70247 203.802     14.4768  203.722     14.4564  92.7991    295.192     36.813      295.192     
1 1 1 33 1  14 o 12 112.81  2.75202 229.417     15.1215  223.731     15.9255  89.3257    329.539     19.0445     329.539     
1 1 1 33 1  15 o 4  156.515 2.70246 421.159     21.6256  450.556     20.688   133.155    87.6235     39.8417     87.6235     
1 1 1 33 1  16 o 8  247.985 2.98198 1092.48     37.0697  1096.56     37.0477  195.681    101.597     26.7965     101.597     
1 1 1 33 1  17 o 7  222.497 2.8672  883.211     31.9697  878.627     31.9701  181.997    178.933     37.9786     178.933     
1 1 1 33 1  18 o 2  68.7939 3.43618 85.3107     11.5904  84.2976     11.9444  30.9751    103.975     31.4338     283.975     
1 1 1 33 1  19 o 7  162.289 2.96542 484.436     24.7544  454.379     23.446   133.301    48.9076     31.5168     48.9076     
1 1 1 33 1  20 o 2  78.0445 3.29275 107.216     13.0576  110.775     12.5656  52.3912    273.956     1.19572     93.9565     
1 1 1 33 1  21 o 9  88.5852 3.06696 143.706     13.5918  136.684     13.5505  63.7312    334.697     4.87869     334.697     
1 1 1 33 1  22 o 11 54.7453 4.07716 53.459      10.6467  55.0282     11.3847  22.4156    232.536     25.5704     52.5357     
1 1 1 33 1  23 o 16 79.1727 3.42791 120.868     13.0515  104.137     13.8788  49.5286    353.587     9.59395     173.587     
1 1 1 33 1  24 o 4  38.705  5.24111 28.1418     8.92376  27.6614     10.6232  5.47561    7.38613     31.3833     187.386     
1 1 1 33 1  25 o 15 44.6843 4.52114 41.6297     9.50654  31.8943     9.9371   16.9259    17.9885     15.686      197.989     
1 1 1 33 1  26 o 19 105.083 2.86562 192.658     15.0424  201.768     15.0773  107.715    133.154     75.5944     133.154     
1 1 1 33 1  27 o 3  110.079 2.83525 216.074     15.6576  216.679     15.5712  80.5291    266.15      5.7823      266.15      
1 1 1 33 1  28 o 3  37.9815 5.32143 29.4814     9.99202  24.6757     9.55358  6.58682    166.162     2.73259     346.162     
1 1 1 33 1  29 o 16 50.6499 4.41318 46.3054     11.0456  47.47       10.8797  28.3534    63.288      10.7823     63.288      
1 1 1 33 1  30 o 15 158.268 2.78885 439.854     22.0663  454.404     22.1519  125.892    230.24      24.8431     230.24      
1 1 1 33 1  31 o 17 174.178 2.96148 543.548     25.8058  540.511     25.8939  138.625    263.423     26.8566     263.423     
1 1 1 33 1  32 f 0  37.5675 5.80295 36.4129     11.5789  18.2301     9.94035  27.5823    330.283     0           0           
1 1 1 33 1  33 o 13 31.6628 6.88873 18.8086     12.5525  18.7412     11.4534  3.70646    221.349     29.7685     41.3493     
1 1 1 33 1  34 o 11 58.924  4.50681 57.756      13.3588  69.6655     12.6199  47.7536    308.751     17.0527     308.751     
1 1 1 33 1  35 o 13 96.648  3.47647 176.349     17.3696  160.386     16.2026  67.9641    308.969     0.797938    128.968     
1 1 1 33 1  36 o 10 29.9545 6.02709 13.2579     9.60762  20.7632     9.62822  8.46235    62.8758     17.4919     242.876     
1 1 1 33 1  37 o 7  75.4169 3.48236 112.968     13.0768  93.1286     13.0078  38.2055    117.638     29.3267     297.638     
1 1 1 33 1  38 o 4  60.7846 3.73771 63.909      10.6129  70.6259     11.9377  47.2416    343.629     12.4831     343.629     
1 1 1 33 1  39 o 16 86.2953 2.98958 130.121     12.847   137.963     12.9253  62.5951    47.3615     4.56195     47.3616     
1 1 1 33 1  40 o 7  170.077 2.87265 505.7       23.9034  532.914     25.0692  140.086    12.9457     38.8048     12.9457     
1 1 1 33 1  41 o 6  59.1972 3.70751 65.1739     10.605   62.7806     11.1417  49.2665    199.341     19.7507     199.341     
1 1 1 33 1  42 o 4  59.1348 3.62644 63.0146     10.6869  64.6184     10.5914  33.5198    188.458     13.7428     8.45824     
1 1 1 33 1  43 o 12 37.2884 5.22438 25.4452     9.46143  27.8462     9.36969  21.9512    171.946     1.92943     351.946     
1 1 1 33 1  44 o 7  30.6358 5.87187 15.0541     9.28881  21.5474     9.36354  14.6934    312.76      4.84592     132.76      
1 1 1 33 1  45 o 18 69.0519 3.43343 87.2482     11.7829  86.3447     11.8277  35.183     310.195     24.7952     130.195     
1 1 1 33 1  46 o 15 55.052  4.04402 56.8815     11.2076  55.0714     10.782   48.3777    163.529     25.417      163.529     
1 1 1 33 1  47 o 15 96.8501 3.05952 171.052     14.9781  168.435     14.646   84.2566    120.317     35.067      120.317     
1 1 1 33 1  48 o 1  47.3558 4.62915 38.7369     10.8198  45.8739     10.4414  36.1439    179.762     11.076      179.762     
1 1 1 33 1  49 o 19 50.6142 4.64211 49.5702     11.0281  47.0195     11.9017  39.8659    220.937     13.4646     220.937     
1 1 1 33 1  50 o 13 40.9359 5.52894 25.3888     11.0421  40.8102     10.6515  28.7487    185.205     5.30045     185.205     
1 1 1 33 1  51 o 12 42.8254 5.44494 29.4478     10.8584  42.8447     11.578   29.1755    187.839     2.88195     187.839     
1 1 1 33 1  52 o 13 35.6599 6.02581 25.3547     10.7088  26.0892     10.5359  27.0492    122.533     12.5267     122.533     
1 1 1 33 1  53 o 16 32.4272 6.20435 18.8088     10.3547  24.337      10.4089  4.90482    122.495     32.1987     302.495     
1 1 1 33 1  54 o 13 24.7664 6.37318 10.7515     10.1958  11.6956     10.2952  12.014     43.1228     0.797284    223.123     
1 1 1 33 1  55 o 6  32.6325 6.26908 21.7011     10.3606  22.7088     10.6733  19.8851    345.818     0.544744    345.818     
1 1 1 33 1  56 f 0  62.0597 4.35378 62.9662     12.6013  84.8907     14.0549  41.1934    81.5609     0           0           
1 1 1 33 1  57 o 16 17.5319 5.50276 -2.76142    9.46396  0.348341    9.86444  0.913975   70.5414     14.0643     250.541     
1 1 1 33 1  58 o 6  21.3635 6.11236 8.81709     10.3527  2.85987     10.1745  6.08609    216.403     2.83151     36.4034     
1 1 1 33 1  59 o 11 33.5894 6.44793 20.0433     11.6151  28.2132     10.9681  21.394     295.664     5.0656      295.664     
1 1 1 33 1  60 o 13 31.1666 6.59877 23.7861     11.4898  18.1383     10.8258  17.5305    40.4276     0.791129    40.4276     
1 1 1 33 1  61 o 9  19.2501 5.90018 -3.9161     11.2727  4.96788     10.303   3.81498    216.587     4.52397     36.5869     
1 1 1 33 1  62 o 11 46.9012 6.31449 41.738      14.6637  50.6886     13.8408  29.5142    316.092     0.765202    136.092     
1 1 1 33 1  63 o 7  41.2634 6.66664 18.9428     15.32    56.17       13.7592  24.7094    93.3508     2.35343     273.351     
1 1 1 33 1  64 o 17 40.275  7.22702 34.8974     15.7274  38.3632     13.6313  24.2897    260.8       1.32319     80.7998     
1 1 1 33 1  65 o 16 54.1709 6.34566 63.4438     16.7975  62.2631     16.4508  46.3589    85.5501     25.0213     85.5501     
1 1 1 33 1  66 o 10 22.4751 7.21113 3.71679     17.7191  -2.28258    17.5785  7.6461     90.8496     3.32312     270.85      
1 1 1 33 1  67 o 15 42.845  7.83555 51.5293     17.007   39.959      17.1657  28.1819    156.664     5.04264     156.664     
1 1 1 33 1  68 o 6  18.7825 6.25918 -5.63068    15.2608  -8.41781    15.2937  1.82081    65.3659     6.26515     245.366     
1 1 1 33 1  69 o 16 21.1267 6.91228 -4.59824    15.9633  3.08512     18.425   2.71553    154.487     3.74627     334.487     
1 1 1 33 1  70 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 2  0  o 9  44.3827 4.37204 37.0144     9.18492  37.0144     9.18492  9.89414    180         39.8855     360         
1 1 1 33 2  1  o 11 73.761  3.03013 96.8358     11.147   97.4174     11.1581  55.7782    221.346     17.3823     221.346     
1 1 1 33 2  2  o 11 93.6704 2.7712  155.411     12.946   157.15      13.0137  64.4708    94.0003     2.42831     274         
1 1 1 33 2  3  o 8  95.8928 2.81135 155.505     13.2654  172.307     13.6877  69.0544    105.945     3.60041     105.945     
1 1 1 33 2  4  o 7  199.756 2.85507 704.317     27.9535  715.057     29.2029  146.927    260.377     0.871516    80.377      
1 1 1 33 2  5  o 7  121.206 2.64666 255.604     16.0642  267.253     16.043   67.6537    208.589     40.5985     28.5889     
1 1 1 33 2  6  o 3  187.465 2.77979 631.126     26.707   618.813     25.5195  134.433    102.562     7.22184     282.562     
1 1 1 33 2  7  o 6  79.5454 3.04439 115.023     11.7695  110.868     12.3884  66.6883    117.867     31.7622     117.867     
1 1 1 33 2  8  o 13 187.76  2.79219 615.836     25.6762  638.289     26.871   130.276    187.983     15.9498     7.98263     
1 1 1 33 2  9  o 12 140.067 2.70662 362.643     18.536   335.876     19.363   111.169    118.935     19.2842     118.935     
1 1 1 33 2  10 o 1  16.0796 4.84094 -10.2073    7.50735  4.44374     7.53956  22.998     102.48      53.8134     102.48      
1 1 1 33 2  11 f 0  86.2534 2.93557 136.269     12.2919  129.191     12.9758  73.5389    113.998     0           0           
1 1 1 33 2  12 o 6  114.847 2.66533 226.29      15.3063  243.529     15.3171  90.2963    225.877     16.6648     225.877     
1 1 1 33 2  13 o 3  28.4481 5.86291 18.0136     9.44678  11.86       8.42015  2.70369    218.272     18.1829     218.272     
1 1 1 33 2  14 o 3  34.6545 5.55836 24.031      9.18114  20.9294     9.6953   3.06912    159.093     9.07224     339.093     
1 1 1 33 2  15 o 3  117.951 2.93823 245.475     17.1585  250.608     17.5236  99.0259    233.016     29.9627     233.016     
1 1 1 33 2  16 o 3  147.729 3.02954 394.888     22.4568  383.393     22.351   118.504    239.837     22.7068     239.837     
1 1 1 33 2  17 o 6  69.7957 3.6049  86.2369     12.5388  88.6846     12.5027  52.6232    310.388     15.2159     310.388     
1 1 1 33 2  18 o 3  149.552 3.21862 416.833     24.1163  382.072     24.0407  120.846    270.556     24.8644     270.556     
1 1 1 33 2  19 o 5  49.3668 4.54966 38.7817     10.8968  50.5666     10.8904  22.4231    340.865     13.8973     160.865     
1 1 1 33 2  20 o 8  158.714 3.12672 470.711     27.136   429.142     22.509   131.103    53.9215     32.0674     53.9215     
1 1 1 33 2  21 o 16 161.628 2.78877 475.484     22.5351  455.534     22.6319  125.523    266.202     16.3977     266.202     
1 1 1 33 2  22 o 1  123.766 2.81473 281.61      17.7112  265.123     17.1601  99.4259    246.389     21.9954     246.389     
1 1 1 33 2  23 o 4  129.038 2.90268 295.227     18.9173  299.304     18.5713  108.515    180.621     32.6996     180.621     
1 1 1 33 2  24 o 17 79.7059 3.47178 127.353     13.1491  101.536     14.1635  64.3097    139.224     22.0492     139.224     
1 1 1 33 2  25 o 1  81.227  3.24735 114.045     12.8406  122.651     13.4917  36.7618    97.2476     40.1839     277.248     
1 1 1 33 2  26 o 2  79.6864 3.13172 116.053     12.3753  111.594     12.5312  73.7889    315.454     50.294      315.454     
1 1 1 33 2  27 o 17 97.5892 3.14127 178.122     16.3715  163.221     14.2698  77.0207    354.294     17.5395     354.294     
1 1 1 33 2  28 o 6  42.2755 4.86401 32.3329     10.25    33.9591     9.62275  1.56766    285.347     51.7237     105.347     
1 1 1 33 2  29 o 10 50.0821 4.8451  39.004      11.8094  54.0722     11.5156  6.62725    128.828     54.632      308.828     
1 1 1 33 2  30 o 18 148.886 3.01804 405.681     23.1295  387.928     21.8628  124.251    70.2332     34.3338     70.2332     
1 1 1 33 2  31 o 7  95.6597 3.09583 166.762     14.7731  161.546     14.8265  77.3061    160.561     19.2661     160.561     
1 1 1 33 2  32 o 5  117.63  2.99589 248.394     17.6313  247.533     17.6322  67.2293    278.784     34.6029     98.7839     
1 1 1 33 2  33 o 2  97.5467 2.9521  174.509     14.4014  166.853     14.3889  70.927     25.5075     3.12911     25.5075     
1 1 1 33 2  34 o 11 127.636 2.79723 284.987     17.8471  298.673     17.8874  89.2101    151.35      4.4472      331.35      
1 1 1 33 2  35 o 12 98.8805 2.90814 168.28      14.6987  182.866     14.0007  71.7608    130.935     3.2281      130.935     
1 1 1 33 2  36 o 3  105.702 2.87998 199.061     15.6296  202.109     14.8054  77.8499    88.7931     5.6422      88.7931     
1 1 1 33 2  37 o 10 33.6456 5.71616 24.8578     9.4712   18.8417     9.64985  16.7736    354.701     5.79059     174.701     
1 1 1 33 2  38 o 12 81.4792 3.28328 110.155     13.2097  130.275     13.4349  66.5462    199.552     19.5905     199.552     
1 1 1 33 2  39 o 19 111.062 3.02942 227.529     17.212   216.967     16.4492  88.8138    274.331     20.7602     274.331     
1 1 1 33 2  40 o 14 136.146 2.93978 328.276     18.5651  339.098     21.4371  124.226    168.061     55.9611     168.061     
1 1 1 33 2  41 o 9  82.3453 3.34371 121.723     13.1211  124.175     14.3411  60.3221    39.9286     5.88321     39.9286     
1 1 1 33 2  42 o 8  30.4147 6.13364 13.441      9.98195  22.5009     10.021   15.2094    297.51      3.62038     297.51      
1 1 1 33 2  43 o 6  39.0061 5.26848 32.0928     9.96523  26.4319     9.86495  25.0462    129.947     1.44727     129.947     
1 1 1 33 2  44 o 12 28.6308 6.18356 14.8492     10.2165  16.7312     9.23329  13.6316    137.152     1.16846     317.152     
1 1 1 33 2  45 o 11 43.9004 5.05671 44.879      10.4689  29.2629     10.6537  21.4615    250.398     15.2499     70.3982     
1 1 1 33 2  46 o 5  68.6977 3.61911 81.4578     12.2734  91.4941     12.4408  35.0398    322.329     24.7016     142.329     
1 1 1 33 2  47 o 9  37.6474 5.71845 30.8933     10.6296  24.8711     10.3257  25.8948    94.6552     5.35503     94.6552     
1 1 1 33 2  48 o 15 70.232  3.69062 95.466      12.8898  86.0431     12.8739  50.4462    148.89      4.69572     148.89      
1 1 1 33 2  49 o 6  88.2912 3.70772 152.365     15.3393  134.791     17.0919  70.2402    41.299      18.8472     41.299      
1 1 1 33 2  50 o 12 35.1592 5.58453 40.933      10.1552  8.87676     10.9884  20.6421    214.14      3.27888     34.1404     
1 1 1 33 2  51 o 11 22.1592 6.16001 1.42012     9.62786  11.6495     10.9124  1.21492    283.753     23.9413     103.753     
1 1 1 33 2  52 o 13 59.6707 4.22617 60.1966     11.8435  74.6387     13.0802  37.1749    324.429     6.35967     144.429     
1 1 1 33 2  53 o 2  17.9513 5.57118 1.5055      9.21891  -2.93765    10.2106  3.38136    77.0411     4.22558     257.041     
1 1 1 33 2  54 o 13 63.0452 4.24137 76.5046     12.4901  74.4929     13.9052  47.8984    165.686     11.3532     165.686     
1 1 1 33 2  55 o 7  70.5953 3.92788 86.261      13.2788  101.793     14.281   58.5377    225.7       22.5464     225.7       
1 1 1 33 2  56 o 17 54.074  4.665   53.2063     12.0862  60.3975     12.6614  29.7451    335.575     12.3088     155.575     
1 1 1 33 2  57 o 13 28.6567 6.56196 22.0629     10.9876  12.0363     11.1628  12.984     84.8143     6.42061     84.8143     
1 1 1 33 2  58 o 11 17.629  5.58863 -3.58538    9.91829  -0.220428   10.5279  0.641508   203.473     12.8313     23.4727     
1 1 1 33 2  59 o 16 29.0314 6.14571 28.9751     10.9515  3.75604     11.4814  3.7551     307.113     28.2496     127.113     
1 1 1 33 2  60 o 7  51.1724 5.15711 43.0068     12.4173  62.0026     12.9764  38.4835    271.638     11.3469     271.638     
1 1 1 33 2  61 o 6  50.1201 5.66632 57.3048     13.5221  45.1962     13.7799  32.4709    216.349     0.13093     216.349     
1 1 1 33 2  62 o 17 42.1844 6.94886 25.6758     13.1887  54.8656     16.3322  22.4352    75.4436     8.81168     255.444     
1 1 1 33 2  63 o 7  22.303  6.42227 -8.69675    12.2065  16.4228     12.8635  3.11408    255.556     0.999282    255.556     
1 1 1 33 2  64 o 1  29.3439 7.85851 25.784      17.8089  13.9703     13.9618  8.9522     77.8245     17.3015     257.824     
1 1 1 33 2  65 o 18 59.3163 6.26248 60.7865     17.9435  92.0269     17.0113  49.8354    304.361     24.6836     304.361     
1 1 1 33 2  66 o 7  21.584  6.89795 17.7476     18.0531  -44.3601    19.1154  4.38292    239.554     1.43545     59.5544     
1 1 1 33 2  67 o 13 22.8121 6.98606 17.8611     15.7051  -13.1335    16.7804  6.03356    323.235     6.75233     143.235     
1 1 1 33 2  68 o 3  25.8841 7.42735 27.72       16.6292  -6.12557    17.3825  7.19868    210.603     11.2831     30.6031     
1 1 1 33 2  69 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 3  0  o 8  275.778 3.31802 1352.7      45.8264  1352.7      45.8264  259.893    360         106.948     360         
1 1 1 33 3  1  o 7  142.912 2.78391 379.685     19.921   347.989     19.8898  108.194    344.363     7.56128     344.363     
1 1 1 33 3  2  o 2  192.168 2.83198 640.95      27.8328  673.563     26.658   186.052    229.854     89.775      229.854     
1 1 1 33 3  3  o 9  49.9765 4.05701 52.0817     9.91249  38.8511     9.8454   16.1152    101.828     30.299      281.828     
1 1 1 33 3  4  o 11 155.646 2.9311  429.849     22.9296  433.282     22.7537  129.139    198.212     30.5402     198.212     
1 1 1 33 3  5  o 12 212.377 3.24948 815.227     35.49    792.567     33.6754  125.531    243.573     63.991      63.5727     
1 1 1 33 3  6  o 18 129.448 2.84589 303.3       18.9017  293.809     17.9765  91.6722    315.341     5.04767     135.341     
1 1 1 33 3  7  o 1  129.933 2.85011 298.477     18.9462  303.13      18.1084  94.0803    48.5964     0.835476    228.596     
1 1 1 33 3  8  o 16 85.7884 3.04805 118.587     13.0002  144.925     13.0231  43.4207    4.15915     34.9791     184.159     
1 1 1 33 3  9  o 17 168.873 2.88244 508.358     24.9933  507.18      23.7806  142.268    303.331     36.9013     303.331     
1 1 1 33 3  10 o 2  18.8321 5.48276 1.45561     7.8561   2.77691     8.81652  6.1397     282.753     16.4081     282.753     
1 1 1 33 3  11 o 15 145.054 2.92345 378.988     21.2262  371.156     21.2314  128.052    335.152     45.4121     335.152     
1 1 1 33 3  12 o 19 126.553 3.18979 291.128     20.7008  280.804     19.6951  91.9936    100.63      0.38265     100.63      
1 1 1 33 3  13 o 7  39.093  5.43307 24.0645     10.2314  33.2165     10.2694  6.21923    82.1707     31.0784     262.171     
1 1 1 33 3  14 o 17 23.2184 6.0328  8.16391     9.29171  7.67114     9.13237  1.88435    133.973     7.12399     133.973     
1 1 1 33 3  15 o 19 101.652 3.15724 196.396     16.0281  173.324     16.0127  72.5175    334.265     0.116251    334.266     
1 1 1 33 3  16 o 5  212.078 3.14958 792.86      32.5366  812.186     34.4039  167.699    61.0571     23.2459     61.0572     
1 1 1 33 3  17 o 13 28.8541 5.76722 14.2314     8.45079  16.8355     8.98348  6.85717    263.156     39.8705     263.156     
1 1 1 33 3  18 o 15 57.4221 3.59951 60.1662     9.65267  58.7233     10.7944  20.7091    287.793     13.5745     287.793     
1 1 1 33 3  19 o 8  130.438 2.65371 304.855     17.2698  301.875     17.3863  119.055    248.804     51.2776     248.804     
1 1 1 33 3  20 o 17 96.5948 2.85707 166.878     13.2995  166.516     14.2807  93.9104    184.005     57.037      184.005     
1 1 1 33 3  21 o 11 116.375 2.83719 246.229     16.6155  237.52      16.4269  100.472    71.1477     35.5284     71.1476     
1 1 1 33 3  22 o 5  29.0167 5.59168 19.6461     8.42572  11.8482     8.59078  16.2575    315.652     64.7988     315.652     
1 1 1 33 3  23 o 16 63.7056 3.40012 73.8247     10.3196  72.2663     11.1984  36.3556    60.1716     12.4226     240.172     
1 1 1 33 3  24 o 19 130.251 2.72843 318.973     18.2053  287.237     17.3718  96.0992    29.8513     4.43045     29.8513     
1 1 1 33 3  25 o 5  36.7327 5.159   27.126      8.99443  23.5428     9.31598  4.87493    186.79      33.8977     6.79048     
1 1 1 33 3  26 o 15 23.3959 5.89661 6.91495     8.15323  10.6743     9.32353  13.4365    233.269     50.7483     233.269     
1 1 1 33 3  27 o 16 130.332 3.11235 298.1       20.1928  310.55      20.4025  109.729    157.106     31.8137     157.106     
1 1 1 33 3  28 o 11 124.429 2.90036 262.268     16.9729  292.33      19.1612  90.4817    191.696     1.38809     191.696     
1 1 1 33 3  29 o 13 89.4179 3.43828 144.689     13.8202  143.198     16.712   91.7283    358.87      59.0808     358.87      
1 1 1 33 3  30 o 6  36.6117 5.25761 28.5651     8.56008  22.1352     10.0014  2.02454    180.281     44.9551     0.281196    
1 1 1 33 3  31 f 0  121.883 2.79072 270.688     15.6907  261.403     18.2082  71.4891    236.513     0           0           
1 1 1 33 3  32 o 17 78.0135 3.15957 108.442     11.1901  110.743     13.3319  48.2484    113.049     14.0755     293.049     
1 1 1 33 3  33 o 18 123.447 2.67102 267.214     15.6456  278.683     17.349   95.9376    294.154     14.7317     294.154     
1 1 1 33 3  34 o 10 140.29  2.82549 356.987     18.6313  349.1       20.9565  113.148    40.8859     24.8377     40.8859     
1 1 1 33 3  35 o 4  64.9422 3.39264 77.1923     10.3798  75.6749     11.5003  61.4707    16.5507     35.8103     16.5507     
1 1 1 33 3  36 o 18 57.9908 3.65754 61.3502     9.96152  61.2853     11.0397  47.9444    291.745     17.8172     291.745     
1 1 1 33 3  37 o 17 99.924  3.1415  170.007     15.9047  190.682     15.4029  86.7032    168.218     32.3158     168.218     
1 1 1 33 3  38 o 17 94.0998 3.13703 167.233     14.8846  152.816     14.6068  65.0289    318.267     3.02604     138.267     
1 1 1 33 3  39 o 16 30.4144 5.9736  19.3363     8.9147   16.5418     10.0473  15.3713    22.2996     3.05127     22.2996     
1 1 1 33 3  40 o 16 128.908 2.85397 291.955     18.1787  306.594     18.6499  107.82     336.562     32.9324     336.562     
1 1 1 33 3  41 f 0  87.6131 3.38159 134.011     14.8391  144.924     14.719   56.9417    211.974     0           0           
1 1 1 33 3  42 o 8  137.864 3.23231 340.234     22.212   348.027     22.3895  97.7935    103.462     0.425352    103.462     
1 1 1 33 3  43 o 16 71.3223 3.77746 95.7752     12.0135  90.7356     14.5578  51.2569    273.723     3.92514     273.723     
1 1 1 33 3  44 o 7  22.3942 6.08656 0.998058    8.91577  12.5486     10.9005  1.37947    34.1303     28.8434     34.1303     
1 1 1 33 3  45 o 1  41.2415 5.62567 33.1066     10.179   33.1638     12.1821  29.3754    164.909     6.15484     164.909     
1 1 1 33 3  46 o 2  87.3747 3.5072  146.591     13.741   132.735     16.5139  62.3358    282.582     3.13897     282.582     
1 1 1 33 3  47 o 10 85.4678 3.54205 121.291     14.7608  147.252     15.3898  70.8957    259.583     23.5302     259.583     
1 1 1 33 3  48 o 16 45.8002 5.28497 45.8859     11.3943  35.8884     11.8404  32.2528    354.278     3.87197     354.278     
1 1 1 33 3  49 o 10 43.1965 5.38603 34.4885     10.8145  38.8668     11.659   33.7501    281.867     11.6907     281.867     
1 1 1 33 3  50 o 4  68.1145 3.90939 84.9652     12.6587  88.2735     13.7917  57.6269    25.6281     22.6957     25.6281     
1 1 1 33 3  51 o 5  41.6585 5.93229 25.069      11.634   46.6336     12.337   30.7182    255.491     7.82581     255.491     
1 1 1 33 3  52 o 15 52.2124 4.78231 47.6276     11.9023  58.2494     12.4733  39.0206    222.72      8.61142     222.72      
1 1 1 33 3  53 o 18 22.5906 6.14319 2.99375     10.0853  12.5357     10.1435  3.48815    158.4       0.976554    158.4       
1 1 1 33 3  54 o 10 54.803  4.54141 61.2044     12.0169  54.845      12.3802  37.3194    74.6175     1.62094     74.6176     
1 1 1 33 3  55 o 10 79.5925 3.68742 117.11      14.2147  120.243     15.0352  55.987     85.7356     4.22174     85.7356     
1 1 1 33 3  56 o 18 21.2501 6.1183  8.58198     10.2807  2.59822     10.4743  0.921397   325.513     21.7877     145.513     
1 1 1 33 3  57 o 19 46.3872 5.4082  49.5404     12.0506  37.6841     12.0502  35.692     346.648     13.0439     346.648     
1 1 1 33 3  58 f 0  20.3448 6.05156 -8.00897    10.2474  11.7073     12.079   12.8774    67.24       0           0           
1 1 1 33 3  59 o 14 33.64   6.52125 30.0681     11.6657  18.9656     11.3798  16.1987    149.648     9.15683     329.647     
1 1 1 33 3  60 o 5  41.5632 6.49542 45.4268     14.545   29.3416     11.9344  30.4992    91.5675     9.09818     91.5675     
1 1 1 33 3  61 o 5  44.7683 6.61844 51.1113     13.7656  35.8606     14.9813  24.2617    70.7991     9.18244     250.799     
1 1 1 33 3  62 o 10 55.2421 6.00287 71.5525     14.9543  56.5002     16.6372  36.9154    252.86      1.99753     252.86      
1 1 1 33 3  63 o 10 35.2086 7.46541 15.2877     16.844   42.1889     14.915   21.0496    117.43      0.353566    297.43      
1 1 1 33 3  64 o 15 32.9961 7.5875  18.3255     16.3183  33.9957     14.2215  20.6038    109.324     11.8575     109.324     
1 1 1 33 3  65 o 9  28.9047 7.92809 18.9055     16.1534  22.5295     16.6949  14.6491    253.774     1.79568     253.774     
1 1 1 33 3  66 f 0  27.4711 8.00349 16.5609     16.1369  20.0782     19.4613  16.7592    30.6319     0           0           
1 1 1 33 3  67 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 3  68 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 4  0  o 9  75.8798 3.36373 103.582     12.6745  103.582     12.6745  75.6884    180         56.7        180         
1 1 1 33 4  1  o 18 157.191 2.88951 434.413     22.6467  446.555     22.8379  119.989    184.821     8.44156     184.821     
1 1 1 33 4  2  o 15 128.75  2.79181 302.501     17.4518  288.516     18.4841  115.754    24.8568     45.0229     24.8568     
1 1 1 33 4  3  o 7  70.8601 3.51687 91.5836     11.9481  88.6568     12.8347  50.1725    56.4192     4.73657     56.4192     
1 1 1 33 4  4  o 10 135.256 2.83092 324.537     19.1028  327.73      19.2324  97.4518    59.4831     3.23838     239.483     
1 1 1 33 4  5  o 4  163.764 2.98695 472.64      23.7731  484.006     25.2062  150.051    26.5509     59.8216     26.5509     
1 1 1 33 4  6  o 18 123.916 3.02808 274.867     18.1301  273.262     19.3958  98.4299    179.417     16.8824     179.417     
1 1 1 33 4  7  o 9  109.504 3.01952 213.365     15.9724  214.836     17.0887  73.8477    341.071     10.8561     161.071     
1 1 1 33 4  8  o 11 142.363 3.2439  355.414     24.2656  368.806     21.8417  122.276    91.7979     36.8212     91.7979     
1 1 1 33 4  9  o 7  137.151 3.27464 339.594     21.8182  332.774     23.0974  120.571    143.768     41.7418     143.768     
1 1 1 33 4  10 o 14 77.2944 3.61051 101.081     14.2138  113.699     13.5054  65.9432    89.6875     29.3843     89.6875     
1 1 1 33 4  11 o 3  213.207 3.19791 814.509     33.6714  808.438     34.6545  153.722    190.549     8.36273     10.5486     
1 1 1 33 4  12 o 1  67.618  3.33443 75.173      10.851   89.2793     11.5929  32.111     267.185     29.2677     87.1846     
1 1 1 33 4  13 o 12 40.8849 4.58581 27.2191     8.44403  34.5995     9.73514  14.5082    131.172     6.28682     311.172     
1 1 1 33 4  14 o 4  62.3132 3.37952 69.5551     9.76761  70.0738     11.1332  19.1404    252.62      47.8605     72.6197     
1 1 1 33 4  15 o 10 21.4914 5.61865 4.87107     7.46757  8.51705     8.60667  12.0503    236.742     37.3976     236.742     
1 1 1 33 4  16 o 19 206.26  2.76601 764.42      26.9624  752.759     30.1053  178.843    245.968     54.1173     245.968     
1 1 1 33 4  17 o 11 43.2283 4.51619 24.931      8.9008   45.2807     9.6393   4.05778    102.685     46.8529     282.685     
1 1 1 33 4  18 o 1  58.1201 3.55655 62.2115     9.29788  59.6947     11.0791  41.0325    118.419     13.3774     118.419     
1 1 1 33 4  19 o 15 84.605  2.8839  124.901     11.523   131.258     12.8501  52.4786    229.228     14.2847     49.2279     
1 1 1 33 4  20 o 16 27.3914 5.50209 18.3493     7.69191  8.86713     8.83745  9.66046    251.362     47.0385     251.362     
1 1 1 33 4  21 o 8  63.7231 3.6512  71.7438     11.2887  74.891      11.8327  31.5359    87.1808     24.6132     267.181     
1 1 1 33 4  22 o 12 63.4299 3.76314 75.8023     10.8202  69.7626     12.6895  41.3098    93.0136     3.39712     273.014     
1 1 1 33 4  23 o 19 105.331 3.17556 199.364     14.99    198.479     18.2773  99.0066    340.544     48.4889     340.544     
1 1 1 33 4  24 o 16 23.0063 5.81681 12.5982     8.06064  0.539393    10.4887  1.90624    11.964      19.8604     11.964      
1 1 1 33 4  25 o 9  75.7825 3.83056 101.4       13.3007  106.389     15.5552  41.7225    331.583     24.5145     151.583     
1 1 1 33 4  26 o 15 21.2552 5.86014 6.18573     8.4839   4.49807     9.58079  7.8804     76.4479     38.5035     76.4479     
1 1 1 33 4  27 o 5  88.2733 3.0848  136.017     12.5747  143.92      14.6038  78.945     333.404     32.3667     333.404     
1 1 1 33 4  28 o 17 71.8033 3.27629 96.8206     11.1533  89.1243     12.2082  29.1578    297.956     44.4333     117.956     
1 1 1 33 4  29 o 10 59.0546 3.7676  62.9233     10.0376  63.9019     11.9395  34.0992    197.66      14.3742     17.6603     
1 1 1 33 4  30 o 13 113.474 2.93861 229.624     15.9444  232.654     17.3965  90.8052    351.712     18.1609     351.712     
1 1 1 33 4  31 o 6  31.5522 5.51799 22.8422     8.23841  15.2009     9.36623  15.2415    336.171     3.38419     336.171     
1 1 1 33 4  32 o 11 115.932 2.84035 225.858     16.2972  257.253     16.6226  91.0962    245.324     15.5136     245.324     
1 1 1 33 4  33 o 4  80.1491 3.26715 113.479     12.3783  118.757     13.7445  46.1645    56.799      21.7764     236.799     
1 1 1 33 4  34 o 4  131.927 2.69366 319.459     17.6496  305.297     17.9163  78.7707    258.049     32.5597     78.0492     
1 1 1 33 4  35 o 9  47.714  4.19172 41.0065     9.29077  43.2799     10.3164  34.8482    117.594     6.53577     117.594     
1 1 1 33 4  36 o 1  97.1716 2.97071 166.116     13.1397  174.439     15.6629  89.4028    83.0235     41.4723     83.0235     
1 1 1 33 4  37 o 9  19.1733 5.49969 -0.172962   7.79156  6.49082     8.93011  9.67628    222.493     41.2264     222.493     
1 1 1 33 4  38 o 15 29.7244 5.79009 19.8006     8.24591  14.2019     9.88013  13.7461    111.679     6.36024     291.679     
1 1 1 33 4  39 o 13 85.8512 3.19958 136.091     12.3766  131.059     14.8742  60.375     27.9516     0.320983    207.951     
1 1 1 33 4  40 o 7  62.8527 3.70705 62.1173     11.1471  83.4183     11.8821  55.999     100.772     26.6894     100.772     
1 1 1 33 4  41 o 6  61.7782 3.75347 71.2751     11.1208  68.8634     11.8619  32.6194    73.4672     20.615      253.467     
1 1 1 33 4  42 o 7  59.014  4.00164 52.3156     10.9517  77.6195     12.2727  43.4979    220.031     6.27955     220.031     
1 1 1 33 4  43 o 1  82.1696 3.33865 114.942     13.4839  131.329     13.8714  60.2908    125.671     5.72173     125.671     
1 1 1 33 4  44 o 12 70.3171 3.5279  85.0079     11.9121  96.3622     12.793   46.4371    29.9067     4.87798     209.907     
1 1 1 33 4  45 o 7  59.1229 3.88222 62.8805     10.429   66.7083     12.2732  32.5693    327.209     16.5538     147.209     
1 1 1 33 4  46 o 13 73.4689 3.67619 100.956     12.2673  98.1798     14.4773  59.1166    89.045      16.6293     89.045      
1 1 1 33 4  47 o 3  109.564 3.06287 211.519     15.1919  226.138     18.3103  91.8157    52.957      30.6048     52.957      
1 1 1 33 4  48 o 17 40.1219 5.43014 26.5404     9.38904  37.7788     11.7126  26.2138    162.775     0.158088    342.775     
1 1 1 33 4  49 o 6  44.5482 5.09172 36.2284     9.88162  41.6079     12.0694  35.0552    138.241     11.7605     138.241     
1 1 1 33 4  50 o 10 57.6832 4.43597 62.702      11.9914  64.4057     13.2172  35.9795    226.958     6.58648     46.958      
1 1 1 33 4  51 o 9  56.3115 4.35091 55.5871     11.9608  65.8838     12.1213  50.9507    111.567     27.3014     111.567     
1 1 1 33 4  52 o 4  17.7787 5.57383 -5.10314    9.82166  2.17906     10.1591  3.14764    62.1238     6.58418     242.124     
1 1 1 33 4  53 o 10 20.4616 5.97096 0.220339    10.1519  8.07058     10.1129  4.56949    301.972     11.6875     121.972     
1 1 1 33 4  54 o 8  42.3831 5.67159 43.3043     11.4885  30.5613     11.6156  20.8881    104.611     13.6945     284.611     
1 1 1 33 4  55 o 1  37.3974 6.42789 28.1056     11.2269  31.8754     12.6353  27.6771    267.122     18.0578     267.122     
1 1 1 33 4  56 o 4  22.126  6.29497 5.59663     10.5767  8.77292     10.8704  6.75738    126.218     3.57792     306.218     
1 1 1 33 4  57 o 11 19.7925 5.9229  -5.24233    10.669   8.55426     10.6442  3.69047    317.887     11.5566     137.887     
1 1 1 33 4  58 o 3  25.8846 6.50738 3.84578     12.0468  20.1368     11.0448  5.94602    256.408     19.34       76.408      
1 1 1 33 4  59 o 3  37.352  6.5736  36.2028     12.5814  24.6583     12.1794  30.5753    268.541     19.6393     268.541     
1 1 1 33 4  60 f 0  60.117  5.39651 72.3896     17.2251  73.8884     14.2367  14.7594    296.234     0           0           
1 1 1 33 4  61 o 19 25.4637 7.05482 10.1114     13.2624  14.7433     13.0797  8.92372    236.778     11.5962     56.7782     
1 1 1 33 4  62 o 16 29.2979 7.48037 23.5364     13.8533  15.8538     14.7819  11.2878    344.29      12.4281     164.29      
1 1 1 33 4  63 o 3  38.9539 8.3975  42.3854     19.1035  37.7279     16.6738  20.4658    325.41      7.01839     145.41      
1 1 1 33 4  64 o 16 29.702  7.54491 3.34887     16.946   35.8029     16.019   14.4657    199.473     3.28347     19.4725     
1 1 1 33 4  65 o 16 24.526  7.57749 -0.0708092  16.6094  19.9023     19.1498  7.73244    83.0688     6.1251      263.069     
1 1 1 33 4  66 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 4  67 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 5  0  o 8  46.5056 4.08409 40.288      9.12316  40.288      9.12316  28.1913    180         3.18841     180         
1 1 1 33 5  1  o 13 72.6163 3.11672 94.1009     10.9959  94.8549     11.5757  34.4246    345.932     33.5155     165.932     
1 1 1 33 5  2  o 5  73.1073 3.17538 84.6901     10.9239  107.59      12.2241  44.8804    163.628     11.9796     343.628     
1 1 1 33 5  3  f 0  112.473 2.84911 234.645     16.395   217.234     15.673   51.5335    193.488     0           0           
1 1 1 33 5  4  o 1  103.899 2.96302 183.801     16.3833  202.216     14.1908  97.12      261.902     47.3474     261.902     
1 1 1 33 5  5  o 6  81.5863 3.09946 137.37      13.5817  102.279     11.6721  59.1241    193.938     4.03499     193.938     
1 1 1 33 5  6  o 5  138.929 2.7513  352.619     19.6536  336.151     18.6219  117.78     240.89      32.3264     240.89      
1 1 1 33 5  7  o 10 54.0596 3.99147 41.9042     10.3046  65.3955     10.5832  27.9865    176.503     13.5767     356.503     
1 1 1 33 5  8  o 1  64.0503 3.47479 76.3529     11.6919  71.3494     10.4411  50.5161    253.633     22.5978     253.633     
1 1 1 33 5  9  o 12 20.4387 5.61253 7.59696     8.53368  1.63899     8.21431  17.0059    261.207     48.7291     261.207     
1 1 1 33 5  10 o 6  98.1549 2.76318 175.824     13.2913  168.372     13.8162  52.5621    305.86      36.9786     125.86      
1 1 1 33 5  11 o 18 117.161 2.72462 248.254     15.6466  241.827     16.2872  96.1525    9.2469      22.9002     9.2469      
1 1 1 33 5  12 o 16 74.709  3.03045 102.157     11.1657  97.8841     11.4195  40.6592    30.1875     23.5841     210.188     
1 1 1 33 5  13 o 10 63.5386 3.27986 67.7171     10.2009  77.6312     10.5235  41.5365    319.95      1.3576      139.95      
1 1 1 33 5  14 f 0  106.275 2.76096 196.461     14.9124  207.137     14.4208  85.1593    66.5027     0           0           
1 1 1 33 5  15 o 7  46.273  4.02152 38.7056     8.9213   39.4036     9.33593  19.1276    203.726     19.3567     23.7264     
1 1 1 33 5  16 o 8  82.9929 2.91531 123.32      12.0847  123.308     12.0896  72.4019    297.032     30.1791     297.032     
1 1 1 33 5  17 o 8  62.6637 3.66404 63.5635     11.7966  78.7082     10.7399  37.5476    332.309     10.6402     152.309     
1 1 1 33 5  18 o 13 38.2622 5.20822 26.5269     9.39706  28.4322     9.85384  4.64823    226.86      59.7283     226.86      
1 1 1 33 5  19 o 16 74.7821 3.44423 95.7321     12.9505  105.78      12.6818  43.9538    51.3617     18.2929     231.362     
1 1 1 33 5  20 o 4  38.7603 5.46951 27.5693     9.98296  29.1428     10.5222  13.7167    199.11      20.9635     19.1098     
1 1 1 33 5  21 f 0  52.3724 4.60519 51.9854     11.9426  48.886      11.7067  31.7659    231.387     0           0           
1 1 1 33 5  22 o 7  37.043  5.52466 19.0607     9.94618  33.5755     10.0185  20.944     250.717     0.0796731   70.7162     
1 1 1 33 5  23 o 7  96.9046 2.97819 175.635     13.7463  161.318     15.0043  76.4179    180.394     12.5179     180.394     
1 1 1 33 5  24 o 9  76.7787 3.26547 112.953     12.7247  99.5837     12.274   59.0122    320.117     8.40934     320.117     
1 1 1 33 5  25 o 7  44.2333 4.91038 35.1218     11.3608  37.8775     9.514    29.5994    116.323     1.2733      116.323     
1 1 1 33 5  26 f 0  73.4386 3.26023 93.0012     11.5491  101.629     12.3314  52.2011    216.404     0           0           
1 1 1 33 5  27 o 10 48.0434 4.36191 44.7232     9.44656  40.5105     10.8856  19.8936    150.035     26.8305     330.035     
1 1 1 33 5  28 o 18 39.8579 4.86995 31.5655     9.02367  28.1708     9.67159  20.7419    263.818     10.9137     83.8178     
1 1 1 33 5  29 o 5  21.2677 5.73386 3.01245     7.64393  9.41678     9.47434  3.39709    327.583     29.593      327.583     
1 1 1 33 5  30 o 11 87.6667 3.02637 142.238     12.7551  134.711     13.7023  47.0805    85.6213     32.0826     265.621     
1 1 1 33 5  31 o 19 40.9351 4.77567 31.6484     8.93752  31.3808     9.94175  17.1736    308.214     20.804      128.214     
1 1 1 33 5  32 o 1  66.7682 3.40344 87.1216     10.7366  74.9929     11.7237  52.5849    130.104     11.7424     130.104     
1 1 1 33 5  33 o 17 87.2002 3.03176 143.722     12.5969  130.917     13.7139  71.9223    227.874     19.8236     227.874     
1 1 1 33 5  34 o 3  111.923 2.90216 229.271     16.1794  222.101     16.3155  90.8448    38.2865     21.1145     38.2865     
1 1 1 33 5  35 o 18 37.9792 5.18493 27.3103     8.9563   27.9662     10.055   21.2643    270.138     6.66061     90.1383     
1 1 1 33 5  36 o 19 78.4952 3.29923 108.46      11.9866  115.323     13.8301  65.5739    293.735     20.6908     293.735     
1 1 1 33 5  37 o 5  112.732 2.98318 227.604     15.813   231.386     17.7872  86.0601    66.0886     11.0225     66.0886     
1 1 1 33 5  38 o 4  36.9545 5.39835 28.4998     9.01332  24.3821     10.2868  14.2525    116.916     20.416      296.916     
1 1 1 33 5  39 o 14 143.331 2.8323  379.034     19.7114  361.959     20.882   108.808    238.698     12.6602     238.698     
1 1 1 33 5  40 o 3  16.7431 5.21177 -5.13296    7.81655  1.8094      9.27013  1.75878    338.577     17.0395     338.577     
1 1 1 33 5  41 f 0  91.7954 3.03364 148.314     13.6544  157.241     14.1809  72.5756    221.588     0           0           
1 1 1 33 5  42 o 3  36.2973 5.62592 32.0242     9.45412  20.0436     10.575   19.3831    239.134     8.62861     59.1341     
1 1 1 33 5  43 o 9  22.1448 5.90902 2.27869     9.29601  11.6361     9.29434  7.2639     115.582     0.547434    295.582     
1 1 1 33 5  44 o 14 38.7465 5.59509 24.8081     10.6416  34.8528     10.3395  33.0282    218.943     19.6073     218.943     
1 1 1 33 5  45 o 6  21.2527 5.97367 6.72545     9.40642  4.98926     9.65706  7.54377    79.0554     2.30261     259.055     
1 1 1 33 5  46 o 9  25.5607 6.40599 12.8225     9.71715  11.5915     10.8923  13.225     235.727     3.98516     235.727     
1 1 1 33 5  47 o 10 90.8366 3.37269 147.423     15.3487  156.707     15.2337  64.4952    240.191     2.09619     240.191     
1 1 1 33 5  48 o 14 24.9667 6.21525 14.5496     9.42485  8.6345      10.2799  8.54252    223.043     13.0047     43.0434     
1 1 1 33 5  49 f 0  49.1765 4.80158 50.9729     11.2952  43.3258     11.6176  30.5253    293.644     0           0           
1 1 1 33 5  50 o 18 40.7153 5.78504 28.2892     10.4514  40.1151     12.3944  31.5002    265.495     11.0688     265.495     
1 1 1 33 5  51 o 2  39.9932 5.82143 21.1667     10.4725  46.7455     12.364   33.282     36.5803     17.6537     36.5802     
1 1 1 33 5  52 o 3  26.5652 6.45364 18.6594     9.99374  8.4497      11.9102  5.96802    207.114     20.6844     27.1145     
1 1 1 33 5  53 o 10 39.3441 6.16267 36.3416     11.0483  28.9491     12.6682  21.0019    64.6388     8.7611      244.639     
1 1 1 33 5  54 o 18 36.2602 6.32282 34.5558     10.6722  21.6449     12.803   23.9762    270.889     4.07211     270.889     
1 1 1 33 5  55 o 12 49.5595 5.21769 39.1942     11.5956  60.3638     13.3931  35.7656    160.058     6.80389     160.058     
1 1 1 33 5  56 o 15 19.8864 6.09302 6.06814     11.0576  -4.47522    12.0476  2.83571    153.156     15.1983     333.156     
1 1 1 33 5  57 o 2  43.9768 6.15008 29.1301     13.2393  53.4249     12.7994  26.7844    28.8715     3.72678     208.872     
1 1 1 33 5  58 o 19 28.0261 6.99439 11.1304     13.7254  21.0086     11.7675  11.3973    174.781     11.1042     354.781     
1 1 1 33 5  59 o 19 23.9622 6.54115 -7.66293    13.0455  20.6061     12.7421  10.5031    242.779     3.38594     242.779     
1 1 1 33 5  60 o 12 28.4785 7.47845 7.5764      13.6445  28.094      15.9985  14.5267    35.6558     3.86541     215.656     
1 1 1 33 5  61 o 4  67.4245 5.41523 94.5301     17.1577  93.8277     18.7094  52.3101    158.573     15.8142     158.573     
1 1 1 33 5  62 o 3  19.6141 6.32553 -24.8336    15.43    9.28782     14.6905  1.28115    130.929     17.2304     310.929     
1 1 1 33 5  63 o 11 24.7906 7.42886 5.34131     16.5779  17.021      16.0394  8.22643    9.79996     0.100839    9.80004     
1 1 1 33 5  64 o 15 23.0306 7.37287 15.4396     20.5085  -3.71885    15.7228  5.32282    94.1327     10.1265     274.133     
1 1 1 33 5  65 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 6  0  o 7  46.1578 4.69094 40.3524     10.201   40.3524     10.201   12.2033    6.3973e-06  43.6114     180         
1 1 1 33 6  1  o 16 59.7048 3.64622 71.1342     11.6519  57.9662     9.97548  44.9334    220.101     18.5637     220.101     
1 1 1 33 6  2  o 11 36.5695 5.54083 24.5902     10.2049  25.8633     9.49025  9.30263    33.8378     8.53667     213.838     
1 1 1 33 6  3  o 1  22.8243 5.869   8.37756     8.85463  7.57054     8.5152   3.64189    281.395     14.6683     281.395     
1 1 1 33 6  4  o 2  77.7126 3.0104  105.203     11.795   111.258     11.5473  73.265     101.358     46.7644     101.358     
1 1 1 33 6  5  f 0  110.274 2.75441 218.829     15.2821  215.644     15.1137  71.5247    41.7417     0           0           
1 1 1 33 6  6  o 6  114.163 2.61963 245.697     14.3608  219.921     15.4555  110.669    61.629      57.4779     61.629      
1 1 1 33 6  7  o 1  74.2015 2.98759 88.9531     10.713   108.908     11.3845  42.9888    331.778     18.9708     151.778     
1 1 1 33 6  8  o 9  26.2689 5.47708 13.5652     7.48203  11.976      7.9568   4.85315    134.283     31.7856     134.283     
1 1 1 33 6  9  o 13 100.699 2.69042 182.956     13.4806  179.387     13.6219  76.9979    89.8785     8.36435     89.8785     
1 1 1 33 6  10 o 16 64.5762 3.30001 76.1661     10.2549  73.9299     10.9344  37.7507    110.944     14.194      290.944     
1 1 1 33 6  11 o 19 54.9177 3.68826 54.6916     9.4988   54.5496     10.5254  42.1444    296.253     20.637      296.253     
1 1 1 33 6  12 o 2  65.952  3.29937 79.623      10.4003  76.9605     11.2324  47.3708    172.425     3.80925     172.425     
1 1 1 33 6  13 o 2  27.0673 5.81802 11.6473     8.68423  15.3651     8.59572  1.22988    168.005     19.6316     348.005     
1 1 1 33 6  14 o 19 81.8444 3.12827 127.521     13.0245  113.17      12.5314  83.4778    310.897     55.5664     310.897     
1 1 1 33 6  15 o 5  54.1018 4.0734  50.1078     10.4214  56.679      11.3332  41.5295    64.2931     12.561      64.2932     
1 1 1 33 6  16 o 14 135.769 2.963   334.118     19.3282  326         20.8895  125.996    130.33      52.769      130.33      
1 1 1 33 6  17 o 5  29.0775 6.15011 20.75       9.9717   10.5383     9.90965  8.5128     60.051      54.5655     60.051      
1 1 1 33 6  18 o 3  29.0134 6.00087 10.8203     9.30276  20.7059     9.72179  10.3327    309.232     5.29236     129.232     
1 1 1 33 6  19 o 10 22.8454 5.7742  9.75558     7.97294  6.71163     8.90501  3.0953     186.184     8.80491     6.18358     
1 1 1 33 6  20 o 6  59.0924 3.7055  65.3895     10.9312  61.4035     10.7834  56.8617    278.521     35.4056     278.521     
1 1 1 33 6  21 o 11 50.1616 4.07542 49.3354     9.67648  42.9384     10.321   33.8353    221.629     1.14513     41.6287     
1 1 1 33 6  22 o 15 39.2159 5.40489 33.9183     8.90856  24.503      11.3037  27.3036    123.84      7.99314     123.84      
1 1 1 33 6  23 o 18 21.931  5.61817 10.7339     7.90731  3.13881     8.61115  8.04095    275.92      42.0693     275.92      
1 1 1 33 6  24 o 3  109.369 3.09843 224.371     16.534   206.155     17.2944  96.6929    124.675     34.4234     124.675     
1 1 1 33 6  25 o 8  31.6701 5.5943  17.9487     8.54357  20.6772     9.17225  13.1277    303.722     12.2907     123.722     
1 1 1 33 6  26 o 5  55.8927 3.94329 55.696      11.188   58.7127     10.5689  33.1783    45.4259     12.1906     225.426     
1 1 1 33 6  27 o 3  47.8794 4.41112 40.7041     9.65245  44.3682     11.0091  27.7909    282.198     10.2684     102.198     
1 1 1 33 6  28 o 19 73.2267 3.46773 95.7108     12.7756  98.9446     12.5195  66.8954    133.223     30.7123     133.223     
1 1 1 33 6  29 o 6  71.4092 3.51691 94.8525     11.7263  90.5795     13.1935  56.445     49.8357     11.656      49.8357     
1 1 1 33 6  30 o 13 71.1042 3.36737 83.856      11.6843  100.074     12.1366  47.2929    186.181     6.7526      6.18127     
1 1 1 33 6  31 o 19 90.9746 3.1902  151.279     14.6695  148.222     14.329   83.1736    24.9791     36.4456     24.9791     
1 1 1 33 6  32 o 19 117.632 2.85579 250.454     16.566   248.056     17.0475  79.7281    240.422     10.8412     60.4219     
1 1 1 33 6  33 o 16 80.883  3.27179 120.685     12.7999  116.733     13.5825  63.4577    246.015     11.7437     246.015     
1 1 1 33 6  34 o 12 37.7574 5.27872 31.7134     9.50297  23.4351     9.72975  26.5599    195.141     6.33131     195.141     
1 1 1 33 6  35 o 16 92.0764 3.04534 153.913     14.0532  152.857     13.9734  62.1804    72.7814     7.4878      252.781     
1 1 1 33 6  36 o 6  26.7334 6.02198 8.81816     8.75962  18.2454     9.83489  10.6334    91.7053     1.70901     91.7053     
1 1 1 33 6  37 o 13 48.8594 4.58058 47.0402     10.279   42.7397     11.4523  38.9498    185.031     12.5306     185.031     
1 1 1 33 6  38 o 16 20.0331 5.58115 -2.40298    8.31782  9.96358     9.14823  3.42206    117.568     4.44247     297.568     
1 1 1 33 6  39 o 5  25.476  6.04746 11.6298     8.70991  12.5891     9.50785  11.5491    27.9695     0.0114331   27.9716     
1 1 1 33 6  40 o 10 91.4533 3.12653 138.203     14.2645  166.541     14.2011  65.9703    263.177     2.08223     263.177     
1 1 1 33 6  41 o 11 32.5753 6.03254 23.9551     10.1131  18.7194     9.89402  14.6053    356.487     13.2563     176.487     
1 1 1 33 6  42 o 14 43.6659 5.20785 32.7311     10.2465  41.7038     11.7538  13.2895    56.1514     33.7202     236.151     
1 1 1 33 6  43 o 5  50.0621 4.47851 48.0428     10.6667  47.1742     11.2805  38.6887    316.058     9.22015     316.058     
1 1 1 33 6  44 o 9  97.6265 3.14203 160.027     15.3424  189.39      15.2203  78.0116    32.3531     18.386      32.3531     
1 1 1 33 6  45 o 8  27.8892 6.46492 14.4996     10.574   16.8876     10.3286  15.0047    1.052       3.52609     181.052     
1 1 1 33 6  46 o 13 26.2607 6.39857 15.2746     10.0078  11.7294     10.5423  13.9653    305.007     2.17729     125.007     
1 1 1 33 6  47 o 1  57.8945 4.45498 61.8521     12.1297  66.7901     13.3064  38.4823    101.341     2.6739      281.341     
1 1 1 33 6  48 o 17 19.183  5.7789  -0.337853   9.48363  4.74711     10.1486  4.5312     79.3083     9.29743     259.308     
1 1 1 33 6  49 o 4  23.7061 6.18542 11.8702     9.16556  8.4556      10.4573  10.9916    194.759     1.09567     14.7589     
1 1 1 33 6  50 o 3  61.5889 4.16837 70.7151     12.5305  74.2412     12.8874  53.1619    6.6743      23.1693     6.6743      
1 1 1 33 6  51 o 15 43.3769 5.51692 49.3067     10.8381  28.2946     11.7338  38.7902    256.265     27.0255     256.265     
1 1 1 33 6  52 o 11 22.2208 6.17572 7.84123     9.36936  8.13396     10.7732  6.35934    84.9608     0.840168    264.961     
1 1 1 33 6  53 o 4  20.7767 6.17793 1.31648     10.9505  7.04141     11.0708  3.81668    176.157     13.4557     356.157     
1 1 1 33 6  54 o 2  97.5364 3.70064 187.077     17.7785  171.071     18.208   79.1653    36.7301     24.7436     36.7301     
1 1 1 33 6  55 o 17 36.2998 6.92733 32.0782     12.4721  26.251      13.5123  17.715     39.5636     11.1837     219.564     
1 1 1 33 6  56 o 16 20.5086 6.29946 6.85073     11.2117  -6.45123    14.1252  6.91885    2.37592     0.544485    182.376     
1 1 1 33 6  57 o 11 24.5828 6.94462 2.95289     11.869   17.8337     14.5182  12.4636    52.227      0.233868    52.2266     
1 1 1 33 6  58 o 15 23.1461 6.87571 -1.41917    15.6524  12.4359     12.8081  5.42381    133.454     2.04613     133.454     
1 1 1 33 6  59 o 3  26.334  7.34237 17.2717     15.1903  11.7703     13.3498  12.3018    188.6       4.94349     8.59987     
1 1 1 33 6  60 o 13 45.36   7.48389 47.7176     15.3092  51.2224     18.1069  33.7239    326.684     10.5458     326.684     
1 1 1 33 6  61 o 5  37.2096 8.5859  35.0671     20.7302  42.2276     17.1456  24.1972    40.0219     4.97615     40.0219     
1 1 1 33 6  62 o 13 25.913  7.86838 8.48726     21.8516  17.6815     16.3283  9.95387    309.625     0.683045    129.625     
1 1 1 33 6  63 o 8  28.6269 7.82817 43.8712     19.9226  -13.7074    19.1022  8.28327    111.844     3.00463     111.844     
1 1 1 33 6  64 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 7  0  o 2  9.95144 4.86953 -6.6292     8.30184  -6.6292     8.30184  8.36969    360         18.6582     360         
1 1 1 33 7  1  o 4  64.4353 3.69966 70.7748     11.721   79.5348     11.9455  33.7387    358.897     24.2248     178.897     
1 1 1 33 7  2  o 19 40.6619 5.26899 32.8619     10.111   29.2092     10.5401  18.2285    185.744     14.1308     5.74414     
1 1 1 33 7  3  o 9  64.1906 3.58968 75.3984     11.4681  73.4963     11.4378  40.3262    26.4083     9.93198     206.408     
1 1 1 33 7  4  o 17 81.6971 3.2803  125.211     12.9416  114.867     13.7382  56.4111    174.222     5.38915     354.222     
1 1 1 33 7  5  o 4  29.1693 5.64607 18.4051     8.76046  13.8234     8.29936  2.12055    262.948     27.9856     82.9477     
1 1 1 33 7  6  o 9  71.1178 3.4501  104.27      12.166   78.949      12.092   43.2233    5.20242     15.7524     185.202     
1 1 1 33 7  7  o 13 34.375  5.32146 21.3698     9.32926  23.3505     8.49654  12.2947    246.848     15.4679     66.8478     
1 1 1 33 7  8  o 15 127.374 2.77583 302.42      18.2223  278.194     17.1781  119.467    323.919     51.2394     323.919     
1 1 1 33 7  9  o 9  64.0361 3.51989 85.8773     11.8757  63.1708     10.5017  41.7965    342.073     7.46745     162.073     
1 1 1 33 7  10 o 4  22.2286 5.74163 2.42285     9.04132  11.0985     8.35011  1.24465    91.5546     20.9714     91.5546     
1 1 1 33 7  11 o 1  59.3801 4.0583  67.826      11.3889  60.7027     12.3415  35.0087    115.316     14.4686     295.316     
1 1 1 33 7  12 o 17 85.8349 3.3542  136.871     14.2363  128.498     14.4867  69.3391    334.14      13.6757     334.14      
1 1 1 33 7  13 o 13 108.056 3.12754 210.824     16.2796  208.455     17.4899  89.2207    184.072     19.2625     184.072     
1 1 1 33 7  14 o 4  75.1656 3.43749 94.8292     12.9875  109.34      12.6915  57.948     141.608     7.17037     141.608     
1 1 1 33 7  15 o 13 66.3943 3.37735 75.7019     10.4741  83.6355     11.8552  58.6025    251.038     23.4057     251.038     
1 1 1 33 7  16 o 13 90.669  2.9944  149.074     12.6348  146.255     14.4195  89.5797    313.522     48.1674     313.522     
1 1 1 33 7  17 o 15 21.4892 5.75763 8.31338     8.08779  3.83837     9.23167  2.0684     158.823     7.97577     338.823     
1 1 1 33 7  18 o 2  61.3914 3.66543 61.9416     10.1658  75.3234     12.2038  30.3889    243.711     27.6104     63.7108     
1 1 1 33 7  19 o 2  39.4091 5.15409 31.8573     9.22822  26.912      10.2852  0.151789   333.326     54.9054     153.327     
1 1 1 33 7  20 o 18 55.8804 3.91775 61.2415     9.84418  53.0437     11.5248  43.0074    90.6289     8.14089     90.6289     
1 1 1 33 7  21 o 18 80.0254 3.12469 118.899     11.8726  112.086     13.0182  50.6014    54.3345     15.1671     234.335     
1 1 1 33 7  22 o 16 68.3936 3.42982 79.4611     10.8126  90.3088     12.5558  48.3532    282.666     1.38927     102.666     
1 1 1 33 7  23 o 13 19.7881 5.65126 3.84635     8.15397  3.64201     9.16408  2.27791    283.516     23.6362     283.516     
1 1 1 33 7  24 o 5  53.811  3.83813 50.0495     10.2129  56.1418     10.1695  33.6964    341.495     8.24787     161.495     
1 1 1 33 7  25 o 11 50.4787 4.03849 51.1218     9.81089  42.9529     10.1444  39.0227    161.686     9.10479     161.686     
1 1 1 33 7  26 o 7  19.3179 5.14338 10.8851     7.64794  -7.03065    8.29285  0.958067   333.452     11.151      153.452     
1 1 1 33 7  27 o 11 52.4496 4.22634 55.0275     10.6659  46.9576     11.0416  48.0554    40.8977     26.5825     40.8977     
1 1 1 33 7  28 o 1  80.9338 3.20974 112.275     12.4007  125.219     13.5401  72         280.114     28.2523     280.114     
1 1 1 33 7  29 o 5  129.497 2.73625 305.646     17.4994  297.725     17.9632  119.145    252.23      49.8866     252.23      
1 1 1 33 7  30 o 16 94.4596 2.84941 160.503     12.9401  161.323     13.9565  72.6124    95.5541     8.73827     95.5541     
1 1 1 33 7  31 o 3  62.1299 3.51668 69.9003     10.4103  71.1518     11.2926  50.4213    228.299     13.7097     228.299     
1 1 1 33 7  32 o 8  90.624  2.92055 140.733     12.7006  156.219     13.7644  77.5495    6.98277     25.0824     6.98277     
1 1 1 33 7  33 o 17 34.3972 5.5597  20.486      9.17025  25.851      9.61397  8.19422    341.798     29.8598     161.798     
1 1 1 33 7  34 o 19 71.3706 3.35692 88.8971     11.5759  96.8645     12.3045  70.8772    135.588     42.4157     135.588     
1 1 1 33 7  35 o 13 33.594  5.70713 21.7178     8.76163  22.7304     10.2221  18.0326    33.6991     6.82093     213.699     
1 1 1 33 7  36 f 0  69.8893 3.30519 85.9451     11.0058  92.3153     12.016   50.0556    62.603      0           0           
1 1 1 33 7  37 o 14 22.4925 5.71667 -0.367801   8.67089  14.8775     9.28661  7.97411    245.159     2.87518     65.1594     
1 1 1 33 7  38 o 10 27.3802 6.07181 16.1497     8.4744   12.7077     10.3456  8.4554     356.101     17.8231     176.101     
1 1 1 33 7  39 o 11 39.9203 5.26559 35.1303     9.34457  27.2025     10.7558  29.6489    325.804     6.47342     325.804     
1 1 1 33 7  40 o 8  33.4235 5.78638 21.9888     8.97225  22.8919     10.2617  25.8952    101.343     13.051      101.343     
1 1 1 33 7  41 o 14 31.4299 5.95285 22.4521     9.06421  17.4744     10.2681  15.0983    132.324     10.7233     312.324     
1 1 1 33 7  42 o 10 63.9922 3.71001 64.5628     11.1401  88.7557     12.3702  51.129     161.887     12.875      161.887     
1 1 1 33 7  43 o 9  90.4441 3.26725 142.976     14.0514  158.272     15.4773  67.7737    136.506     7.57591     136.506     
1 1 1 33 7  44 o 18 28.7986 6.18149 17.6088     9.09256  16.5106     10.3843  19.2909    185.243     8.27515     185.243     
1 1 1 33 7  45 o 19 65.7165 4.12583 80.5516     12.3473  83.2383     14.4687  48.9089    268.927     6.38541     268.927     
1 1 1 33 7  46 o 15 20.0865 5.79377 1.36942     8.54072  8.1367      10.0247  6.55092    208.639     3.77624     28.6395     
1 1 1 33 7  47 o 14 35.3711 5.95353 27.062      9.63009  25.1506     11.2134  28.3574    209.51      15.5388     209.51      
1 1 1 33 7  48 o 11 30.474  6.40322 22.7753     10.038   16.6022     11.3371  15.5366    169.816     6.80604     349.816     
1 1 1 33 7  49 o 10 35.4828 6.27281 26.4761     10.9217  27.2907     11.3257  17.3652    122.772     11.2225     302.772     
1 1 1 33 7  50 o 16 24.8981 6.54188 17.0526     11.4922  5.91841     10.9717  11.0934    188.607     0.238036    188.607     
1 1 1 33 7  51 o 6  65.4819 4.37822 83.0312     14.6391  82.8045     13.7337  58.5552    317.504     28.9919     317.504     
1 1 1 33 7  52 o 7  28.8222 6.75103 16.649      11.2892  19.233      11.4586  12.5754    111.206     9.76701     291.206     
1 1 1 33 7  53 o 1  28.0933 6.99628 18.5324     11.5925  14.6876     13.1507  12.5502    161.717     7.08768     161.717     
1 1 1 33 7  54 o 14 26.2938 6.89332 14.3933     11.4731  13.376      12.7354  9.39062    245.565     13.3169     65.5653     
1 1 1 33 7  55 o 18 27.148  7.01268 17.8218     12.2377  12.9081     12.8174  15.2802    198.566     7.36714     198.566     
1 1 1 33 7  56 o 11 63.2446 5.01221 96.3759     14.6541  65.063      15.5731  50.6442    219.171     16.3967     219.171     
1 1 1 33 7  57 o 16 58.3417 5.67724 71.156      16.0098  71.224      16.3058  44.9029    272.905     12.1641     272.905     
1 1 1 33 7  58 o 19 35.7026 7.3179  12.8664     15.2296  49.228      16.1465  25.1475    131.459     7.72871     131.459     
1 1 1 33 7  59 o 2  28.5518 7.53085 7.24285     14.8958  30.8993     15.9949  15.4358    243.843     0.958767    243.843     
1 1 1 33 7  60 f 0  23.6294 7.28061 22.6055     17.8882  -17.8717    18.2717  9.01559    63.9148     0           0           
1 1 1 33 7  61 o 8  29.4814 8.46379 23.5619     18.8711  25.7154     20.2     12.3871    284.48      4.20893     284.48      
1 1 1 33 7  62 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 7  63 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 8  0  o 18 51.4872 4.30786 49.4106     10.7065  49.4106     10.7065  29.501     360         24.8603     360         
1 1 1 33 8  1  o 4  151.331 2.84399 416.335     22.4085  403.963     20.6767  135.807    198.72      45.4714     198.72      
1 1 1 33 8  2  o 19 27.3373 5.6681  12.714      8.18886  15.3909     8.38156  5.70948    243.516     0.0254002   243.516     
1 1 1 33 8  3  o 2  55.154  3.75246 53.1323     9.5687   57.5615     10.914   33.3702    187.59      12.0592     7.5899      
1 1 1 33 8  4  o 1  33.9271 5.65783 16.4219     8.97885  28.0791     10.1569  19.6816    189.1       5.01197     189.1       
1 1 1 33 8  5  o 16 60.4185 3.75971 63.1531     10.9434  69.5624     11.5941  44.5909    317.958     2.84051     317.958     
1 1 1 33 8  6  o 3  40.1857 5.1439  34.6487     9.98803  26.3944     9.90535  29.6751    116.904     11.0052     116.904     
1 1 1 33 8  7  o 8  29.7283 5.96206 12.2338     9.35428  21.3227     9.60657  12.8279    24.1657     0.331877    24.1656     
1 1 1 33 8  8  o 5  23.0495 5.84961 12.9736     8.85439  2.15857     9.33145  4.68121    2.1469      36.87       2.1469      
1 1 1 33 8  9  o 12 89.1385 3.27769 140.263     14.2682  146.113     14.9162  61.9803    161.912     7.48439     341.912     
1 1 1 33 8  10 o 10 83.1839 3.17639 122.032     13.4024  127.249     12.9636  64.195     155.558     6.50576     155.558     
1 1 1 33 8  11 o 13 14.0889 4.59942 -4.42311    7.39717  -7.21807    7.83093  9.27226    12.1899     28.5873     12.1899     
1 1 1 33 8  12 o 2  38.1875 4.95635 34.2414     8.95665  21.335      9.13502  25.5207    163.607     3.14652     163.607     
1 1 1 33 8  13 o 8  35.2298 5.08063 27.5007     8.72525  19.8366     8.61037  21.6168    156.824     0.612435    156.824     
1 1 1 33 8  14 o 13 58.0176 3.38295 66.0863     9.51778  56.1708     9.88444  50.3985    58.2356     19.835      58.2356     
1 1 1 33 8  15 o 1  26.8558 5.56595 14.2685     7.8789   13.0352     8.08331  6.68534    241.615     18.0607     61.6151     
1 1 1 33 8  16 o 10 19.8229 5.40992 5.3344      7.38882  4.7845      7.84719  0.779011   339.645     11.9042     159.645     
1 1 1 33 8  17 o 10 50.2889 3.89087 45.9167     9.73769  46.847      9.54938  27.4879    355.034     16.1594     175.034     
1 1 1 33 8  18 o 1  112.303 2.70654 222.15      15.4228  230.62      14.9812  89.0422    41.4124     12.4014     41.4124     
1 1 1 33 8  19 o 19 30.2105 5.41595 19.4616     8.01168  15.6824     8.47954  9.44872    311.183     3.90007     311.183     
1 1 1 33 8  20 o 17 60.1408 3.63597 69.0314     9.91107  62.9799     11.6031  33.4514    256.091     19.6316     76.0906     
1 1 1 33 8  21 o 9  29.9324 5.70828 15.5044     7.95575  19.333      9.57431  15.5405    217.954     0.137799    217.953     
1 1 1 33 8  22 o 19 28.7016 6.13309 15.4931     8.57104  16.1332     10.6074  13.6195    169.409     0.571839    349.409     
1 1 1 33 8  23 o 6  84.7579 3.04908 132.425     12.0135  127.194     13.7014  60.2748    129.984     2.96436     309.984     
1 1 1 33 8  24 o 9  23.1924 5.89537 12.4512     8.71266  4.18104     9.42085  2.80891    250.962     34.0716     250.962     
1 1 1 33 8  25 o 14 75.78   3.19733 98.2097     11.197   110.189     12.9825  63.8902    67.3141     18.7949     67.3141     
1 1 1 33 8  26 o 17 21.6299 5.75921 4.34019     7.6533   9.73317     9.41899  6.64323    260.138     39.9792     260.138     
1 1 1 33 8  27 o 7  31.7891 5.89702 22.3982     9.20522  17.2083     9.96625  15.9245    330.965     7.80973     150.965     
1 1 1 33 8  28 o 18 50.5059 4.51353 52.8701     9.70945  42.7951     12.0106  35.4909    137.396     0.780079    137.396     
1 1 1 33 8  29 o 5  34.3786 5.60369 22.42       8.66346  23.8061     10.2539  17.6915    359.642     9.34771     179.642     
1 1 1 33 8  30 o 4  62.731  3.67899 72.1061     10.6211  72.2748     12.234   49.9634    307.283     11.2289     307.283     
1 1 1 33 8  31 o 4  104.038 2.93428 193.34      14.2825  198.099     16.2099  99.8427    71.3884     49.4916     71.3884     
1 1 1 33 8  32 o 11 44.121  4.80502 37.2432     9.38186  36.7242     11.0819  33.3697    247.278     7.49429     247.278     
1 1 1 33 8  33 o 18 60.9234 3.65596 63.7174     10.4592  72.955      11.6651  54.7606    289.856     24.5059     289.856     
1 1 1 33 8  34 o 4  97.2923 3.09926 181.324     14.6319  162.769     15.4194  74.6911    280.273     8.98869     280.273     
1 1 1 33 8  35 o 11 84.5247 3.0911  129.858     12.4554  130.05      13.6143  69.8931    152.089     18.6433     152.089     
1 1 1 33 8  36 o 17 22.8993 5.92046 9.85042     8.34629  7.70434     9.47458  7.35562    310.279     11.7648     130.279     
1 1 1 33 8  37 o 9  24.5973 5.95646 13.8193     8.45705  8.05398     9.67147  12.0749    104.679     3.39184     284.679     
1 1 1 33 8  38 o 10 47.1188 4.58017 32.1136     9.72952  54.0082     11.0208  43.8138    231.784     24.704      231.784     
1 1 1 33 8  39 o 2  34.2039 5.75634 20.9158     9.27869  26.55       10.2067  24.7765    209.448     5.90513     209.448     
1 1 1 33 8  40 o 16 72.6263 3.44723 94.9384     11.7481  100.141     13.1856  61.3918    292.741     20.1474     292.741     
1 1 1 33 8  41 o 8  42.082  5.138   30.8851     9.83569  39.3065     11.0618  25.7622    254.549     6.04104     74.5494     
1 1 1 33 8  42 o 1  23.4273 5.92156 14.45       8.76786  3.9313      9.94441  10.0567    317.303     6.83267     137.303     
1 1 1 33 8  43 o 6  18.5155 5.5987  6.06427     8.61308  -8.35198    11.463   3.80742    137.852     10.8717     317.852     
1 1 1 33 8  44 o 15 32.4651 6.09501 16.6238     9.62379  28.17       10.8476  13.8467    234.191     10.3043     234.191     
1 1 1 33 8  45 o 9  42.9481 5.3901  44.5373     10.5681  30.4398     11.4425  33.0688    67.8652     9.16404     67.8652     
1 1 1 33 8  46 o 12 41.7399 5.44522 39.7555     10.1773  31.1752     11.5514  25.9346    265.694     3.98606     85.6944     
1 1 1 33 8  47 o 9  22.9663 6.33016 10.3355     10.4225  7.36962     10.6629  9.23094    303.083     1.30881     123.083     
1 1 1 33 8  48 o 16 35.2598 6.73869 23.5156     11.6946  31.4263     12.7856  14.3149    55.8555     17.3908     235.856     
1 1 1 33 8  49 o 3  31.6503 6.33265 6.86631     11.2797  36.1785     12.5445  14.6117    86.471      10.4721     266.471     
1 1 1 33 8  50 o 5  25.1726 6.7864  6.36953     12.027   16.9019     12.3445  11.3016    285.128     4.64087     105.127     
1 1 1 33 8  51 o 6  36.372  6.90823 32.1233     12.7758  26.7442     13.0466  15.5633    0.765865    16.5839     180.766     
1 1 1 33 8  52 o 5  65.702  4.73907 82.6809     15.3923  86.8502     15.3676  50.9427    266.652     12.076      266.652     
1 1 1 33 8  53 o 13 31.2929 6.79781 8.90042     12.5724  33.7542     13.2277  12.3263    235.113     15.5456     55.1132     
1 1 1 33 8  54 o 5  20.956  6.43207 -0.361486   12.0814  6.65118     13.0963  8.14831    227.548     1.62708     47.5484     
1 1 1 33 8  55 o 15 35.1133 7.21111 28.4082     13.2953  29.5239     13.5799  27.6691    40.8145     15.7037     40.8145     
1 1 1 33 8  56 o 6  16.8261 5.59997 -5.47109    11.7001  -10.1969    12.7139  2.14883    321.818     9.8124      141.818     
1 1 1 33 8  57 o 4  68.3589 5.3694  101.857     17.9755  94.1786     18.1439  53.8196    50.6533     15.9878     50.6533     
1 1 1 33 8  58 o 10 39.2978 8.1548  47.4275     18.1119  35.7863     16.2169  29.0381    351.617     12.04       351.617     
1 1 1 33 8  59 o 7  19.2345 6.82543 -14.8965    30.659   -33.9548    17.9921  2.15137    141.925     10.5192     321.925     
1 1 1 33 8  60 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 8  61 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 9  0  o 5  124.084 2.97313 275.537     18.4398  275.537     18.4398  94.044     3.24569e-06 0.601334    3.24568e-06 
1 1 1 33 9  1  o 8  69.0251 3.45568 89.2845     12.5646  83.4347     11.1827  60.2074    333.162     20.7579     333.162     
1 1 1 33 9  2  o 2  66.6772 3.28624 81.594      11.4956  79.2517     10.3091  50.8849    242.841     4.98696     242.841     
1 1 1 33 9  3  o 1  57.9503 3.71258 58.4539     11.0278  64.0074     10.2194  31.5674    71.6782     20.92       251.678     
1 1 1 33 9  4  o 8  73.4879 3.36416 90.6183     12.7329  105.06      11.7548  37.3363    287.206     33.7958     107.206     
1 1 1 33 9  5  o 6  31.3562 5.71854 20.707      9.57808  17.2873     8.5259   2.44311    326.982     37.4086     146.982     
1 1 1 33 9  6  o 8  21.1338 5.42883 2.56592     7.57244  10.5105     7.83646  0.341458   60.2908     20.1642     240.291     
1 1 1 33 9  7  o 12 17.3546 5.19392 2.59527     7.31574  -1.63496    8.49273  6.38985    177.179     29.1259     177.179     
1 1 1 33 9  8  o 6  45.7453 4.42665 44.3323     9.24056  33.7019     10.1597  30.5708    288.341     2.12853     108.341     
1 1 1 33 9  9  o 9  20.2598 5.54078 7.71723     7.97795  2.05908     8.35281  1.25137    56.1361     13.0443     236.136     
1 1 1 33 9  10 o 7  82.5897 3.05574 124.011     11.9485  121.993     13.2116  50.9869    289.472     20.0501     109.472     
1 1 1 33 9  11 o 5  116.038 2.95952 230.844     17.1473  254.042     17.1874  84.0924    63.916      4.65016     243.916     
1 1 1 33 9  12 o 15 60.05   3.85199 69.6134     10.992   62.4119     11.8338  46.8902    51.5097     7.89778     51.5097     
1 1 1 33 9  13 o 1  83.7676 2.99476 129.574     12.6453  123.532     12.4158  66.1812    1.68933     9.32817     1.68933     
1 1 1 33 9  14 o 5  18.9656 5.35893 0.547913    7.84844  6.21629     7.84339  0.590346   269.132     16.8589     269.132     
1 1 1 33 9  15 f 0  59.5    3.65732 65.4917     10.4666  63.8332     11.1047  35.5705    127.128     0           0           
1 1 1 33 9  16 o 16 66.3091 3.36467 85.5214     11.0912  74.4316     11.0772  41.1381    246.158     14.2567     66.1583     
1 1 1 33 9  17 o 5  64.5812 3.63507 69.5064     12.0326  83.0508     11.1026  37.7977    298.753     18.3149     118.753     
1 1 1 33 9  18 o 10 50.85   4.25128 43.4992     9.78524  52.6373     11.4853  31.1208    215.193     9.88525     35.1928     
1 1 1 33 9  19 o 8  24.1486 5.65229 10.5822     7.82033  10.7113     8.10499  7.04394    284.506     2.3412      104.506     
1 1 1 33 9  20 o 7  25.9287 5.59612 16.3618     7.97786  8.71927     8.3802   3.60195    59.5243     25.2586     239.524     
1 1 1 33 9  21 o 12 80.7841 3.27481 131.807     12.5136  105.762     13.6021  49.5212    237.837     19.3668     57.8371     
1 1 1 33 9  22 o 10 42.375  4.4685  39.3611     8.94301  28.4814     9.19978  35.9922    209.248     18.1363     209.248     
1 1 1 33 9  23 o 13 51.7504 4.00052 38.8631     9.46108  61.4763     10.7459  25.2872    333.579     23.4085     153.579     
1 1 1 33 9  24 o 19 36.5255 5.48592 26.8709     8.63871  24.9369     10.7921  26.7835    250.026     8.74771     250.026     
1 1 1 33 9  25 o 10 35.877  5.593   29.9461     9.667    20.5448     9.987    17.8364    218.874     12.3302     38.8743     
1 1 1 33 9  26 o 9  22.6211 5.83517 10.6539     8.0628   5.17012     9.58202  3.57251    234.973     18.4272     54.9729     
1 1 1 33 9  27 o 13 21.6887 5.801   5.382       8.09367  8.77979     9.21692  4.51336    61.0335     12.9249     241.033     
1 1 1 33 9  28 o 10 25.4713 6.12012 17.4102     9.30138  3.31768     11.121   10.2165    71.4986     7.38759     251.499     
1 1 1 33 9  29 o 18 80.4974 3.22771 119.516     12.1173  116.356     13.7337  74.8062    273.258     33.8929     273.258     
1 1 1 33 9  30 o 18 17.5816 5.30899 3.0836      7.73491  -2.80453    9.18147  3.23545    326.154     25.3993     326.154     
1 1 1 33 9  31 o 17 24.6401 5.96502 6.70911     8.38493  15.446      9.71541  9.14393    296.905     2.13169     296.905     
1 1 1 33 9  32 o 11 29.7088 6.08185 19.9867     8.63214  14.604      10.9747  17.299     291.666     2.00348     111.666     
1 1 1 33 9  33 o 3  60.6716 4.02517 66.7031     11.0485  70.4834     13.089   53.039     204.189     20.3757     204.189     
1 1 1 33 9  34 o 3  50.3478 4.63777 48.9717     10.0241  47.5558     12.5541  28.7117    56.025      13.8386     236.025     
1 1 1 33 9  35 o 12 24.3745 6.15957 5.76555     8.48781  15.9286     10.881   8.43175    268.342     13.2132     88.342      
1 1 1 33 9  36 o 2  46.5712 5.07666 45.9963     10.2808  38.5154     12.2508  27.1321    118.385     10.9699     298.385     
1 1 1 33 9  37 o 18 53.1374 4.48736 51.5197     10.3434  56.4212     12.9947  47.8275    357.23      22.0955     357.23      
1 1 1 33 9  38 o 16 18.1415 5.39212 7.00939     8.13418  -10.5823    10.6922  4.1423     10.6529     9.39994     190.653     
1 1 1 33 9  39 o 12 20.9269 6.00716 4.09222     8.57254  7.17965     11.0497  5.10831    288.335     14.2573     108.335     
1 1 1 33 9  40 o 14 87.5792 3.3537  136.286     13.1841  147.941     16.085   71.0374    110.18      17.0915     110.18      
1 1 1 33 9  41 o 2  33.3661 6.36753 27.2467     10.0725  19.8047     12.2054  19.7556    355.924     4.03215     175.924     
1 1 1 33 9  42 o 10 36.1484 6.144   28.7758     9.67192  26.2265     12.4269  27.4982    140.765     8.8792      140.765     
1 1 1 33 9  43 o 12 16.569  5.37766 -7.66419    8.22467  0.175623    11.6456  0.993382   327.947     13.3929     147.947     
1 1 1 33 9  44 o 8  29.8021 7.01514 16.6154     11.5873  22.2105     12.983   16.575     99.1452     3.2234      279.145     
1 1 1 33 9  45 o 4  35.1855 7.21579 21.1288     11.4184  35.7743     15.6461  26.5851    41.176      12.4641     41.176      
1 1 1 33 9  46 o 12 37.3783 6.91755 30.5461     11.469   31.5899     14.8754  24.7136    45.8471     1.70796     45.8472     
1 1 1 33 9  47 o 5  28.3456 6.93702 16.8323     11.1643  17.9333     12.8624  8.24585    197.944     19.0686     17.9438     
1 1 1 33 9  48 o 7  22.1148 6.44248 13.5731     11.6236  -9.67479    14.4966  3.55719    34.3183     0.609754    34.3183     
1 1 1 33 9  49 o 1  38.4371 6.68463 35.7878     12.0812  29.0502     13.6856  31.7841    312.446     16.5535     312.446     
1 1 1 33 9  50 o 19 87.4695 3.80984 132.262     15.8531  158.169     17.3864  63.4021    111.305     4.82384     111.305     
1 1 1 33 9  51 o 7  32.1889 7.0924  13.8528     12.7586  33.1599     13.8802  23.4767    235.993     9.01486     235.993     
1 1 1 33 9  52 o 18 49.189  6.09366 51.9037     14.4311  51.1293     14.5157  33.9865    59.5968     1.81506     59.5969     
1 1 1 33 9  53 o 11 41.1391 7.5161  35.1285     17.502   45.3766     14.391   29.7651    136.56      6.39609     136.56      
1 1 1 33 9  54 o 14 30.517  6.99752 37.6776     14.4544  0.0915516   15.6418  15.0729    111.809     7.84485     291.809     
1 1 1 33 9  55 o 18 27.272  7.5264  15.2103     14.6617  19.4906     15.1176  10.4262    336.208     5.18805     336.208     
1 1 1 33 9  56 o 5  28.2523 7.88804 10.9553     18.7001  26.9344     16.1727  13.4174    141.8       4.82658     321.8       
1 1 1 33 9  57 o 6  50.2116 8.14986 61.1773     21.3473  71.827      19.0065  43.8939    266.741     26.3509     266.741     
1 1 1 33 9  58 o 18 25.7362 8.15676 25.1306     26.4876  6.86661     16.1516  8.81731    141.223     0.39782     321.223     
1 1 1 33 9  59 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 10 0  o 13 82.915  3.3272  124.168     13.7226  124.168     13.7226  76.1269    180         26.7472     180         
1 1 1 33 10 1  o 17 24.3442 5.97685 13.3405     8.88838  6.69998     9.35296  2.67134    140.827     36.2942     140.827     
1 1 1 33 10 2  o 2  78.901  3.1378  106.427     11.454   118.91      13.2642  53.6807    317.241     9.44368     137.241     
1 1 1 33 10 3  f 0  65.0562 3.50817 80.1906     10.4452  73.9723     12.0936  54.7823    173.691     0           0           
1 1 1 33 10 4  f 0  29.8395 5.33178 25.4641     8.1393   8.31315     9.07295  40.0319    107.196     0           0           
1 1 1 33 10 5  o 10 45.4357 4.45523 45.9558     9.16381  31.6873     10.0387  37.6803    30.2568     14.2911     30.2568     
1 1 1 33 10 6  o 19 22.8106 5.66985 8.33799     7.62     9.46815     8.44744  5.62791    99.3744     7.43395     279.374     
1 1 1 33 10 7  o 4  43.188  4.36416 38.2202     8.75581  31.5466     9.424    37.2466    340.985     19.7136     340.985     
1 1 1 33 10 8  o 3  19.4583 5.34805 3.42246     7.50587  6.07092     7.52406  0.371104   166.825     16.4909     346.825     
1 1 1 33 10 9  o 8  73.8374 3.0145  108.54      11.1243  89.0431     11.0125  72.6141    198.366     38.4227     198.366     
1 1 1 33 10 10 o 7  70.1748 3.17793 83.032      11.2661  95.718      10.8879  67.4309    146.763     33.6933     146.763     
1 1 1 33 10 11 o 4  94.3409 2.91295 161.371     13.6667  159.739     13.8092  71.026     205.746     1.98303     205.746     
1 1 1 33 10 12 o 8  22.692  5.67048 1.97656     8.07987  14.1525     8.99634  1.43489    270.134     30.5663     270.134     
1 1 1 33 10 13 o 8  86.9389 3.13839 133.873     12.7233  139.842     14.5051  61.0442    227.641     6.62836     47.6412     
1 1 1 33 10 14 o 13 33.2114 5.62414 24.6068     9.18332  18.4974     9.38065  21.7514    73.3692     9.15768     73.3692     
1 1 1 33 10 15 o 14 32.2615 5.50752 22.1591     8.37654  18.3516     9.29366  9.25357    29.6591     25.0709     209.659     
1 1 1 33 10 16 f 0  19.226  5.57264 -0.198392   8.8331   5.60506     8.59478  32.1062    171.043     0           0           
1 1 1 33 10 17 o 19 79.6304 3.47305 112.903     14.1859  118.231     13.3562  41.2169    159.899     35.2147     339.899     
1 1 1 33 10 18 o 15 48.8456 4.07625 46.6015     10.0616  42.0233     9.51077  33.8364    349.041     1.28697     169.041     
1 1 1 33 10 19 o 2  33.2971 5.49517 22.4123     9.30569  20.9153     8.69948  11.0851    158.731     22.9981     338.731     
1 1 1 33 10 20 o 9  37.374  5.15762 26.5634     9.45874  27.2872     9.16446  24.1684    92.1291     1.39535     272.129     
1 1 1 33 10 21 o 9  57.4318 3.84197 61.067      10.8772  60.5338     10.9744  33.8021    79.4386     15.3815     259.439     
1 1 1 33 10 22 o 9  47.5077 4.27178 45.0454     10.2218  39.3993     9.65296  15.8594    284.402     36.5169     104.402     
1 1 1 33 10 23 o 19 49.9542 3.98423 51.4624     9.70678  41.3957     9.76666  28.7753    181.184     13.6871     1.18448     
1 1 1 33 10 24 o 7  60.4693 3.58769 73.5448     10.4718  60.9857     10.9296  31.0606    49.3275     25.6028     229.328     
1 1 1 33 10 25 o 13 74.4723 3.31079 101.166     12.1928  101.162     12.3937  67.2369    33.1596     26.8631     33.1596     
1 1 1 33 10 26 o 11 24.346  5.67243 16.841      8.60203  3.40558     8.82502  9.0094     203.119     9.90072     23.1193     
1 1 1 33 10 27 o 8  23.0669 5.75941 13.3851     8.17538  3.10515     9.56169  7.0676     299.631     12.3434     119.631     
1 1 1 33 10 28 o 15 69.0125 3.88439 86.2778     12.9147  89.9803     13.7315  54.502     67.135      9.31649     67.135      
1 1 1 33 10 29 o 12 40.8575 5.49995 38.9014     9.60329  26.8705     11.7461  28.7271    293.68      1.45188     293.68      
1 1 1 33 10 30 o 12 28.2946 6.20249 10.7671     8.70167  21.4971     11.0066  18.2812    88.0585     4.6827      88.0585     
1 1 1 33 10 31 o 19 43.62   4.89326 36.7846     9.60394  36.6923     11.0129  25.7405    145.041     9.87274     325.041     
1 1 1 33 10 32 o 16 44.2403 4.89174 35.856      9.93747  39.9511     11.0501  26.0696    185.834     10.1211     5.834       
1 1 1 33 10 33 o 9  21.5874 5.81242 10.7481     8.44578  1.96592     9.84016  7.70856    19.9692     9.05584     199.969     
1 1 1 33 10 34 o 16 56.9136 4.13361 65.4271     10.7479  57.0316     12.2335  36.2597    268.993     8.84057     88.9935     
1 1 1 33 10 35 o 10 35.6599 5.59743 39.4389     9.61411  12.8518     11.0269  19.7325    30.5534     9.19386     210.553     
1 1 1 33 10 36 o 13 18.8492 5.57961 6.29607     8.48548  -3.14242    10.0397  2.04662    76.7977     17.8494     256.798     
1 1 1 33 10 37 o 7  40.6048 5.6859  27.84       10.9416  39.7493     11.3719  22.1196    136.865     11.9909     316.865     
1 1 1 33 10 38 o 15 24.2922 6.22614 12.1564     9.03671  9.97525     10.6555  9.76189    281.996     10.0512     101.996     
1 1 1 33 10 39 o 5  46.7494 4.95337 45.4812     10.3292  40.9977     11.9368  31.4717    32.1815     1.98567     212.181     
1 1 1 33 10 40 o 8  88.9861 3.42812 150.361     14.7502  144.842     15.6674  79.4363    269.1       31.9045     269.1       
1 1 1 33 10 41 o 2  24.9349 6.45064 9.37969     10.3244  14.7466     10.8501  13.0079    194.513     0.407002    14.5131     
1 1 1 33 10 42 o 4  23.8951 6.4545  15.3774     10.6489  2.36763     12.3363  9.85374    49.6061     7.05921     229.606     
1 1 1 33 10 43 o 10 22.2925 6.54669 5.60807     10.9052  7.57275     13.1279  3.79366    43.9195     18.6453     223.92      
1 1 1 33 10 44 f 0  50.1643 5.58086 45.7036     12.7874  57.877      14.3477  32.3599    261.687     0           0           
1 1 1 33 10 45 o 6  47.5291 5.7709  38.6072     12.3853  55.893      14.0794  25.3566    73.695      14.4699     253.695     
1 1 1 33 10 46 o 16 20.852  6.27414 8.7506      10.8459  -5.20704    13.588   2.74875    286.179     18.5883     106.179     
1 1 1 33 10 47 o 15 25.5346 7.11261 15.4328     13.0142  7.84143     14.2458  9.75066    185.809     11.4272     5.80856     
1 1 1 33 10 48 o 3  27.2788 6.74663 25.6001     12.2195  -1.42221    14.7967  13.1114    259.813     7.62027     79.8128     
1 1 1 33 10 49 f 0  27.413  7.32022 13.3669     12.4585  18.7326     15.0129  11.9109    35.7716     0           0           
1 1 1 33 10 50 o 1  47.601  7.06113 34.8038     14.4295  70.7662     18.5997  26.8031    296.701     11.0711     116.701     
1 1 1 33 10 51 o 16 64.8518 6.25477 70.4511     17.2103  113.807     22.432   56.5398    41.2561     24.5846     41.2561     
1 1 1 33 10 52 o 10 33.6046 8.16949 12.8193     16.2125  46.2777     19.4632  23.4527    253.064     6.76114     253.064     
1 1 1 33 10 53 o 12 32.9191 8.52513 26.5905     16.9586  33.7432     19.7724  18.6247    307.619     2.98916     127.619     
1 1 1 33 10 54 o 14 20.5782 6.73042 2.38228     15.3002  -6.69826    17.9101  4.4817     275.5       11.2367     95.5002     
1 1 1 33 10 55 o 11 25.9869 7.91612 21.1034     18.387   7.33693     19.9909  11.0982    157.175     3.44188     337.175     
1 1 1 33 10 56 o 11 22.1046 7.22996 2.57119     17.8333  2.14756     19.9443  5.60052    304.325     7.0126      124.325     
1 1 1 33 10 57 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 10 58 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 11 0  o 13 50.7851 3.86385 47.9177     9.54632  47.9177     9.54632  52.4121    1.63244e-05 28.0776     1.63244e-05 
1 1 1 33 11 1  o 16 66.9012 3.40159 76.496      11.5254  86.7684     11.0529  61.4727    162.316     25.7882     162.316     
1 1 1 33 11 2  o 13 58.5434 3.55822 71.1365     10.4593  54.807      10.1091  36.9406    326.355     11.7445     146.355     
1 1 1 33 11 3  o 4  86.1712 3.08917 130.208     14.0233  138.757     12.4531  78.2189    18.9053     28.8287     18.9053     
1 1 1 33 11 4  o 6  15.8799 4.93486 1.39272     7.82763  -5.1822     7.60478  2.78996    20.7366     17.2814     20.7366     
1 1 1 33 11 5  o 10 60.4646 3.54377 67.6238     10.6831  66.1163     10.6     53.3027    264.385     19.4956     264.385     
1 1 1 33 11 6  o 13 60.5798 3.66785 80.7566     11.4553  55.0063     10.4384  55.2565    162.711     23.5652     162.711     
1 1 1 33 11 7  o 11 62.797  3.49914 70.5649     10.3419  73.5649     11.4911  66.5029    66.4559     45.0839     66.4559     
1 1 1 33 11 8  o 11 33.2737 5.71177 25.0387     8.57008  18.1584     10.5142  9.85414    171.786     26.0023     351.786     
1 1 1 33 11 9  o 18 63.1046 3.50582 74.9976     10.5058  70.6184     11.4256  56.6872    18.6367     22.2254     18.6367     
1 1 1 33 11 10 o 14 48.7568 4.1899  45.4482     9.4743   43.0647     10.4985  27.6544    328.561     14.8576     148.561     
1 1 1 33 11 11 o 5  72.3707 3.21713 105.332     11.1182  85.5675     11.8906  64.7746    32.051      23.6979     32.051      
1 1 1 33 11 12 o 17 85.8925 2.98402 141.683     12.3796  125.617     13.1318  68.8519    5.45446     10.3953     5.45446     
1 1 1 33 11 13 o 2  55.1243 3.83914 48.2127     10.1966  64.4544     10.5961  47.593     37.3121     16.7541     37.3121     
1 1 1 33 11 14 o 7  70.9187 3.13682 90.3764     11.1447  92.3694     11.0376  51.8785    220.234     0.53152     40.234      
1 1 1 33 11 15 o 5  62.0607 3.42636 76.0292     10.5341  64.9884     10.551   42.9127    61.8397     4.75954     241.84      
1 1 1 33 11 16 o 12 61.8417 3.8069  62.4884     11.8245  78.8012     11.3141  34.408     46.4747     21.8136     226.475     
1 1 1 33 11 17 o 17 99.0025 3.03986 179.588     13.9588  175.628     16.0277  66.7074    307.266     13.8608     127.266     
1 1 1 33 11 18 o 6  19.886  5.48694 8.77786     7.89561  -0.981433   8.85205  0.55299    180.64      20.709      0.640384    
1 1 1 33 11 19 o 14 39.5666 5.2854  29.4305     9.67482  31.2717     10.5181  29.6464    298.965     6.3103      298.965     
1 1 1 33 11 20 o 16 21.0108 5.85724 5.20129     8.08424  6.25873     10.0572  4.37706    273.644     12.8811     93.6437     
1 1 1 33 11 21 o 13 66.5966 3.54541 83.2588     12.4035  79.5539     11.0717  48.0108    98.1965     1.18816     278.196     
1 1 1 33 11 22 o 17 65.6526 3.54165 71.7906     11.592   86.8532     11.4252  56.0841    103.812     17.055      103.812     
1 1 1 33 11 23 o 15 48.5508 4.3771  41.4089     10.6786  47.4348     10.0076  28.9537    279.005     11.6504     99.0046     
1 1 1 33 11 24 o 18 52.452  4.14458 51.7051     10.8346  51.2314     10.5814  34.5183    215.252     6.4273      35.2521     
1 1 1 33 11 25 o 14 24.6471 5.86919 18.8932     10.0068  2.44475     8.60852  11.6305    93.6236     5.39694     273.624     
1 1 1 33 11 26 o 3  22.6009 5.75489 16.4229     9.80022  -2.59005    8.96649  9.26417    35.0238     6.90517     215.024     
1 1 1 33 11 27 o 19 19.971  5.70517 4.90656     8.94283  4.17737     8.71137  4.59418    104.394     13.501      284.394     
1 1 1 33 11 28 o 15 26.632  6.09622 14.6318     8.85334  13.2618     9.77755  6.41601    209.947     22.7429     29.9472     
1 1 1 33 11 29 o 9  74.7987 3.68644 98.2346     13.3717  109.557     14.0909  58.1081    104.29      7.25021     104.29      
1 1 1 33 11 30 o 9  21.6369 5.92945 6.46345     8.72328  7.83576     9.61968  0.123922   108.651     28.2666     108.651     
1 1 1 33 11 31 o 3  32.6976 6.05397 24.1188     9.70231  20.0116     10.4744  21.5544    315.277     0.137078    135.276     
1 1 1 33 11 32 o 11 21.8221 5.66787 14.6601     8.80735  -4.26359    10.1074  9.40456    69.8803     5.69479     249.88      
1 1 1 33 11 33 o 9  70.5279 3.57058 90.7775     12.0611  94.7083     13.008   63.3263    192.253     25.1748     192.253     
1 1 1 33 11 34 o 9  21.3472 5.91979 9.55952     8.74297  2.94644     10.2855  2.64383    253.973     21.5296     73.9732     
1 1 1 33 11 35 o 8  33.3691 6.03028 23.7771     9.58519  22.9887     10.6851  17.8488    211.554     9.32462     31.5539     
1 1 1 33 11 36 o 4  35.2887 5.86104 34.8343     9.89641  17.4813     11.1869  17.4032    324.789     13.4323     144.789     
1 1 1 33 11 37 o 6  22.3122 6.26352 8.72218     10.4981  6.84303     10.4215  9.84679    206.12      3.39006     26.1202     
1 1 1 33 11 38 o 1  62.4609 4.51621 84.1577     13.3028  67.7127     14.2258  49.58      144.771     10.6522     144.771     
1 1 1 33 11 39 o 9  59.5629 4.7055  77.5461     13.1414  61.8748     14.0838  43.0429    220.598     1.95732     220.598     
1 1 1 33 11 40 o 19 29.1148 6.7762  15.2674     10.9998  21.7889     12.0223  17.0415    93.4974     0.858506    273.497     
1 1 1 33 11 41 o 10 26.5255 6.48448 22.3758     11.0592  3.71464     12.2962  13.3705    223.327     3.74366     43.3266     
1 1 1 33 11 42 o 9  20.3654 6.30033 2.16615     12.7044  1.83896     11.7398  4.72563    41.5381     10.6606     221.538     
1 1 1 33 11 43 o 8  23.7267 6.50411 17.3564     11.7437  -1.50715    12.4394  6.9052     187.733     14.4728     7.7332      
1 1 1 33 11 44 o 12 46.0236 6.46734 32.8338     13.9102  60.25       14.9101  25.7816    127.513     11.7393     307.513     
1 1 1 33 11 45 o 16 85.3605 4.14474 141.362     17.0285  138.453     18.1731  68.3606    258.781     15.9443     258.781     
1 1 1 33 11 46 o 16 36.4435 7.1919  34.0708     13.5367  26.8187     13.9475  25.7617    88.8064     4.08518     88.8064     
1 1 1 33 11 47 o 15 22.3324 6.73032 3.81537     11.9731  8.1295      14.4546  10.0462    252.047     3.76483     72.0471     
1 1 1 33 11 48 o 9  23.286  6.92159 5.79506     12.9297  10.2457     14.4542  9.08576    61.4287     9.0813      241.429     
1 1 1 33 11 49 o 17 50.5868 7.0647  61.1851     17.543   56.0535     17.0087  42.0047    162.175     16.007      162.175     
1 1 1 33 11 50 o 14 22.4252 6.99595 4.53547     15.2158  5.3795      15.5151  6.9228     125.348     11.8597     305.348     
1 1 1 33 11 51 o 18 21.8919 6.73122 -14.9043    15.284   16.5772     15.1026  5.48152    310.886     13.6172     130.886     
1 1 1 33 11 52 o 5  22.5375 7.03995 9.22658     16.0313  3.764       15.2169  8.12615    63.4054     2.73389     243.405     
1 1 1 33 11 53 o 14 21.9402 6.91715 2.63618     15.8378  7.93659     15.1607  5.88255    170.959     1.87287     350.959     
1 1 1 33 11 54 o 6  23.9259 7.37146 2.73047     18.3676  16.3489     16.0063  6.53234    7.07399     0.304247    187.074     
1 1 1 33 11 55 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 11 56 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 12 0  o 15 19.5761 6.92545 10.5281     8.29984  10.5281     8.29984  1.47007    180         1.40378     0.000395309 
1 1 1 33 12 1  o 9  47.9359 4.43962 50.7223     9.44897  36.0654     10.7308  37.4746    160.535     6.97239     160.535     
1 1 1 33 12 2  o 4  54.1861 3.80141 62.8187     10.3124  46.1715     9.90294  47.0704    191.396     16.5336     191.396     
1 1 1 33 12 3  o 11 52.5773 3.81984 49.9691     10.0836  52.1732     9.74194  51.5498    118.476     30.0359     118.476     
1 1 1 33 12 4  o 6  49.7925 3.99318 50.6873     9.63048  41.5696     9.82141  50.6749    91.2081     37.3746     91.2081     
1 1 1 33 12 5  o 5  24.949  5.78135 14.4201     8.70786  8.79284     8.15487  10.8349    114.569     1.5738      294.569     
1 1 1 33 12 6  o 5  22.3691 5.67832 12.003      8.58776  4.34633     8.03377  6.21892    251.701     11.2786     71.7012     
1 1 1 33 12 7  o 16 139.055 2.70633 340.122     18.8271  357.176     18.8476  133.649    238.357     58.0716     238.357     
1 1 1 33 12 8  o 18 41.1748 4.76111 32.8302     9.58877  31.7441     9.38173  27.9595    9.92953     1.51665     189.93      
1 1 1 33 12 9  o 7  26.676  5.85636 14.9873     8.77183  12.4876     8.55518  11.8494    108.198     8.3146      288.198     
1 1 1 33 12 10 o 16 50.0439 4.09395 45.1954     10.1391  48.1167     10.0002  29.9307    210.793     12.7012     30.7931     
1 1 1 33 12 11 o 6  64.4849 3.4358  85.5925     10.8223  67.182      11.0467  51.9787    240.513     9.46667     240.513     
1 1 1 33 12 12 o 4  37.1508 5.13911 28.8093     9.04067  24.7227     9.38841  30.5172    143.459     14.9136     143.459     
1 1 1 33 12 13 o 13 19.1174 5.50469 5.41358     7.97345  0.923196    8.85481  0.80806    151.79      23.1156     151.79      
1 1 1 33 12 14 o 17 61.1075 3.84794 72.7225     10.8732  65.4178     12.2719  48.75      331.173     8.37127     331.173     
1 1 1 33 12 15 o 11 55.9307 4.25197 57.3018     10.8496  59.6687     12.5644  34.1947    225.503     13.3604     45.503      
1 1 1 33 12 16 o 17 82.2912 3.13696 123.703     12.8191  122.87      12.9576  59.8645    169.436     2.50552     349.436     
1 1 1 33 12 17 o 8  57.5321 3.87439 60.9151     10.525   61.8455     11.5253  40.7124    92.4443     2.50983     272.444     
1 1 1 33 12 18 o 6  36.6874 5.58146 24.6243     9.77725  28.6345     10.1481  26.0165    52.854      2.35112     52.854      
1 1 1 33 12 19 f 0  60.5557 3.86128 73.4514     10.9877  62.7922     12.0012  48.2089    103.508     0           0           
1 1 1 33 12 20 f 0  69.4153 3.611   89.2719     11.4532  88.4313     13.3896  31.0597    351.34      0           0           
1 1 1 33 12 21 o 13 23.402  5.95542 6.31        8.47142  12.8886     9.56573  5.72115    168.686     18.438      348.686     
1 1 1 33 12 22 f 0  85.132  3.1888  143.34      13.0791  122.198     13.8762  46.8816    289.24      0           0           
1 1 1 33 12 23 o 15 21.8155 5.80825 10.7314     8.44084  3.2472      9.47064  8.556      13.7831     7.79852     193.783     
1 1 1 33 12 24 o 17 19.993  5.77869 4.93111     8.51062  3.42347     9.91098  7.14246    48.6744     4.69854     228.674     
1 1 1 33 12 25 o 1  40.9225 5.32317 26.5266     10.2854  40.3586     10.6329  28.0443    345.984     1.46407     165.984     
1 1 1 33 12 26 o 6  16.2091 5.13525 1.01499     8.77906  -7.29622    8.81671  2.42075    138.596     8.45065     318.596     
1 1 1 33 12 27 o 2  46.2138 4.91952 38.3628     11.6296  45.0842     10.1628  27.3728    316.896     11.549      136.896     
1 1 1 33 12 28 o 14 69.776  3.69936 95.0903     12.9654  86.9342     12.7068  59.5883    305.48      17.5668     305.48      
1 1 1 33 12 29 o 12 49.1754 5.07473 54.8686     13.4342  40.9949     10.8878  27.6466    250.549     15.4943     70.5494     
1 1 1 33 12 30 o 11 44.5757 5.10929 43.1619     11.2091  35.8485     10.8011  23.772     92.1597     16.0953     272.16      
1 1 1 33 12 31 o 11 24.3716 6.20846 9.17279     10.0296  13.3121     9.53559  12.4012    107.207     4.1973      287.207     
1 1 1 33 12 32 o 15 16.8348 5.35735 -2.84803    9.00226  -1.57985    9.94316  1.00918    186.01      15.9332     6.00962     
1 1 1 33 12 33 o 15 68.0925 3.8617  87.4254     12.8868  88.2131     13.2461  56.5027    13.0105     14.8164     13.0105     
1 1 1 33 12 34 o 12 21.6146 6.25525 7.68755     10.1584  4.445       11.5576  9.03576    133.918     0.609888    313.918     
1 1 1 33 12 35 o 6  47.3621 5.67191 45.1326     12.624   47.0968     13.3404  37.859     316.179     9.95573     316.179     
1 1 1 33 12 36 o 14 28.4111 6.68876 24.1336     10.9414  7.24147     13.8845  18.3564    333.141     5.03553     333.141     
1 1 1 33 12 37 o 10 21.3475 6.2097  0.0299999   10.5273  10.8159     11.3908  6.91268    29.0227     8.88735     209.023     
1 1 1 33 12 38 o 16 27.6091 6.76425 7.96895     12.0704  23.4121     12.1044  11.9725    285.347     6.12177     285.347     
1 1 1 33 12 39 f 0  65.581  5.04327 112.853     14.8957  61.6171     15.7166  44.6794    70.6789     0           0           
1 1 1 33 12 40 o 11 29.68   7.14398 16.661      12.25    22.9103     13.2753  14.9473    268.32      7.45601     88.3204     
1 1 1 33 12 41 o 17 52.1934 6.18609 56.2397     16.1203  59.2728     15.0244  42.0916    55.6199     12.0906     55.6199     
1 1 1 33 12 42 o 14 78.9052 4.27725 110.664     16.3343  130.433     17.202   66.4023    270.25      20.5613     270.25      
1 1 1 33 12 43 o 16 65.1257 4.88996 85.7895     15.1738  82.8075     16.1944  47.9553    19.467      3.81472     19.4671     
1 1 1 33 12 44 o 19 33.2902 7.79815 13.7261     12.8032  41.4361     18.4829  22.8236    3.00899     16.1102     3.00899     
1 1 1 33 12 45 o 4  23.0673 7.02534 0.950885    15.0904  10.4229     14.7621  10.6533    92.2312     2.85051     92.2312     
1 1 1 33 12 46 o 14 22.6276 6.82511 -8.39407    15.1157  15.0638     14.3539  10.5193    296.322     3.30568     116.322     
1 1 1 33 12 47 o 8  23.2538 7.07686 -0.715689   15.6906  13.2174     15.0227  8.25059    125.59      3.17879     125.59      
1 1 1 33 12 48 o 19 32.7682 8.06688 35.2889     16.8433  21.2221     16.3595  14.6297    262.728     13.3095     82.7283     
1 1 1 33 12 49 o 10 27.5049 7.7325  13.7517     16.914   22.5723     15.6061  14.2595    32.5746     3.04836     212.575     
1 1 1 33 12 50 o 8  27.4763 7.76997 17.895      16.6204  20.5731     15.8623  14.6426    171.081     3.03174     171.081     
1 1 1 33 12 51 o 16 19.3632 6.37147 -11.3674    15.6149  3.72227     15.0108  3.03764    264.208     3.21431     84.2082     
1 1 1 33 12 52 o 2  23.2621 7.25335 12.4207     16.5623  5.89976     16.5789  6.54509    123.511     1.34348     303.511     
1 1 1 33 12 53 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 12 54 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 13 0  o 1  35.8699 5.79116 26.7923     9.06994  26.7923     9.06994  16.5762    1.75659e-05 21.4309     180         
1 1 1 33 13 1  o 17 80.5202 3.01637 117.389     12.1754  118.278     12.0803  61.6931    359.565     2.86674     359.565     
1 1 1 33 13 2  o 3  54.5994 4.06012 53.2597     11.2757  57.8798     10.5331  58.8765    271.168     42.8943     271.168     
1 1 1 33 13 3  f 0  73.2357 3.16119 91.2723     11.5202  104.506     11.5295  26.1935    354.553     0           0           
1 1 1 33 13 4  o 18 99.6874 2.82615 191.71      14.0673  168.529     14.0662  89.9516    231.878     30.1939     231.878     
1 1 1 33 13 5  o 6  19.4066 5.49529 -1.08154    8.77158  7.68766     8.16886  2.28474    342.923     16.741      162.923     
1 1 1 33 13 6  o 6  64.5373 3.38881 69.9767     10.8687  83.0086     10.821   54.8142    43.1075     14.45       43.1075     
1 1 1 33 13 7  o 9  56.3072 3.72603 62.8958     10.3506  54.5386     10.3805  58.1622    36.7182     36.3446     36.7182     
1 1 1 33 13 8  o 6  48.37   4.09987 40.019      9.70086  47.7439     9.6998   39.2448    213.82      9.02308     213.82      
1 1 1 33 13 9  o 9  20.9377 5.63359 4.95238     8.22586  8.05899     8.21988  6.53034    325.843     8.86336     145.843     
1 1 1 33 13 10 o 16 64.2668 3.48035 77.0484     11.3793  74.8508     10.8677  44.6278    122.826     6.07527     302.826     
1 1 1 33 13 11 o 7  18.3799 5.23782 8.57589     8.22172  -5.55549    8.01331  3.7227     36.2006     3.87605     216.201     
1 1 1 33 13 12 o 18 20.9478 5.71032 5.64726     8.61626  7.06917     8.36119  7.06015    301.278     1.46099     121.278     
1 1 1 33 13 13 o 3  44.703  4.74991 28.9426     10.1838  48.7473     9.7372   30.6711    170.808     2.99563     350.808     
1 1 1 33 13 14 o 10 27.9956 5.9454  22.2258     9.19221  7.33093     10.4165  2.91804    119.536     1.89414     119.536     
1 1 1 33 13 15 o 2  60.3704 3.95438 70.3512     11.1523  65.7225     12.3919  54.3459    343.947     20.4102     343.947     
1 1 1 33 13 16 o 8  55.9018 4.10428 65.5373     11.8873  52.2115     10.7573  45.0825    136.379     8.42273     136.379     
1 1 1 33 13 17 o 12 52.5933 4.33571 63.0461     11.097   42.6544     10.9265  56.808     304.639     40.6479     304.639     
1 1 1 33 13 18 o 3  40.5447 5.13812 36.1203     10.1763  28.597      9.89832  37.0483    304.397     18.9547     304.397     
1 1 1 33 13 19 o 7  69.3469 3.45487 85.8323     11.6696  91.955      12.1914  63.211     269.431     24.331      269.431     
1 1 1 33 13 20 o 13 19.7808 5.68541 0.758572    8.43355  7.6152      9.45772  7.09086    237.002     5.76114     57.0017     
1 1 1 33 13 21 o 11 35.2591 5.61042 35.1073     9.47993  15.8101     10.4646  16.6049    311.651     16.641      131.651     
1 1 1 33 13 22 o 3  23.6705 6.01025 11.3591     8.74541  9.19648     9.48593  8.51341    215.814     13.3002     35.8144     
1 1 1 33 13 23 o 2  42.5649 4.97321 32.1431     9.8241   39.3287     10.646   27.1825    250.319     6.59125     70.3192     
1 1 1 33 13 24 o 15 37.4706 5.51892 32.9515     9.60445  24.1593     10.4374  16.248     18.374      20.9592     198.374     
1 1 1 33 13 25 o 7  15.8719 5.18918 -5.8582     8.73946  -4.84027    10.5562  2.60718    227.748     6.10325     47.7477     
1 1 1 33 13 26 o 9  58.2724 4.4427  74.8558     11.3754  56.3393     13.3671  47.5355    216.57      10.5092     216.57      
1 1 1 33 13 27 o 9  24.0234 6.3255  1.34946     8.8401   19.691      12.5388  12.6277    156.744     2.76696     336.744     
1 1 1 33 13 28 o 9  22.8696 6.12911 12.5297     9.28351  4.37968     10.8098  11.1879    36.706      2.31759     36.706      
1 1 1 33 13 29 o 12 18.9328 5.76799 4.28218     10.0051  -1.10036    10.0317  5.40244    200.886     8.65973     20.8857     
1 1 1 33 13 30 f 0  27.8721 6.50469 14.6261     10.5976  18.3639     10.5892  24.2928    36.6043     0           0           
1 1 1 33 13 31 o 17 20.9638 6.18385 6.23049     11.1697  3.90542     10.4463  5.26987    101.465     14.3853     281.465     
1 1 1 33 13 32 o 3  20.2572 6.08686 0.407617    12.3594  5.73159     9.62034  7.03169    69.0176     5.36126     249.018     
1 1 1 33 13 33 o 12 21.4734 6.18896 -14.5112    15.3953  12.8514     10.1039  7.60978    223.737     8.07104     43.737      
1 1 1 33 13 34 o 7  30.451  6.93689 26.4354     13.4242  15.5175     10.8167  20.6328    129.995     10.3069     129.995     
1 1 1 33 13 35 o 17 26.6474 7.12001 13.5017     13.1782  15.7316     12.8818  14.2987    189.233     1.44021     9.23335     
1 1 1 33 13 36 o 19 71.36   4.7142  103.251     16.7932  97.7669     16.5293  56.7992    103.559     11.2192     103.559     
1 1 1 33 13 37 o 13 23.0929 6.57121 1.0831      11.5728  14.8504     12.5714  9.85757    254.241     4.49681     74.2406     
1 1 1 33 13 38 o 14 33.5758 6.63614 39.4088     12.9271  9.9247      13.5056  26.509     23.8802     15.0432     23.8802     
1 1 1 33 13 39 o 2  48.984  6.03708 53.7952     13.6059  47.5674     14.8137  42.37      209.421     17.298      209.421     
1 1 1 33 13 40 o 8  54.0568 6.02066 53.6333     14.5737  70.0093     16.9957  40.4018    50.7704     4.69055     50.7704     
1 1 1 33 13 41 o 13 34.7516 8.2636  28.3267     17.8446  31.7024     16.3662  26.7498    133.614     9.84322     133.614     
1 1 1 33 13 42 f 0  38.5378 7.75083 25.3528     16.1189  47.1783     16.5183  27.252     105.587     0           0           
1 1 1 33 13 43 o 13 35.1341 7.89873 23.6962     16.2898  37.8404     15.8916  24.2266    273.329     2.70737     273.329     
1 1 1 33 13 44 o 12 22.9357 7.0639  -1.95943    15.3696  12.4607     15.7404  11.4438    235.606     0.486597    235.607     
1 1 1 33 13 45 o 6  20.8194 6.67269 0.639241    15.7992  0.813974    14.2498  7.83531    205.362     0.49881     25.3615     
1 1 1 33 13 46 o 19 45.9315 7.75622 42.1037     17.9019  65.2307     17.9365  36.714     78.4896     12.2007     78.4896     
1 1 1 33 13 47 o 13 30.2662 7.61429 38.7753     16.4246  5.83956     16.8553  17.4673    193.947     9.66967     193.947     
1 1 1 33 13 48 o 6  22.9485 7.14205 14.4081     16.5588  0.935079    15.7117  4.86599    92.3593     0.647016    92.3593     
1 1 1 33 13 49 o 19 16.9027 5.78342 -22.8073    15.7559  -6.27548    14.7428  0.0940226  255.441     14.1951     255.441     
1 1 1 33 13 50 x 16 ?       ?       ?           ?        ?           ?        1.45155    90.5233     0           0           
1 1 1 33 13 51 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 14 0  o 18 22.8868 7.22096 14.2234     8.78947  14.2234     8.78947  2.3798     180         1.09336     180         
1 1 1 33 14 1  o 13 69.8244 3.37754 87.1974     11.8567  92.3094     11.6208  54.8329    198.314     5.13376     198.314     
1 1 1 33 14 2  o 15 21.2528 5.681   3.22165     8.26344  10.3939     8.68873  5.26331    188.338     39.5352     188.338     
1 1 1 33 14 3  o 5  55.8298 3.94299 64.7842     11.1514  52.1912     10.5634  56.327     158.714     31.6395     158.714     
1 1 1 33 14 4  o 4  57.6423 3.70157 63.9076     10.6291  59.6728     10.516   42.4547    74.0501     0.689873    254.05      
1 1 1 33 14 5  o 1  41.3729 4.79679 35.9684     9.61621  30.3897     9.54357  30.1537    245.37      0.863143    245.37      
1 1 1 33 14 6  o 3  33.4413 5.51354 20.7621     9.05025  24.1131     9.10743  21.1471    84.7254     4.24191     264.725     
1 1 1 33 14 7  o 8  72.115  3.25636 87.8256     11.7168  103.596     11.6191  52.4734    116.547     3.20066     296.547     
1 1 1 33 14 8  o 15 58.6324 3.70944 69.9274     10.7412  58.3123     10.7433  53.0929    330.333     19.8476     330.333     
1 1 1 33 14 9  o 19 27.5106 5.70018 9.66616     8.78162  20.3535     8.65872  19.186     240.87      8.37676     240.87      
1 1 1 33 14 10 o 17 72.7307 3.28522 86.4646     11.7824  108.86      11.9231  60.192     293.118     11.681      293.118     
1 1 1 33 14 11 f 0  51.4948 4.1026  60.063      10.2103  40.9267     10.2015  28.9104    202.288     0           0           
1 1 1 33 14 12 o 19 31.4055 5.71726 16.5775     9.12063  23.6353     9.15375  22.9614    262.668     4.30083     262.668     
1 1 1 33 14 13 o 5  103.007 2.99542 191.879     15.5136  196.235     15.3416  97.8248    94.3892     40.8307     94.3892     
1 1 1 33 14 14 o 2  33.2575 5.64352 25.9367     9.39011  19.207      9.27758  20.1689    17.0906     6.00802     197.091     
1 1 1 33 14 15 o 8  65.3338 3.69838 79.8368     12.4608  79.6427     11.5328  50.8369    319.48      4.62035     319.48      
1 1 1 33 14 16 o 9  16.3148 5.24322 -3.8723     9.93528  -3.27983    8.7572   0.174138   319.753     17.8408     139.753     
1 1 1 33 14 17 o 1  56.1284 3.97491 61.0312     11.2503  58.1212     10.812   51.8927    183.921     21.928      183.921     
1 1 1 33 14 18 o 1  27.5461 6.09967 15.411      9.63658  15.833      9.09442  18.5649    41.9001     2.74718     41.9001     
1 1 1 33 14 19 o 17 21.3658 5.81065 0.285711    9.02612  12.4531     9.48787  7.49968    150.205     11.2791     330.206     
1 1 1 33 14 20 o 9  21.5376 5.79121 10.7811     8.76659  3.92883     8.93204  8.32816    61.6151     9.4262      241.615     
1 1 1 33 14 21 o 12 75.3351 3.35958 110.259     12.3896  100.835     12.8004  45.867     96.1023     20.484      276.102     
1 1 1 33 14 22 o 10 71.3125 3.6321  89.8031     12.6856  101.243     13.084   57.4461    47.2739     9.40651     47.2739     
1 1 1 33 14 23 o 9  58.1439 4.1108  69.7325     11.9333  59.8282     11.6569  49.9554    146.867     15.1607     146.867     
1 1 1 33 14 24 o 4  53.7046 4.28455 66.2544     10.9424  45.8652     11.226   46.7794    206.77      15.9921     206.77      
1 1 1 33 14 25 o 15 47.4759 6.03918 36.7887     14.8343  57.9964     11.8824  37.5737    5.20007     7.48819     5.20007     
1 1 1 33 14 26 o 9  24.7261 6.58494 15.5316     11.2501  7.07445     11.4742  12.7019    101.852     4.41359     281.852     
1 1 1 33 14 27 o 8  46.9469 5.57984 58.7379     13.242   33.3691     11.801   43.3647    197.797     21.3672     197.797     
1 1 1 33 14 28 o 19 22.8182 6.47203 15.7487     12.0326  -4.95173    12.7964  6.20201    145.103     16.1428     325.103     
1 1 1 33 14 29 o 16 28.3926 7.22505 20.5491     11.7993  12.9153     15.5885  16.537     39.6566     2.11685     219.657     
1 1 1 33 14 30 o 9  65.1769 5.22177 90.6715     15.4538  80.6051     17.6428  53.8526    216.634     13.4033     216.634     
1 1 1 33 14 31 o 1  35.8081 6.71028 45.7227     12.7198  6.13285     18.2949  22.2981    309.937     3.76731     129.936     
1 1 1 33 14 32 o 8  20.6632 6.41971 4.23753     11.3594  -1.09817    14.6322  6.5215     257.33      4.54132     77.3298     
1 1 1 33 14 33 o 10 18.679  6.07564 -7.11535    11.2776  -0.0257796  14.5227  3.29605    82.8438     2.53639     262.844     
1 1 1 33 14 34 o 7  37.4721 7.27863 37.6375     12.8982  27.1486     16.2839  16.3292    278.568     19.2716     98.5675     
1 1 1 33 14 35 o 8  27.8085 6.99576 20.2848     12.0789  12.9928     12.9131  17.9165    279.676     6.85625     279.676     
1 1 1 33 14 36 f 0  32.4826 7.39275 25.701      15.196   23.5145     12.2344  17.357     277.834     0           0           
1 1 1 33 14 37 o 7  29.6045 8.32245 12.4586     19.8525  25.3143     18.1197  12.4866    59.1027     14.1597     239.103     
1 1 1 33 14 38 o 5  35.2169 8.37494 39.8142     19.7372  23.8894     15.3121  27.4898    321.84      10.0778     321.84      
1 1 1 33 14 39 o 13 25.3041 7.63415 13.9657     19.5718  7.54033     14.4156  14.2086    82.0354     0.737414    262.035     
1 1 1 33 14 40 o 14 53.2159 8.21367 84.4671     24.9093  56.9005     17.773   40.5147    250.882     6.55432     250.882     
1 1 1 33 14 41 o 9  25.5185 7.55198 -4.28437    19.426   21.021      16.147   15.0446    232.181     2.32125     232.181     
1 1 1 33 14 42 o 6  28.9298 8.02717 11.9758     16.1495  29.4277     18.4215  13.0535    326.664     8.30935     326.664     
1 1 1 33 14 43 o 19 38.3943 8.29151 50.9746     17.5868  29.3873     19.5677  27.3153    98.6346     4.2238      98.6346     
1 1 1 33 14 44 o 13 21.2131 6.82851 -11.7653    15.6519  11.9403     17.1012  7.55484    309.421     2.6076      129.421     
1 1 1 33 14 45 o 6  26.5254 7.87603 10.6245     18.2404  23.2098     17.8402  12.6857    313.266     4.58128     133.266     
1 1 1 33 14 46 f 0  23.9829 7.3123  20.4792     16.264   -2.78842    17.9888  8.06401    127.039     0           0           
1 1 1 33 14 47 o 18 20.909  6.83307 -1.2841     16.2644  4.29367     17.3334  4.07087    26.5299     2.24028     206.53      
1 1 1 33 14 48 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 14 49 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 15 0  o 4  59.8824 3.76585 66.6305     11.086   66.6305     11.086   50.2739    180         8.99577     180         
1 1 1 33 15 1  o 13 15.7106 4.98793 -1.60177    8.19573  -3.01066    8.15542  2.15509    122.298     9.97872     302.298     
1 1 1 33 15 2  o 10 85.3582 3.06449 136.044     13.1609  131.745     12.9707  75.3782    287.16      21.9333     287.16      
1 1 1 33 15 3  f 0  15.657  4.99664 -6.86942    8.55038  0.0636509   8.36999  27.8649    45.4359     0           0           
1 1 1 33 15 4  o 9  69.0453 3.43259 90.8442     11.8627  86.2819     11.7369  69.6395    110.042     36.4978     110.042     
1 1 1 33 15 5  o 13 53.9977 4.12952 55.3226     11.4125  55.6051     10.5528  51.6723    73.4512     24.2875     73.4512     
1 1 1 33 15 6  o 10 30.0603 5.83464 17.8021     9.04396  19.5834     9.08019  18.0893    123.442     12.8315     123.442     
1 1 1 33 15 7  o 1  35.3895 5.49204 23.8834     9.33604  27.1053     9.61728  28.2111    353.991     7.42124     353.991     
1 1 1 33 15 8  o 8  27.3179 5.58461 23.7921     9.01119  5.64817     8.94062  9.49028    79.186      19.0551     259.186     
1 1 1 33 15 9  o 16 19.6462 5.43184 -4.06997    8.50745  11.2006     8.62128  6.49531    316.085     10.0585     136.085     
1 1 1 33 15 10 o 18 45.9782 4.70158 46.8052     10.1987  36.0657     10.5882  35.8294    165.078     4.60101     165.078     
1 1 1 33 15 11 o 10 49.369  4.37352 44.5884     10.7122  49.4728     10.3948  48.1559    64.8947     25.161      64.8947     
1 1 1 33 15 12 o 7  26.8527 5.99407 13.0443     9.13183  16.6349     9.0098   12.5446    84.277      7.98698     84.277      
1 1 1 33 15 13 o 1  31.9991 6.11324 21.3184     9.76038  21.9688     10.3079  21.9313    239.87      0.151306    239.871     
1 1 1 33 15 14 o 13 48.6803 4.36732 47.0572     10.381   44.6114     10.4381  44.2305    132.398     18.0357     132.398     
1 1 1 33 15 15 o 6  33.5798 5.95044 27.6397     10.2491  19.9843     9.86794  23.7687    17.1976     1.28892     17.1977     
1 1 1 33 15 16 o 17 29.2054 5.77323 28.0625     9.87617  6.99443     9.68233  20.5528    199.412     3.10621     199.412     
1 1 1 33 15 17 o 19 23.0139 5.98139 7.9045      9.20122  11.6909     9.04801  11.1604    97.3278     3.72823     97.3278     
1 1 1 33 15 18 o 17 64.8361 3.63632 73.773      11.6819  84.8889     11.7025  49.5318    142.465     2.76386     142.465     
1 1 1 33 15 19 o 19 33.867  6.07859 17.1286     10.109   32.5098     11.0824  23.5699    61.7575     0.66711     61.7575     
1 1 1 33 15 20 o 18 42.7285 5.59286 41.2339     11.5113  34.2052     11.5202  36.1044    292.03      11.943      292.03      
1 1 1 33 15 21 o 17 21.8023 6.29145 9.42128     11.6381  4.17198     10.1209  2.98593    260.918     22.371      80.9181     
1 1 1 33 15 22 o 17 36.5368 6.44126 24.3703     12.7239  33.8725     11.1517  29.6125    284.952     10.0334     284.952     
1 1 1 33 15 23 o 10 50.3636 5.50832 64.3083     14.7316  40.9843     12.1306  39.8617    331.372     7.09752     331.372     
1 1 1 33 15 24 o 12 25.5993 6.58623 20.8409     12.2586  4.9986      10.6809  13.8419    206.577     3.17616     26.5772     
1 1 1 33 15 25 o 2  29.812  7.05256 23.9612     13.6989  16.3542     11.1129  20.6891    194.39      5.84858     194.39      
1 1 1 33 15 26 o 13 33.3988 6.83837 25.4703     12.8283  24.946      11.4056  25.9716    318.989     10.5727     318.989     
1 1 1 33 15 27 o 16 31.0742 6.9582  27.1532     12.5298  16.6253     12.2733  22.3843    115.579     10.3976     115.579     
1 1 1 33 15 28 o 15 18.1726 5.71236 4.92233     10.8505  -8.70454    10.8194  3.49604    189.762     8.84584     9.76184     
1 1 1 33 15 29 o 13 21.9944 6.32533 14.2814     12.0883  -1.98294    10.9096  7.78871    131.867     0.241009    131.867     
1 1 1 33 15 30 o 2  45.9665 6.01867 47          13.333   42.9551     13.3628  39.9491    350.894     16.1578     350.894     
1 1 1 33 15 31 o 1  16.4631 5.41361 -9.06546    11.1306  -3.36608    10.6214  0.411689   291.15      0.440479    111.15      
1 1 1 33 15 32 o 2  22.5582 6.66543 -0.148886   14.5622  11.1054     11.767   10.425     355.343     1.69991     355.343     
1 1 1 33 15 33 o 8  29.6879 7.48294 25.4565     15.6383  15.5035     12.4866  18.7395    255.068     11.8355     255.068     
1 1 1 33 15 34 o 13 59.2397 6.35209 79.996      18.2123  71.2176     18.2485  37.6597    122.477     10.4656     302.477     
1 1 1 33 15 35 o 15 26.0405 7.43201 17.2971     15.1774  8.7689      15.0816  13.3652    63.1059     7.19819     63.1059     
1 1 1 33 15 36 o 13 26.0796 7.96306 8.25516     15.8426  15.8732     21.9497  8.11125    336.952     4.68486     336.952     
1 1 1 33 15 37 o 7  28.7138 8.14657 24.8628     16.061   8.87156     22.8212  17.7006    126.182     0.328653    306.182     
1 1 1 33 15 38 o 8  30.8828 8.58563 27.413      17.0652  21.6852     23.4194  22.4635    180.115     9.16615     180.115     
1 1 1 33 15 39 o 4  35.9472 9.40271 21.9281     18.6808  60.8912     26.8345  17.1581    266.982     14.395      86.9818     
1 1 1 33 15 40 o 17 28.991  8.79271 18.7271     21.4241  26.633      24.2693  16.5231    102.6       8.32364     102.6       
1 1 1 33 15 41 o 18 22.5518 7.52573 -0.617899   20.8287  -1.83708    23.6355  2.08908    148.221     0.537913    148.221     
1 1 1 33 15 42 o 3  26.3419 8.35012 5.83008     21.8115  25.7099     24.0446  12.593     296.085     3.26229     296.085     
1 1 1 33 15 43 o 4  20.1483 6.90082 -2.759      20.6837  -24.4908    23.2157  4.2535     74.3895     2.50157     254.39      
1 1 1 33 15 44 o 3  29.2046 8.48203 20.7859     23.0966  30.9224     18.4949  14.077     135.825     5.75044     135.825     
1 1 1 33 15 45 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 15 46 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 16 0  o 6  11.5945 5.4592  -1.58935    8.55704  -1.58935    8.55704  9.50043    180         33.7799     180         
1 1 1 33 16 1  o 10 73.233  3.42298 111.553     12.4213  89.5069     12.427   64.5349    239.979     18.8145     239.979     
1 1 1 33 16 2  o 3  60.0571 3.7887  69.2101     11.3304  67.5056     11.2357  50.9258    149.383     12.1953     149.383     
1 1 1 33 16 3  o 8  28.9241 5.99411 13.8182     9.27728  21.6021     9.51777  15.0908    262.056     9.73974     82.0558     
1 1 1 33 16 4  o 11 15.8749 5.07208 -4.75953    8.53849  -0.641273   8.74187  2.52333    228.215     9.51932     48.2151     
1 1 1 33 16 5  o 4  64.601  3.61442 79.4642     11.5142  77.7779     11.6934  58.8751    213.804     21.2431     213.804     
1 1 1 33 16 6  o 17 19.1605 5.63148 2.75602     8.88307  4.87276     8.9774   6.90598    51.0701     6.24291     231.07      
1 1 1 33 16 7  o 4  32.7937 5.81288 26.0897     9.623    19.3757     9.57019  20.5618    242.377     4.84952     62.3773     
1 1 1 33 16 8  f 0  53.3715 4.24354 64.1805     11.0027  46.5327     10.9919  37.3543    257.197     0           0           
1 1 1 33 16 9  f 0  31.6983 5.90247 21.8887     9.43191  20.7978     9.58328  12.7215    43.1742     0           0           
1 1 1 33 16 10 o 16 52.8556 4.16171 52.976      10.8016  54.8526     10.87    32.3458    274.432     14.0448     94.4315     
1 1 1 33 16 11 o 1  39.769  5.63294 39.3903     10.6384  26.7241     10.9853  34.1493    176.259     12.4646     176.259     
1 1 1 33 16 12 o 9  30.5006 6.75359 16.3387     11.9559  24.5883     11.4472  23.759     304.072     10.5975     304.072     
1 1 1 33 16 13 o 14 19.0807 5.53126 -6.69669    9.24209  10.3183     9.33637  5.949      306.177     9.1676      126.177     
1 1 1 33 16 14 f 0  50.551  4.97493 52.9976     12.4943  49.3234     12.0298  42.0543    200.082     0           0           
1 1 1 33 16 15 o 12 36.1686 6.02074 29.2574     10.6211  26.6922     10.8549  24.9662    17.9927     0.846003    197.993     
1 1 1 33 16 16 o 19 23.9128 6.56918 8.83276     11.6057  11.9406     11.0633  8.14461    351.508     14.7245     171.508     
1 1 1 33 16 17 o 11 45.6425 5.76958 52.7382     12.5572  34.9707     12.6056  40.7516    317.036     16.7531     317.036     
1 1 1 33 16 18 o 15 26.3669 6.91589 19.5162     12.236   7.89796     13.0655  8.79471    307.474     17.7041     127.474     
1 1 1 33 16 19 o 9  52.9986 5.13865 51.5532     13.3291  62.2319     13.0725  46.9677    234.902     17.1834     234.902     
1 1 1 33 16 20 o 1  20.0396 5.99684 -1.72025    11.1653  7.79788     10.2914  6.89587    315.591     5.0992      135.591     
1 1 1 33 16 21 o 8  45.7285 6.16907 40.99       12.9589  48.9229     14.3013  31.2219    73.732      3.32454     253.732     
1 1 1 33 16 22 o 8  46.3219 5.80481 49.6791     13.0208  40.8386     12.8852  30.7532    38.6055     5.24269     218.606     
1 1 1 33 16 23 o 3  35.2133 6.72564 32.814      12.4752  23.4104     12.0472  27.2365    284.15      8.50451     284.15      
1 1 1 33 16 24 o 11 37.4545 6.78009 35.2672     13.3626  28.3268     12.2449  22.5764    68.2137     7.05257     248.214     
1 1 1 33 16 25 o 11 33.7578 6.98554 25.0474     13.115   27.3763     12.11    21.2922    209.68      3.06632     29.6798     
1 1 1 33 16 26 o 18 24.36   6.71131 8.00229     12.8729  13.7902     11.1873  6.17246    85.3971     19.5368     265.397     
1 1 1 33 16 27 o 5  15.3688 5.19422 -8.34381    11.3876  -14.1631    11.1876  1.46942    97.5267     3.28209     277.527     
1 1 1 33 16 28 o 7  24.1068 7.06053 15.9969     16.0607  3.69891     11.7886  10.3772    311.915     4.39744     311.915     
1 1 1 33 16 29 o 17 45.9151 7.69156 55.3838     20.4947  44.7546     14.4082  34.1108    344.149     3.01194     344.149     
1 1 1 33 16 30 o 10 20.7225 6.57351 10.0058     16.3052  -9.08568    11.96    7.2827     110.394     10.2379     290.394     
1 1 1 33 16 31 o 17 25.7071 7.06895 -24.3076    22.6339  23.5265     13.2005  16.6894    220.311     5.43738     220.311     
1 1 1 33 16 32 o 19 28.0489 7.71781 26.0725     17.6632  10.3122     13.7338  17.5388    11.9503     0.281133    191.95      
1 1 1 33 16 33 o 4  23.159  6.97082 18.9554     16.4837  -5.34959    12.8596  12.6253    45.2906     2.48679     45.2906     
1 1 1 33 16 34 o 17 26.2875 7.63387 23.3937     18.6932  7.06767     13.4834  15.5898    226.477     7.42161     226.477     
1 1 1 33 16 35 o 18 29.7718 7.95345 29.1702     18.3292  17.0208     14.1077  16.3061    166.573     6.55507     346.573     
1 1 1 33 16 36 o 19 21.0121 6.4623  -16.8607    16.9589  12.5901     12.4633  8.7035     261.395     5.19259     81.3948     
1 1 1 33 16 37 o 10 25.5759 7.47113 17.5982     18.0265  12.4077     13.0931  13.2897    313.762     3.59954     133.762     
1 1 1 33 16 38 o 4  28.7756 8.31417 23.1908     19.0056  23.6272     18.9871  15.974     54.2725     3.16775     234.272     
1 1 1 33 16 39 o 12 25.9716 7.76711 9.94788     18.3469  22.0117     17.2742  13.2504    61.6762     1.99224     241.676     
1 1 1 33 16 40 o 4  24.8865 7.56256 2.36882     18.0902  22.9754     17.4441  10.8022    85.439      1.4323      85.439      
1 1 1 33 16 41 o 6  19.8388 6.62646 2.53292     18.0496  -9.05392    16.4613  3.57661    236.773     2.76789     56.7728     
1 1 1 33 16 42 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 16 43 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 17 0  o 2  17.9862 7.21555 9.19846     10.0641  9.19846     10.0641  2.07184    180         0.368649    0.000238528 
1 1 1 33 17 1  f 0  47.3987 4.91783 51.598      11.6811  38.961      10.8932  16.7159    68.7744     0           0           
1 1 1 33 17 2  o 16 40.6395 5.65482 36.5355     11.1981  32.5995     11.0134  22.0971    99.4235     15.307      279.423     
1 1 1 33 17 3  f 0  33.699  6.15933 19.8452     10.6982  29.6537     10.569   32.0453    45.1526     0           0           
1 1 1 33 17 4  o 16 63.4546 4.05443 76.6108     12.8798  78.4924     12.62    57.7998    53.1004     20.865      53.1004     
1 1 1 33 17 5  o 14 20.7054 5.84679 -1.50754    9.88658  11.6646     9.64245  7.95002    158.771     0.168091    158.771     
1 1 1 33 17 6  o 13 19.9968 5.8271  9.00582     9.70407  -0.589838   9.80219  7.3236     252.376     6.63365     72.3757     
1 1 1 33 17 7  o 18 40.9457 5.6048  44.5624     11.358   26.4049     10.7606  40.7139    124.542     30.0705     124.542     
1 1 1 33 17 8  o 12 32.7498 6.3817  23.3526     11.0139  23.9796     10.613   25.0687    92.726      6.6429      92.726      
1 1 1 33 17 9  o 12 57.0776 4.45071 66.3214     12.7189  61.6062     12.3181  47.5552    45.0858     10.4444     45.0859     
1 1 1 33 17 10 o 1  33.9184 6.21078 36.6145     11.2994  14.0784     11.6391  7.9244     66.3414     33.2517     246.341     
1 1 1 33 17 11 o 18 27.9662 7.16971 19.6486     13.2236  14.9051     12.7573  12.5295    215.412     12.4708     35.4116     
1 1 1 33 17 12 o 17 28.3915 6.83707 25.5002     12.4622  9.38264     12.1612  13.0677    70.9425     12.1642     250.943     
1 1 1 33 17 13 o 15 27.5849 7.1131  19.0608     14.0507  14.6308     11.4763  17.3301    187.376     6.86913     187.376     
1 1 1 33 17 14 o 10 27.0412 6.85568 12.7062     12.7643  18.5163     11.2901  12.0865    314.74      11.4355     134.74      
1 1 1 33 17 15 o 6  19.7401 6.06544 5.47273     11.5201  -0.949727   10.9704  5.60512    196.648     9.39599     16.6484     
1 1 1 33 17 16 o 14 21.1791 6.27751 10.3112     11.7708  -0.311434   11.1814  7.73508    177.434     6.71292     357.434     
1 1 1 33 17 17 o 17 54.0731 5.48374 58.499      15.1207  62.5223     13.5682  58.7132    186.218     42.4693     186.218     
1 1 1 33 17 18 o 4  73.4832 4.58546 111.099     16.2901  102.366     17.0471  56.2513    116.864     2.66063     116.864     
1 1 1 33 17 19 o 17 56.2206 5.40389 63.533      14.8953  66.7542     14.7494  38.3614    95.3769     6.30646     275.377     
1 1 1 33 17 20 o 13 22.1715 6.44789 13.0432     12.4217  0.562841    11.2252  5.57509    106.768     1.68319     106.768     
1 1 1 33 17 21 o 13 22.155  6.45188 11.0879     12.1688  3.27094     11.1568  6.05291    200.362     16.0254     20.3616     
1 1 1 33 17 22 o 16 60.1402 5.52111 74.4806     17.7937  75.0003     14.2949  52.6676    229.557     17.009      229.557     
1 1 1 33 17 23 o 11 26.7004 7.09356 34.7158     17.6354  -7.24247    11.4846  17.0005    0.128756    8.0944      0.128756    
1 1 1 33 17 24 o 7  35.9152 8.05739 36.3511     18.504   28.3716     14.1046  22.6752    235.979     4.72087     55.979      
1 1 1 33 17 25 o 13 26.2835 7.4295  6.02516     17.8487  18.4155     13.5408  13.146     36.3617     8.22567     216.362     
1 1 1 33 17 26 o 2  29.2383 7.67393 30.3854     17.2511  10.2551     13.3438  20.075     253.069     12.3051     253.069     
1 1 1 33 17 27 o 14 27.3397 7.65527 23.432      17.2972  9.78486     14.0203  18.356     67.1027     3.54715     67.1028     
1 1 1 33 17 28 o 14 35.0431 8.02686 43.1222     18.6698  21.2637     13.9328  29.5126    207.113     13.8113     207.113     
1 1 1 33 17 29 o 17 24.4904 7.36354 22.7506     19.0456  -0.534943   12.4978  10.1268    231.185     11.3453     51.1847     
1 1 1 33 17 30 o 5  30.6652 8.06731 22.6606     20.5486  25.135      13.9564  20.1197    328.122     0.0859277   328.122     
1 1 1 33 17 31 o 19 24.1951 7.65764 -17.5209    32.2723  12.9287     13.9621  10.9271    345.687     8.31504     165.687     
1 1 1 33 17 32 o 8  36.3714 8.90824 59.2556     23.4119  21.9705     17.5035  24.5626    190.529     0.0532302   10.5296     
1 1 1 33 17 33 o 12 23.9928 7.16076 -7.30194    21.2385  17.6041     13.2478  10.4178    351.896     3.87392     351.896     
1 1 1 33 17 34 o 16 23.3291 7.35239 14.0217     21.2452  5.28801     13.1544  9.73196    272.932     7.47351     92.9318     
1 1 1 33 17 35 o 9  25.9431 7.41933 3.75088     20.0215  23.0247     13.8555  14.3557    132.249     0.692732    132.249     
1 1 1 33 17 36 o 9  21.0278 6.8086  11.4422     18.7329  -2.76824    12.7854  3.16429    305.993     0.0666602   125.993     
1 1 1 33 17 37 o 3  21.3781 6.82804 -1.71156    18.7202  8.83965     13.7232  6.93718    101.04      4.08867     281.04      
1 1 1 33 17 38 o 19 19.2817 6.38997 -2.66829    18.3309  -0.800559   12.7668  1.70997    58.7955     1.29862     238.795     
1 1 1 33 17 39 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 17 40 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 18 0  o 8  74.1806 4.52724 104.789     16.5297  104.789     16.5297  63.1755    360         12.1637     360         
1 1 1 33 18 1  o 3  53.3622 5.03515 62.1359     13.0226  53.5985     13.1356  37.6644    35.8884     4.05007     215.888     
1 1 1 33 18 2  o 9  47.8744 6.113   47.8581     15.1632  50.7891     12.9186  48.2515    260.245     29.6075     260.245     
1 1 1 33 18 3  o 12 36.1769 6.4463  31.9978     11.7671  26.5318     11.66    27.9271    264.561     6.16354     264.561     
1 1 1 33 18 4  o 11 50.9716 5.18884 50.6525     13.0757  55.7932     12.5911  51.2429    211.525     29.4304     211.525     
1 1 1 33 18 5  o 3  28.9206 7.28046 14.7504     12.1953  24.0794     14.4834  6.7324     245.69      27.0491     65.6904     
1 1 1 33 18 6  o 7  56.0251 5.68476 82.3735     15.5089  50.5301     14.7656  54.0824    331.554     26.2223     331.554     
1 1 1 33 18 7  o 6  21.8519 6.47065 4.03415     12.1908  8.61575     11.7663  8.87943    92.7217     6.70747     272.722     
1 1 1 33 18 8  o 17 44.1292 6.53009 47.6467     14.43    38.8765     13.5487  27.8205    278.37      8.86423     98.3699     
1 1 1 33 18 9  o 5  27.9251 6.74533 4.9229      12.8473  27.1046     12.4567  19.1057    269.099     6.3204      269.099     
1 1 1 33 18 10 o 14 24.0527 6.81219 -4.56397    13.307   20.4064     14.0321  11.8035    293.996     3.51049     293.996     
1 1 1 33 18 11 o 14 21.3196 6.34891 0.161996    11.9703  9.78978     11.6937  2.38914    48.3465     23.0878     228.347     
1 1 1 33 18 12 o 11 23.1203 6.80783 12.7359     13.9944  3.52733     12.3044  10.0901    284.558     2.92752     284.558     
1 1 1 33 18 13 o 4  22.7419 6.57348 8.22553     12.1368  8.56505     11.6306  11.5035    94.2146     1.5509      94.2146     
1 1 1 33 18 14 o 15 62.6951 5.51822 85.2692     15.5956  77.5579     17.9235  47.4509    204.142     1.09525     204.142     
1 1 1 33 18 15 o 16 56.2446 5.72968 63.3268     15.8208  69.4947     15.478   62.5455    228.824     44.8462     228.824     
1 1 1 33 18 16 o 4  64.6842 5.80963 76.7499     18.858   99.1583     17.087   65.3841    17.1105     35.1599     17.1105     
1 1 1 33 18 17 o 7  93.3434 4.64064 183.827     22.3173  161.693     20.825   92.2062    21.5282     43.6739     21.5282     
1 1 1 33 18 18 o 16 37.5036 8.01968 40.3057     19.7804  30.6056     13.1602  29.3636    339.262     6.5326      339.262     
1 1 1 33 18 19 o 6  60.1948 7.09354 77.7229     23.39    85.5474     16.2986  59.0856    289.772     29.9012     289.772     
1 1 1 33 18 20 o 17 23.3712 7.2867  13.0055     17.6988  -3.44509    16.0746  10.6687    254.262     8.27941     74.2615     
1 1 1 33 18 21 o 7  36.1183 7.90549 24.9868     19.8806  39.4433     14.4176  20.1773    232.846     11.0421     52.8461     
1 1 1 33 18 22 o 7  38.3135 8.25249 41.4647     20.2436  35.1923     14.6088  33.2081    60.9893     14.4514     60.9893     
1 1 1 33 18 23 o 12 39.8036 8.07751 44.6901     19.7801  37.0569     14.3359  26.0842    271.786     4.57685     91.7855     
1 1 1 33 18 24 o 19 41.9903 8.41702 59.8032     21.9225  35.4946     15.2309  30.25      355.101     0.782312    355.101     
1 1 1 33 18 25 o 4  25.4202 7.50111 10.5808     19.7973  14.1689     13.0756  14.1011    114.606     6.99092     114.606     
1 1 1 33 18 26 o 3  33.5513 8.24723 38.2902     19.6359  24.3648     14.2922  28.1442    342.655     16.4375     342.655     
1 1 1 33 18 27 o 16 29.8619 8.08823 16.2325     20.9891  28.855      15.4859  20.7239    111.444     12.1687     111.444     
1 1 1 33 18 28 o 7  26.1633 7.23476 -1.40769    18.6976  24.7509     13.6474  16.3688    164.851     2.07139     164.851     
1 1 1 33 18 29 o 16 32.0925 7.95905 23.2716     19.8239  32.943      14.299   23.9948    295.15      7.93544     295.15      
1 1 1 33 18 30 o 11 26.2256 7.51483 36.0029     19.1569  -2.29097    13.4767  6.62797    217.639     3.60438     217.639     
1 1 1 33 18 31 f 0  25.1518 7.32759 36.7273     19.32    -8.46894    12.8307  7.98799    96.1051     0           0           
1 1 1 33 18 32 o 15 31.9111 7.78997 16.8834     20.575   38.7889     14.8309  19.7481    5.219       1.69714     185.219     
1 1 1 33 18 33 o 14 23.7982 7.37111 20.0539     19.6118  6.39648     13.5223  4.27792    101.459     1.18531     101.459     
1 1 1 33 18 34 o 12 23.2268 7.41852 18.4956     22.8787  5.39723     13.233   8.97354    108.806     4.6192      288.806     
1 1 1 33 18 35 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 18 36 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 18 37 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 19 0  o 4  14.9687 7.11537 -2.04836    15.1652  -2.04836    15.1652  3.07393    1.2152e-05  6.94989     180         
1 1 1 33 19 1  o 13 58.0024 6.4877  81.2922     20.2158  66.7378     16.2491  50.3672    234.745     14.0316     234.745     
1 1 1 33 19 2  o 12 30.0755 7.49502 20.8673     14.4444  22.0624     13.6895  23.4606    134.205     8.9587      134.205     
1 1 1 33 19 3  o 10 28.0191 7.31146 14.4526     14.1461  20.7802     13.3179  18.3431    70.4465     0.281209    250.446     
1 1 1 33 19 4  o 16 70.8716 5.2095  103.804     18.5249  101.596     17.9393  79.2516    44.4021     52.6204     44.4021     
1 1 1 33 19 5  o 16 24.0817 7.16147 13.6515     16.3628  5.59647     12.8812  4.03576    69.8529     25.3247     249.853     
1 1 1 33 19 6  o 11 26.9486 7.27446 21.2742     14.3484  10.0279     13.4626  17.8089    350.638     0.920892    350.638     
1 1 1 33 19 7  o 9  26.15   7.52275 11.9365     15.0128  15.5238     15.9366  17.8205    288.228     4.63707     288.228     
1 1 1 33 19 8  o 7  72.8575 5.22592 114.527     19.0792  103.098     18.5324  67.1563    132.625     24.1112     132.625     
1 1 1 33 19 9  o 12 22.8352 7.11045 -0.439343   14.6122  10.426      17.0267  13.1205    237.634     2.31804     237.634     
1 1 1 33 19 10 o 1  30.1495 7.71934 18.3319     17.803   24.5122     13.3797  24.1615    80.7509     12.5164     80.7509     
1 1 1 33 19 11 o 3  29.1348 8.01625 4.15002     25.4701  26.1481     14.4525  20.8977    205.453     4.20645     205.453     
1 1 1 33 19 12 o 15 27.7636 7.71194 18.569      17.8958  16.6386     13.6528  19.8957    152.635     10.0503     152.635     
1 1 1 33 19 13 o 9  55.2664 7.13537 76.9748     21.429   64.4643     16.5635  42.7819    49.4789     3.25992     49.4789     
1 1 1 33 19 14 o 1  28.5558 8.03262 23.3806     20.3973  16.3974     14.1065  17.2903    57.9095     3.6353      237.909     
1 1 1 33 19 15 o 6  24.8522 7.5221  3.5488      20.013   14.4357     14.8313  15.3235    120.271     5.85513     120.271     
1 1 1 33 19 16 o 2  38.0084 8.20653 25.1111     21.8013  50.2059     16.7549  29.1522    221.572     4.79315     221.572     
1 1 1 33 19 17 o 4  31.7444 8.80363 23.3443     21.2568  32.874      20.1392  22.4928    259.761     2.78224     259.761     
1 1 1 33 19 18 o 4  27.7642 8.00168 29.6664     20.6538  9.23289     14.3369  13.661     134.962     10.3114     314.962     
1 1 1 33 19 19 o 4  76.3885 6.78867 130.877     27.5385  136.325     22.2519  65.825     121.235     16.9623     121.235     
1 1 1 33 19 20 o 13 22.1979 6.99543 -7.98067    19.6314  10.7419     14.2368  11.8845    153.165     1.42186     153.165     
1 1 1 33 19 21 o 3  35.2708 8.6043  54.27       21.7923  20.3776     16.3193  30.0881    26.2105     14.9501     26.2105     
1 1 1 33 19 22 o 10 24.3756 7.48287 5.66059     20.0016  14.2858     15.1195  11.3845    146.342     8.07617     326.342     
1 1 1 33 19 23 o 4  45.5725 8.7956  65.4949     23.4209  54.3581     18.0262  29.8872    63.2737     5.96064     243.274     
1 1 1 33 19 24 o 14 22.666  7.246   13.9645     20.1743  0.809855    14.4345  9.43273    184.707     2.02912     184.707     
1 1 1 33 19 25 f 0  20.2056 6.57754 -4.53031    17.9854  3.94636     13.4899  10.9528    176.613     0           0           
1 1 1 33 19 26 o 17 19.1777 6.31131 -21.9431    18.7378  6.01533     13.6875  4.86147    25.6788     10.2943     205.679     
1 1 1 33 19 27 o 1  25.4416 7.67239 22.739      19.4156  11.34       14.882   13.3878    271.473     2.27513     271.473     
1 1 1 33 19 28 f 0  24.0295 7.4469  17.0429     19.5939  9.85378     14.5727  13.22      88.3128     0           0           
1 1 1 33 19 29 o 4  25.8477 7.8035  15.8723     21.041   20.0338     15.797   12.7731    163.457     3.37553     343.457     
1 1 1 33 19 30 o 1  23.1259 7.59803 9.46943     29.464   8.1195      14.7535  8.5914     247.007     2.01817     67.0068     
1 1 1 33 19 31 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 19 32 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 19 33 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 20 0  o 14 26.9376 10.0335 25.7926     17.9981  25.7926     17.9981  17.5046    180         6.02934     9.00955e-06 
1 1 1 33 20 1  o 19 67.4391 9.33396 129.054     34.9977  119.887     25.0042  54.6951    30.3223     7.7173      30.3223     
1 1 1 33 20 2  o 12 36.6826 9.54265 39.7362     29.3644  45.0086     20.0682  29.3837    204.643     8.4067      204.643     
1 1 1 33 20 3  o 13 25.2839 8.42457 0.626439    42.4531  6.70076     16.7212  15.7672    310.21      3.84899     310.21      
1 1 1 33 20 4  o 10 28.6436 8.77981 41.8629     28.1507  3.67554     17.7252  18.1641    337.107     10.5759     337.107     
1 1 1 33 20 5  o 12 31.8903 8.39947 15.6708     27.78    33.7716     15.4121  18.7426    220.226     7.23484     40.2264     
1 1 1 33 20 6  o 17 30.0739 8.47883 25.1129     27.1701  23.3266     14.2689  14.3002    200.864     13.5816     20.8638     
1 1 1 33 20 7  o 11 19.3078 6.38616 4.25785     17.4247  -10.9391    12.4489  8.33135    262.111     2.47939     82.1112     
1 1 1 33 20 8  o 11 31.6746 9.12618 44.3984     27.4184  19.482      17.8498  22.3764    194.21      2.39851     194.21      
1 1 1 33 20 9  o 4  27.8403 8.02571 23.2259     21.7936  16.518      13.8594  19.8716    128.173     9.65313     128.173     
1 1 1 33 20 10 o 13 25.5231 8.87895 -35.6921    110.334  6.30347     14.2993  15.4244    342.278     1.48271     342.278     
1 1 1 33 20 11 o 4  23.8469 7.27772 -2.79095    20.2785  15.6651     14.3382  4.24434    344.042     24.4777     164.042     
1 1 1 33 20 12 o 11 27.3633 7.82883 7.38577     21.3742  24.7922     15.331   19.3528    24.4006     7.19546     24.4006     
1 1 1 33 20 13 o 2  43.5476 8.98994 62.4289     23.3918  49.4912     18.3553  42.4024    237.113     25.5781     237.113     
1 1 1 33 20 14 o 18 31.885  8.42772 38.6819     20.5477  22.2161     15.6781  25.3319    261.474     11.2712     261.474     
1 1 1 33 20 15 o 4  33.7262 8.71119 37.761      22.2624  32.6351     16.5771  20.5465    152.946     5.7976      332.946     
1 1 1 33 20 16 o 10 21.6223 7.13791 3.26841     19.7599  -2.33476    18.3234  5.76845    122.504     1.56024     122.504     
1 1 1 33 20 17 o 11 22.3577 7.10349 -0.337366   20.2906  10.0273     14.3745  9.32555    316.846     8.12764     136.846     
1 1 1 33 20 18 o 4  41.5158 8.48029 39.3824     24.0251  64.6855     18.174   24.1922    349.901     11.5688     169.901     
1 1 1 33 20 19 f 0  32.2559 8.47148 29.5565     22.3179  35.6869     16.3711  13.5107    302.029     0           0           
1 1 1 33 20 20 o 7  32.1401 8.57348 36.0732     22.2501  31.6456     16.2043  23.8104    58.2356     8.75408     58.2356     
1 1 1 33 20 21 o 14 23.4408 7.3606  9.58963     20.8139  11.6728     14.5184  11.0818    246.338     1.45176     66.3375     
1 1 1 33 20 22 o 4  19.6272 6.47635 -10.2246    19.1493  4.22322     13.7079  3.04481    253.238     16.5308     73.2376     
1 1 1 33 20 23 o 10 21.7545 7.02434 4.33679     20.135   7.30004     14.5016  5.63967    170.073     0.020624    170.072     
1 1 1 33 20 24 o 14 20.6444 6.75211 -14.0691    20.9133  9.73644     14.974   5.75198    354.789     2.51971     174.789     
1 1 1 33 20 25 o 10 20.9206 6.88933 13.7113     20.2512  -4.56683    13.8167  1.11251    153.831     0.159212    333.831     
1 1 1 33 20 26 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 20 27 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 20 28 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 21 0  o 10 18.1058 8.85949 -1.8172     27.4759  -1.8172     27.4759  6.32592    360         4.96649     180         
1 1 1 33 21 1  o 2  22.7719 7.81843 -26.3671    28.5205  10.2454     28.188   7.90427    290.577     12.9054     110.577     
1 1 1 33 21 2  o 19 22.8871 7.78563 -38.1149    27.2486  20.0433     27.0253  10.7012    33.2763     4.85025     213.276     
1 1 1 33 21 3  o 9  30.5341 9.94161 57.8032     39.2257  27.2488     30.3834  21.0234    196.068     5.90837     196.068     
1 1 1 33 21 4  o 2  26.1892 9.13862 9.26607     38.4835  8.7545      48.9765  10.5863    236.134     4.63216     236.134     
1 1 1 33 21 5  f 0  27.0259 9.34708 29.267      38.6119  0.000186841 49.1683  7.53223    48.2714     0           0           
1 1 1 33 21 6  o 8  29.6479 9.98461 49.4144     37.9537  29.0523     46.9461  19.4223    5.74891     5.4927      5.74892     
1 1 1 33 21 7  o 7  27.841  9.56792 142.376     131.549  18.578      21.2888  12.1258    324.428     5.90681     324.428     
1 1 1 33 21 8  o 10 31.1966 9.10442 -6.35821    37.5203  55.0533     23.9674  15.2844    351.41      12.3854     171.41      
1 1 1 33 21 9  o 11 32.4505 10.1496 60.8244     40.4856  44.3165     27.032   23.3679    94.3538     9.29337     94.3538     
1 1 1 33 21 10 o 4  25.3182 8.40187 8.19334     35.6568  16.7153     21.8865  13.2815    165.538     2.69561     345.538     
1 1 1 33 21 11 o 5  24.7097 7.86629 -12.8234    38.0601  18.8305     15.5135  10.385     205.823     3.48019     205.823     
1 1 1 33 21 12 o 2  24.8373 8.27114 7.62129     37.8814  14.341      20.0223  12.7412    199.136     0.243236    19.1363     
1 1 1 33 21 13 o 12 20.8161 6.7879  -12.1401    21.6231  9.12479     14.3555  2.30244    93.776      0.152275    93.776      
1 1 1 33 21 14 o 8  21.3899 6.9529  0.0841011   20.7114  7.51617     14.5306  6.38282    27.5202     0.170923    207.52      
1 1 1 33 21 15 o 16 26.0955 8.02099 33.4528     22.5132  8.93798     16.2392  14.2267    352.959     0.51642     172.959     
1 1 1 33 21 16 o 10 24.6486 7.954   24.0176     22.5018  5.23299     21.5242  11.2402    142.016     1.20883     142.016     
1 1 1 33 21 17 o 4  17.1921 5.89936 -19.9002    19.8654  -5.823      12.8095  2.13607    128.247     9.72618     308.247     
1 1 1 33 21 18 o 1  22.8534 7.37099 22.0691     21.9022  1.20333     14.5149  9.08535    256.895     4.37643     76.8948     
1 1 1 33 21 19 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 21 20 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 21 21 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 21 22 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 0  x 6  ?       ?       ?           ?        ?           ?        8.4171     180         0           0           
1 1 1 33 22 1  x 15 ?       ?       ?           ?        ?           ?        15.6634    85.708      0           0           
1 1 1 33 22 2  o 5  25.0447 12.4308 13.2479     42.218   0           0        1.7537     2.18126     0.212422    182.181     
1 1 1 33 22 3  o 11 21.2137 10.6616 -25.5002    35.6744  0           0        1.55903    22.83       1.33511     202.83      
1 1 1 33 22 4  o 10 27.3417 9.4935  49.7309     41.21    21.991      52.6745  8.22294    200.998     3.26742     200.998     
1 1 1 33 22 5  o 5  27.8215 9.67395 57.0931     43.9686  30.2429     53.3965  4.48802    328.03      2.0102      328.03      
1 1 1 33 22 6  x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 7  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 8  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 9  x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 10 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 11 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 12 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 13 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 33 22 14 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 0  0  o 15 19.4315 7.66199 9.1371      11.1007  9.1371      11.1007  40.0766    180         88.9197     180         
1 1 1 34 0  1  o 9  9.83892 4.75658 -4.66074    7.37917  -4.66074    7.37917  10.8073    240         22.7512     240         
1 1 1 34 0  2  o 17 99.6927 2.72906 177.18      13.5879  177.18      13.5879  78.2409    120         7.49441     120         
1 1 1 34 0  3  o 3  136.213 2.6293  329.991     17.9179  329.991     17.9179  94.643     3.58729e-06 14.2859     180         
1 1 1 34 0  4  o 15 42.2991 4.6061  34.0084     9.07602  34.0084     9.07602  11.8636    60          7.02042     240         
1 1 1 34 0  5  o 6  25.2779 7.09626 15.7465     8.67296  15.7465     8.67296  9.51042    300         33.2003     300         
1 1 1 34 0  6  o 5  10.5614 5.05722 -3.97913    7.93469  -3.97913    7.93469  78.9258    360         166.565     360         
1 1 1 34 0  7  o 9  202.781 2.7661  730.707     28.0861  730.707     28.0861  128.207    60          46.3112     240         
1 1 1 34 0  8  o 11 128.749 2.62091 294.917     16.8789  294.917     16.8789  71.3082    300         49.5089     120         
1 1 1 34 0  9  o 19 90.2539 2.83506 145.462     12.7652  145.462     12.7652  54.615     180         25.3758     8.61071e-06 
1 1 1 34 0  10 o 17 188.479 2.87302 631.599     27.1086  631.599     27.1086  143.125    60          5.27273     59.9999     
1 1 1 34 0  11 o 11 236.143 2.93278 991.102     34.6826  991.102     34.6826  174.224    120         3.37875     300         
1 1 1 34 0  12 o 6  294.097 3.24062 1537.82     47.7355  1537.82     47.7355  270.299    180         102.702     180         
1 1 1 34 0  13 o 10 99.7195 2.84198 177.424     14.1499  177.424     14.1499  86.2621    60          24.182      60          
1 1 1 34 0  14 o 6  206.059 3.05813 755.252     31.5484  755.252     31.5484  165.712    120         25.0541     120         
1 1 1 34 0  15 o 6  27.245  7.11984 17.7744     9.00733  17.7744     9.00733  0.49746    180         3.30521     180         
1 1 1 34 0  16 o 5  107.322 3.12073 205.693     16.7197  205.693     16.7197  83.868     240         8.43388     240         
1 1 1 34 0  17 o 10 7.87692 4.01681 -14.5926    8.01061  -14.5926    8.01061  31.7519    300         65.9721     300         
1 1 1 34 0  18 o 17 112.515 3.10523 226.004     17.4484  226.004     17.4484  48.013     180         70.6707     360         
1 1 1 34 0  19 o 5  256.87  3.68252 1175.7      47.3604  1175.7      47.3604  234.011    240         87.8426     240         
1 1 1 34 0  20 o 11 149.989 3.05874 400.86      22.948   400.86      22.948   111.201    120         0.651283    120         
1 1 1 34 0  21 o 15 37.564  5.62486 28.3287     9.31357  28.3287     9.31357  0.842415   180         49.0395     360         
1 1 1 34 0  22 o 9  135.968 2.81993 329.371     19.1774  329.371     19.1774  151.715    240         102.88      240         
1 1 1 34 0  23 o 12 30.19   7.19253 21.0843     9.72325  21.0843     9.72325  1.09207    120         29.3557     120         
1 1 1 34 0  24 o 10 85.4594 3.21642 131.03      13.6853  131.03      13.6853  65.0259    180         4.35056     180         
1 1 1 34 0  25 o 13 38.5478 5.60216 29.6962     9.56141  29.6962     9.56141  2.84183    60          46.8944     240         
1 1 1 34 0  26 o 8  88.7867 3.12371 141.291     13.82    141.291     13.82    100.092    300         78.2501     300         
1 1 1 34 0  27 f 0  79.6085 3.13738 113.819     12.427   113.819     12.427   14.2517    1.43294e-05 0           0           
1 1 1 34 0  28 o 14 37.9758 6.89588 30.5102     11.3424  30.5102     11.3424  12.12      240         0.324425    240         
1 1 1 34 0  29 o 16 138.051 2.91268 339.961     20.1102  339.961     20.1102  89.3682    300         22.8924     120         
1 1 1 34 0  30 o 1  31.0468 7.12037 22.049      9.79501  22.049      9.79501  7.79605    180         3.03407     8.65205e-06 
1 1 1 34 0  31 o 17 225.604 3.11424 907.497     35.1791  907.497     35.1791  215.48     60          102.549     60          
1 1 1 34 0  32 o 1  133.387 2.96803 317.727     19.7956  317.727     19.7956  115.011    300         36.187      300         
1 1 1 34 0  33 o 19 24.5271 7.24405 15.3513     8.90949  15.3513     8.90949  1.66284    360         27.4599     180         
1 1 1 34 0  34 f 0  130.881 2.77928 305.799     18.1921  305.799     18.1921  101.582    60          0           0           
1 1 1 34 0  35 o 16 67.6616 3.28606 82.8285     11.0197  82.8285     11.0197  66.2329    120         34.7186     120         
1 1 1 34 0  36 o 14 13.829  6.15027 1.95497     8.94313  1.95497     8.94313  5.591      8.65153e-06 17.6329     8.65153e-06 
1 1 1 34 0  37 o 1  193.392 2.87655 667.615     27.8507  667.615     27.8507  155.931    60          33.4968     60          
1 1 1 34 0  38 o 12 14.5534 6.32926 3.32588     8.95223  3.32588     8.95223  10.4974    120         33.9167     120         
1 1 1 34 0  39 o 13 14.3182 6.28811 2.82774     9.04668  2.82774     9.04668  6.12614    8.65145e-06 21.3264     8.65145e-06 
1 1 1 34 0  40 o 13 96.7016 3.24121 168.292     15.6266  168.292     15.6266  104.526    240         70.7477     240         
1 1 1 34 0  41 o 17 12.082  5.61793 -1.17078    8.61526  -1.17078    8.61526  0.875499   120         2.59202     120         
1 1 1 34 0  42 o 5  39.7393 5.37384 31.4627     9.56823  31.4627     9.56823  28.947     3.44066e-06 1.91709     3.44066e-06 
1 1 1 34 0  43 o 15 53.443  4.05913 53.0903     10.5549  53.0903     10.5549  39.233     240         2.56163     240         
1 1 1 34 0  44 o 3  61.9258 3.79502 70.3945     11.5653  70.3945     11.5653  55.9012    120         24.0586     120         
1 1 1 34 0  45 o 15 84.1538 3.27669 127.976     13.7223  127.976     13.7223  70.9034    180         22.8537     180         
1 1 1 34 0  46 o 1  24.2535 7.56214 15.6876     9.64196  15.6876     9.64196  6.27748    240         19.1779     60          
1 1 1 34 0  47 f 0  60.6314 4.02065 67.9637     11.9555  67.9637     11.9555  37.7115    300         0           0           
1 1 1 34 0  48 o 16 53.4569 4.62288 54.0453     11.8898  54.0453     11.8898  42.6024    180         10.2242     180         
1 1 1 34 0  49 o 16 53.7314 5.16831 55.4928     13.1894  55.4928     13.1894  50.718     60          26.282      60          
1 1 1 34 0  50 o 16 31.909  8.16161 25.3283     11.9737  25.3283     11.9737  7.88392    120         28.7144     300         
1 1 1 34 0  51 o 18 73.3391 3.64006 98.5282     13.2243  98.5282     13.2243  55.8629    180         9.69662     180         
1 1 1 34 0  52 o 7  61.0224 3.97633 69.2275     11.9098  69.2275     11.9098  49.7694    240         14.886      240         
1 1 1 34 0  53 o 12 28.0655 7.77584 20.4504     10.464   20.4504     10.464   13.7228    300         10.8688     120         
1 1 1 34 0  54 o 15 18.7637 7.27977 9.87444     9.83816  9.87444     9.83816  5.51285    8.10036e-06 6.20886     180         
1 1 1 34 0  55 o 6  30.7216 8.18926 24.4109     11.8     24.4109     11.8     23.6174    240         7.75529     240         
1 1 1 34 0  56 o 19 12.936  6.0329  -0.836368   10.0498  -0.836368   10.0498  2.9814     120         15.0971     120         
1 1 1 34 0  57 o 7  12.6664 5.93086 -1.20321    9.86908  -1.20321    9.86908  4.86985    180         19.5671     180         
1 1 1 34 0  58 o 1  23.9735 8.35608 17.051      12.0023  17.051      12.0023  2.87043    59.9999     0.778214    59.9999     
1 1 1 34 0  59 o 7  22.861  7.94162 15.3334     10.8265  15.3334     10.8265  5.44017    120         0.596816    120         
1 1 1 34 0  60 o 14 52.1824 5.03124 53.1345     12.4654  53.1345     12.4654  40.9141    360         11.2105     360         
1 1 1 34 0  61 o 11 17.9543 7.5433  8.17455     11.8362  8.17455     11.8362  4.06693    240         3.63227     60          
1 1 1 34 0  62 o 10 60.2209 5.30691 70.7414     15.3451  70.7414     15.3451  48.9879    120         17.026      120         
1 1 1 34 0  63 o 7  12.7443 6.21534 -7.43266    13.2497  -7.43266    13.2497  0.370402   180         4.3939      180         
1 1 1 34 0  64 o 4  59.413  5.86615 70.8188     16.4917  70.8188     16.4917  45.9841    60          12.6587     60          
1 1 1 34 0  65 o 1  20.1398 8.70958 11.2574     16.7353  11.2574     16.7353  4.55442    120         1.13018     300         
1 1 1 34 0  66 o 9  16.4105 7.9009  -3.42467    19.9138  -3.42467    19.9138  0.0213901  360         0.102829    180         
1 1 1 34 0  67 o 7  24.7713 9.80159 21.9867     18.2433  21.9867     18.2433  7.03069    60          0.895303    60          
1 1 1 34 0  68 o 2  29.4468 10.2867 30.2904     18.2061  30.2904     18.2061  14.3046    300         4.70182     300         
1 1 1 34 0  69 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 1  0  o 16 31.4071 6.22274 21.2488     8.47578  21.2488     8.47578  19.2419    180         79.6585     180         
1 1 1 34 1  1  o 4  161.233 2.70403 460.53      22.379   464.237     21.3004  116.636    17.976      3.7125      197.976     
1 1 1 34 1  2  o 19 121.035 2.73236 268.221     16.0886  253.582     16.9684  67.6847    164.978     40.9588     344.978     
1 1 1 34 1  3  o 15 120.258 2.66233 244.454     15.9841  270.788     16.0365  74.7056    213.183     25.3276     33.1829     
1 1 1 34 1  4  f 0  133.806 2.76096 322.798     18.4963  314.807     18.4897  96.557     145.71      0           0           
1 1 1 34 1  5  o 14 98.1816 2.90632 166.242     14.2329  177.597     14.2936  69.3853    227.804     0.61623     47.804      
1 1 1 34 1  6  o 12 46.1059 4.86307 36.6483     11.7737  41.3061     9.73152  18.8024    279.479     3.66622     99.4786     
1 1 1 34 1  7  o 4  63.2559 3.48862 65.6139     10.96    78.2628     10.9054  45.5078    6.04479     16.539      6.0448      
1 1 1 34 1  8  o 9  18.8073 5.40462 -1.37884    8.14319  5.44375     8.19657  18.7246    203.811     48.0218     203.811     
1 1 1 34 1  9  o 7  182.551 2.83091 590.244     25.8749  596.11      25.9213  136.366    294.628     3.83303     294.628     
1 1 1 34 1  10 o 5  167.744 2.94294 505.44      24.7191  497.056     24.7384  138.743    275.576     31.6666     275.576     
1 1 1 34 1  11 o 5  165.043 2.95684 490.801     24.4353  480.152     24.4351  115.91     338.089     10.5867     158.089     
1 1 1 34 1  12 o 9  263.163 3.39594 1254.86     44.814   1216.76     44.7515  262.647    21.6517     136.729     21.6517     
1 1 1 34 1  13 o 13 105.931 3.13464 199.969     16.5594  200.818     16.6484  80.1469    100.132     9.10147     100.132     
1 1 1 34 1  14 o 10 177.718 3.10251 553.758     27.6333  572.836     27.6007  165.881    296.715     72.0729     296.715     
1 1 1 34 1  15 o 17 165.308 3.0633  486.186     25.3834  488.883     25.3271  149.085    310.909     57.2276     310.909     
1 1 1 34 1  16 o 13 84.4237 3.35509 139.831     14.1591  116.026     14.03    40.6391    318.224     38.3896     138.224     
1 1 1 34 1  17 o 15 82.7434 3.16248 116.939     13.0855  128.226     13.0187  37.0857    359.517     43.0139     179.517     
1 1 1 34 1  18 o 7  146.774 2.8443  395.534     21.476   373.139     20.3311  110.11     4.39365     6.79355     4.39364     
1 1 1 34 1  19 o 16 72.1313 3.4924  89.966      11.7963  97.0389     13.2973  36.4911    145.226     26.7208     325.226     
1 1 1 34 1  20 o 16 107.257 2.90534 195.722     15.8759  215.483     15.2322  88.0563    284.288     24.2762     284.288     
1 1 1 34 1  21 o 17 147.26  2.71172 386.841     20.4827  386.757     19.4949  115.536    69.8256     17.7568     69.8256     
1 1 1 34 1  22 o 16 182.265 2.85778 597.087     26.7165  588.279     25.483   152.809    70.2348     40.2415     70.2348     
1 1 1 34 1  23 o 11 47.8357 4.17024 46.3571     9.26986  37.377      10.0599  23.0127    248.064     6.80471     248.064     
1 1 1 34 1  24 o 9  59.4859 3.54756 60.2005     10.7365  67.5801     10.1374  42.4699    16.2791     11.4952     16.2791     
1 1 1 34 1  25 o 2  80.6033 3.17688 119.933     12.9694  113.198     12.5942  45.7801    254.477     21.528      74.4771     
1 1 1 34 1  26 o 2  47.3273 4.67562 50.8657     10.3601  32.6128     10.6614  29.5496    115.794     8.03943     115.794     
1 1 1 34 1  27 o 8  157.254 3.12546 456.713     24.8151  429.086     24.3907  137.683    118.014     47.9724     118.014     
1 1 1 34 1  28 o 11 93.6636 3.61352 144.085     16.5585  172.583     17.1784  81.3453    117.32      30.6903     117.32      
1 1 1 34 1  29 f 0  49.9519 4.39442 44.5626     10.8627  47.0346     10.6468  50.748     54.9315     0           0           
1 1 1 34 1  30 o 19 16.1997 5.06221 -2.77714    8.14826  -1.60421    8.01796  15.5249    120.491     46.9579     120.491     
1 1 1 34 1  31 o 3  96.4202 2.97147 169.146     14.3439  164.458     14.3019  82.5402    213.396     28.0282     213.396     
1 1 1 34 1  32 o 3  115.85  2.72844 233.28      15.8412  247.474     15.7831  85.2435    110.041     4.19519     110.041     
1 1 1 34 1  33 o 15 51.9226 4.02834 43.1735     9.93626  55.9522     10.6099  39.3525    286.741     9.76401     286.741     
1 1 1 34 1  34 o 6  47.0089 4.29368 47.4643     9.69905  34.5992     9.7953   39.4289    303.523     23.2514     303.523     
1 1 1 34 1  35 o 12 19.8096 5.55388 2.35834     8.23756  6.00123     8.28969  0.626783   84.6345     8.54445     264.634     
1 1 1 34 1  36 o 17 143.172 2.85061 368.737     21.3937  367.545     19.4244  103.023    256.907     0.911451    256.907     
1 1 1 34 1  37 o 10 192.346 2.84512 658.063     28.0336  670.683     26.787   142.814    227.562     9.6317      227.562     
1 1 1 34 1  38 o 13 120.412 2.94272 244.249     18.4997  278.393     16.7329  100.77     96.6612     30.5843     96.6612     
1 1 1 34 1  39 o 11 36.6777 6.11191 28.2322     11.0876  24.4948     11.0318  18.3917    176.887     9.52205     356.887     
1 1 1 34 1  40 o 15 45.7745 5.50608 45.8419     11.285   34.6501     12.7181  33.7144    112.845     8.39828     112.845     
1 1 1 34 1  41 o 17 97.9848 3.30365 179.562     16.6195  168.648     15.7354  76.1252    310.479     14.5733     310.479     
1 1 1 34 1  42 o 9  54.1267 4.91926 42.543      12.1159  69.2772     13.5942  43.9704    57.7774     16.1693     57.7774     
1 1 1 34 1  43 o 8  21.883  6.06948 3.53368     8.95347  8.85861     10.5371  4.35358    312.549     10.3066     132.549     
1 1 1 34 1  44 o 11 67.5155 3.9136  85.0096     12.1485  82.7588     13.9896  57.6972    294.592     23.4846     294.592     
1 1 1 34 1  45 o 15 79.7386 3.47269 121.224     13.4313  110.99      14.121   46.3631    111.139     18.2612     291.139     
1 1 1 34 1  46 o 1  38.6221 5.9316  24.9116     10.0011  34.4834     12.3627  15.7994    88.0451     19.3304     268.045     
1 1 1 34 1  47 f 0  50.1601 4.81493 54.2457     11.3821  41.7795     11.8968  39.2467    259.122     0           0           
1 1 1 34 1  48 o 10 61.774  4.08852 77.17       11.9354  65.3462     12.8774  39.9672    346.771     4.61453     166.771     
1 1 1 34 1  49 o 17 84.7618 3.5265  140.831     14.5553  123.858     15.167   66.5628    244.459     16.2501     244.459     
1 1 1 34 1  50 o 16 91.4577 3.61089 161.102     16.2831  148.141     16.6409  73.4272    344.788     20.8168     344.788     
1 1 1 34 1  51 o 14 62.7154 4.07826 65.6431     12.3679  82.815      12.8845  43.5488    16.0358     1.88045     16.0358     
1 1 1 34 1  52 o 11 48.2374 4.94272 46.2708     11.1605  44.4695     11.9904  40.6938    201.649     18.7755     201.649     
1 1 1 34 1  53 o 16 35.3375 6.1484  24.7057     10.5834  27.3928     11.0504  27.326     243.357     16.4703     243.357     
1 1 1 34 1  54 o 11 25.8382 6.41399 16.8563     10.3539  8.83846     10.7189  12.0159    266.734     4.44825     86.7342     
1 1 1 34 1  55 o 2  52.4399 5.02226 63.6401     12.0465  45.2098     13.009   39.0283    94.9342     9.27712     94.9342     
1 1 1 34 1  56 o 11 36.2881 6.4597  26.4018     11.5864  29.9657     11.9093  25.1443    176.204     7.30182     176.204     
1 1 1 34 1  57 o 17 29.5043 6.7158  22.4493     11.4528  14.7069     11.448   13.9663    295.404     5.78103     115.404     
1 1 1 34 1  58 o 10 23.0982 6.44994 9.16969     10.9272  8.17026     11.1352  5.20065    38.6607     14.5562     218.661     
1 1 1 34 1  59 o 10 19.8771 5.91911 -7.0455     10.6113  9.69701     10.8606  0.516479   307.36      23.0584     307.36      
1 1 1 34 1  60 o 14 30.4477 6.8766  16.2528     12.0039  23.8985     11.9972  10.5465    160.262     16.459      340.262     
1 1 1 34 1  61 o 13 72.7974 5.09069 96.9897     18.9333  113.366     17.3565  50.8082    44.7718     5.12047     44.7719     
1 1 1 34 1  62 o 15 41.301  8.11919 40.2416     17.8039  41.9354     17.051   25.0874    255.222     1.48732     75.2215     
1 1 1 34 1  63 o 6  21.0525 6.51476 10.1008     13.3008  -11.9028    14.8958  4.32335    256.263     13.9549     76.2633     
1 1 1 34 1  64 o 6  20.793  6.52258 -12.6803    15.8454  8.92176     13.3079  5.99258    212.318     5.12248     32.3181     
1 1 1 34 1  65 o 1  22.3581 7.01715 -6.05266    16.2249  11.7179     16.1277  5.75145    225.587     1.25131     45.5871     
1 1 1 34 1  66 o 19 25.2161 7.93089 13.4781     21.3484  7.49792     18.8665  7.56714    203.904     0.0727107   23.904      
1 1 1 34 1  67 o 16 25.5367 7.72611 2.73176     17.3222  22.483      18.7031  7.90357    321.689     1.61833     141.689     
1 1 1 34 1  68 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 2  0  o 10 135.679 2.95064 327.975     20.0197  327.975     20.0197  134.696    180         66.064      180         
1 1 1 34 2  1  o 10 112.827 2.96657 228.87      16.7336  225.33      16.7543  108.156    234.501     56.5189     234.501     
1 1 1 34 2  2  o 19 157.99  2.97547 440.717     23.5937  449.341     23.4781  122.464    37.7345     12.4517     37.7345     
1 1 1 34 2  3  o 10 69.6971 3.56343 100.671     12.2909  74.6915     12.2169  19.8684    341.629     58.5667     161.629     
1 1 1 34 2  4  o 16 176.977 3.28251 540.085     29.9315  578.127     28.1459  140.032    359.209     18.7978     359.209     
1 1 1 34 2  5  o 11 268.837 3.69707 1311.38     52.6187  1272.29     46.9093  199.47     22.1472     1.36298     202.146     
1 1 1 34 2  6  o 10 134.885 3.36912 332.906     24.217   317.44      21.2199  102.905    260.212     8.76774     260.212     
1 1 1 34 2  7  o 11 100.468 3.39198 174.707     16.327   186.578     17.7339  70.534     289.017     2.99446     109.017     
1 1 1 34 2  8  o 5  98.7296 3.30649 174.473     16.3961  174.216     16.23    75.4162    34.4516     10.2372     34.4516     
1 1 1 34 2  9  o 17 69.0921 3.87217 80.1448     13.459   91.9719     13.047   34.7494    157.784     26.0667     337.784     
1 1 1 34 2  10 o 11 217.213 3.48691 843.555     37.9267  842.431     37.9862  179.163    117.36      36.8759     117.36      
1 1 1 34 2  11 o 3  145.09  3.23672 365         23.5082  387.386     23.485   126.614    170.306     41.841      170.306     
1 1 1 34 2  12 o 2  203.436 3.22217 744.329     32.8492  733.278     32.8497  199.917    177.633     100.674     177.633     
1 1 1 34 2  13 o 10 83.7032 3.36497 122.523     13.198   128.661     14.8977  43.7933    250.723     31.232      70.7227     
1 1 1 34 2  14 o 10 173.069 2.84527 538.725     24.0647  529.264     25.2632  153.17     148.423     52.77       148.423     
1 1 1 34 2  15 o 2  67.094  3.29864 74.8905     10.6821  86.9692     11.3546  31.8465    102.025     28.7306     282.025     
1 1 1 34 2  16 o 18 69.2206 3.25491 81.4794     10.8893  90.6158     11.5664  53.3662    187.583     16.3382     187.583     
1 1 1 34 2  17 o 1  63.696  3.40357 66.6277     10.4777  79.6107     11.0675  31.5267    178.046     23.4158     358.046     
1 1 1 34 2  18 o 4  201.537 2.98962 730.632     30.9767  719.642     29.4026  182.814    122.525     70.0952     122.525     
1 1 1 34 2  19 o 10 41.8973 4.69402 28.6868     8.97994  36.398      10.0763  12.6544    17.1965     22.6115     197.197     
1 1 1 34 2  20 o 5  25.4763 5.88782 12.2261     8.1101   10.6018     9.26946  0.304336   23.6434     2.20936     23.6434     
1 1 1 34 2  21 o 16 69.7878 3.34493 89.8361     11.7312  85.3204     11.5258  56.0967    246.036     20.364      246.036     
1 1 1 34 2  22 o 12 51.4682 4.68062 46.0563     11.8281  51.289      11.7162  31.2554    309.976     1.16217     129.976     
1 1 1 34 2  23 o 19 42.6209 5.36646 31.5178     10.2125  36.5781     11.8861  16.9509    319.483     18.4223     139.483     
1 1 1 34 2  24 o 3  224.543 3.24965 896.049     35.5502  909.795     37.57    197.469    243.834     65.999      243.834     
1 1 1 34 2  25 o 9  62.7233 3.92529 79.1847     11.8894  63.9361     12.3458  31.0317    359.186     25.5072     179.186     
1 1 1 34 2  26 o 13 74.2197 3.82223 102.141     13.7361  97.2139     14.4638  59.433     192.59      15.0447     192.59      
1 1 1 34 2  27 o 2  102.009 2.97266 178.957     14.7008  194.274     15.632   77.37      279.493     7.72596     279.493     
1 1 1 34 2  28 o 4  54.7055 4.1945  46.9835     10.628   63.069      11.9602  24.2854    78.588      27.8406     258.588     
1 1 1 34 2  29 o 19 95.1631 2.98209 168.674     13.5628  156.553     14.7231  74.0263    236.75      11.723      236.75      
1 1 1 34 2  30 o 10 128.293 2.80215 297.28      17.9504  292.593     18.0364  102.291    304.617     19.2329     304.617     
1 1 1 34 2  31 o 5  180.786 2.8533  576.411     25.792   594.962     25.9064  143.938    44.5528     25.5471     44.5528     
1 1 1 34 2  32 o 15 21.0083 5.68654 0.985842    8.49207  9.63252     8.81462  1.51302    76.0224     5.53605     256.022     
1 1 1 34 2  33 o 17 63.6547 3.57785 69.2392     11.203   78.158      11.4132  38.7912    167.432     11.5318     347.432     
1 1 1 34 2  34 o 2  41.5792 4.96531 26.5133     9.62719  39.2827     10.2003  13.2722    297.044     29.6431     117.044     
1 1 1 34 2  35 o 12 47.2291 4.88258 57.4571     10.2407  28.5223     10.8964  19.9608    261.093     24.641      81.0934     
1 1 1 34 2  36 o 3  31.3159 5.85958 12.7196     9.23677  25.6194     9.97104  15.6543    88.1256     4.10418     268.126     
1 1 1 34 2  37 o 8  124.118 3.03495 280.104     17.7623  275.561     19.854   111.083    37.6928     45.3619     37.6928     
1 1 1 34 2  38 o 7  39.7345 5.48671 33.2508     10.6262  27.681      10.4341  21.2056    306.465     9.42742     126.465     
1 1 1 34 2  39 o 7  85.9814 3.34693 133.6       13.2298  134.829     15.418   53.1689    75.1272     15.108      255.127     
1 1 1 34 2  40 o 1  22.3509 6.01431 12.343      10.0726  0.366247    9.48923  3.49119    299.914     2.04612     119.914     
1 1 1 34 2  41 o 10 54.6278 4.60914 62.5996     12.7266  49.436      11.9403  37.2918    141.515     0.300692    141.515     
1 1 1 34 2  42 o 15 73.7421 3.82352 89.0866     14.1084  111.117     13.7577  58.1323    289.388     14.0459     289.388     
1 1 1 34 2  43 f 0  19.1078 5.82617 -6.03578    9.83863  4.99946     10.9539  13.9048    353.539     0           0           
1 1 1 34 2  44 f 0  43.1243 5.80411 36.0417     11.52    36.8151     12.6406  17.716     144.081     0           0           
1 1 1 34 2  45 o 11 108.226 3.16177 213.52      16.4501  212.373     17.7412  97.2705    347.386     43.1042     347.386     
1 1 1 34 2  46 o 1  60.0089 4.322   63.4285     12.1371  71.7303     13.5066  36.3346    143.782     9.98084     323.782     
1 1 1 34 2  47 o 17 77.9405 3.73131 112.163     14.0117  112.384     14.9473  49.9962    46.5135     8.2656      226.514     
1 1 1 34 2  48 o 2  39.0684 5.65752 20.8507     10.8722  41.1705     10.6055  32.1253    57.7188     16.0186     57.7188     
1 1 1 34 2  49 o 7  19.5368 5.87874 3.98006     10.4115  0.160521    9.80698  5.13257    197.976     2.29078     17.9763     
1 1 1 34 2  50 o 18 62.1987 4.29553 71.9912     14.0041  74.7776     12.3051  53.2934    123.784     22.5572     123.784     
1 1 1 34 2  51 o 13 65.823  4.19517 90.5106     13.953   74.1644     13.3621  48.3288    123.471     7.0675      123.471     
1 1 1 34 2  52 o 3  83.457  3.57886 131.913     15.3554  127.661     14.4366  64.9246    73.3708     15.604      73.3709     
1 1 1 34 2  53 o 14 49.4701 5.11414 61.2387     12.2061  36.8835     11.7977  42.6206    314.41      21.3758     314.41      
1 1 1 34 2  54 o 5  30.6959 6.59013 21.1142     11.1632  19.239      10.8985  11.8593    323.026     14.2551     143.026     
1 1 1 34 2  55 o 10 37.7268 6.11503 42.5525     11.9314  18.6726     11.4795  20.91      281.388     5.82426     101.388     
1 1 1 34 2  56 o 19 21.6871 6.20909 5.07317     10.6943  7.94232     10.3454  7.29987    339.2       40.6267     339.2       
1 1 1 34 2  57 o 6  69.5959 4.11507 99.832      14.4083  85.3185     13.9872  52.5764    119.583     12.2706     119.583     
1 1 1 34 2  58 o 19 21.3509 6.20016 10.3492     11.025   -0.580616   10.9439  4.59113    359.976     13.7778     179.976     
1 1 1 34 2  59 o 3  20.2794 6.06202 8.4922      11.1046  -3.17925    10.7981  4.77842    55.8194     0.182606    55.8194     
1 1 1 34 2  60 o 8  28.29   7.42451 22.889      16.114   11.8899     11.9293  13.7139    99.7131     7.73136     99.7131     
1 1 1 34 2  61 o 10 37.1338 7.44506 32.6508     14.5322  31.6561     14.4475  22.0806    250.453     1.85249     70.4527     
1 1 1 34 2  62 o 12 29.8812 7.37106 9.17002     13.8052  31.1245     15.0855  18.9117    48.7497     7.42666     48.7497     
1 1 1 34 2  63 o 7  24.9499 7.34066 19.4919     17.3114  3.70798     13.1402  4.36747    282.643     1.67682     282.643     
1 1 1 34 2  64 o 17 37.8037 8.63882 26.1082     18.4398  54.1396     20.4933  21.9778    295.384     0.871291    115.384     
1 1 1 34 2  65 o 4  32.456  8.24529 41.7322     18.0571  13.607      19.7937  16.8817    97.1525     1.63135     277.152     
1 1 1 34 2  66 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 2  67 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 3  0  o 3  103.027 3.29606 189.974     16.9384  189.974     16.9384  61.8336    180         30.9364     8.78279e-06 
1 1 1 34 3  1  o 6  148.243 2.80753 388.081     21.8067  395.792     19.7987  119.113    95.5296     20.2795     95.5296     
1 1 1 34 3  2  o 16 51.1813 4.15945 50.8936     10.6317  44.4227     10.2957  14.2305    259.004     39.4198     79.0037     
1 1 1 34 3  3  o 15 107.281 3.1312  211.882     16.326   199.724     17.2187  68.441     227.172     18.9379     47.172      
1 1 1 34 3  4  o 5  103.389 3.19775 186.772     17.7871  195.695     15.0787  92.212     134.435     37.6499     134.435     
1 1 1 34 3  5  o 10 156.662 2.86518 438.502     23.0417  437.212     21.8959  120.128    122.884     9.31937     122.884     
1 1 1 34 3  6  o 19 95.3925 3.08535 163.25      15.2941  162.237     14.1052  69.6807    70.919      3.1017      70.9189     
1 1 1 34 3  7  o 10 173.514 3.16926 556.068     28.4245  520.168     26.6535  152.679    160.43      49.6083     160.43      
1 1 1 34 3  8  o 3  87.2692 3.31353 129.495     13.5281  143.673     15.3559  61.0509    241.778     1.43453     61.7779     
1 1 1 34 3  9  o 9  20.6509 5.66488 7.45903     8.48676  2.02402     8.53794  8.11212    115.684     24.8149     115.684     
1 1 1 34 3  10 o 19 194.268 3.08783 676.809     29.2613  670.946     30.8336  171.823    303.201     56.7064     303.201     
1 1 1 34 3  11 o 12 20.3557 5.65531 4.37254     8.45652  4.72881     8.42092  16.0348    156.59      45.9848     156.59      
1 1 1 34 3  12 o 8  188.362 2.93457 634.729     27.0396  631.701     28.3435  145.898    343.375     13.5079     343.375     
1 1 1 34 3  13 o 5  47.819  4.36112 43.6287     9.94044  40.0504     10.4225  19.5046    274.117     20.2538     94.1173     
1 1 1 34 3  14 o 11 79.3162 3.15526 122.844     12.374   103.151     12.5178  59.0852    10.8945     8.50731     10.8945     
1 1 1 34 3  15 o 6  98.4454 2.92668 175.305     14.3817  171.36      14.4294  79.1279    183.714     18.5528     183.714     
1 1 1 34 3  16 o 12 90.8709 3.00576 150.258     13.5722  145.414     13.7221  77.0374    350.92      26.9471     350.92      
1 1 1 34 3  17 o 2  31.273  5.63037 15.1127     8.85474  21.9532     8.98673  3.49767    291.936     17.8853     111.936     
1 1 1 34 3  18 o 5  146.797 2.89717 402.55      21.2238  368.16      21.3237  133.074    282.408     52.2712     282.408     
1 1 1 34 3  19 o 2  105.834 3.12328 201.587     15.9896  199.81      17.0448  80.9211    112.725     9.30677     112.725     
1 1 1 34 3  20 o 7  37.5359 5.25782 24.9683     9.32292  28.0648     9.76205  11.6164    271.481     21.5874     91.4813     
1 1 1 34 3  21 o 6  68.0795 3.99565 92.2103     13.736   76.2282     13.2257  46.4961    239.539     1.90088     59.539      
1 1 1 34 3  22 o 11 56.85   4.36813 62.3298     12.1611  55.9196     12.2843  42.7623    9.98105     9.49731     9.98105     
1 1 1 34 3  23 o 1  148.572 3.09587 403.039     22.9319  388.28      23.1087  121.514    165.164     25.6405     165.164     
1 1 1 34 3  24 o 7  77.4361 3.30762 104.515     13.2552  111.467     12.2268  62.0626    90.9113     13.8548     90.9113     
1 1 1 34 3  25 o 3  32.0535 5.85666 16.6817     9.34192  22.6926     9.70901  6.65674    136.359     27.458      316.359     
1 1 1 34 3  26 o 4  37.5169 5.30305 36.8749     9.65855  17.5957     9.58986  21.1938    303.143     4.37125     123.143     
1 1 1 34 3  27 o 17 22.2098 5.69014 5.92741     7.76702  9.59595     8.6049   2.16885    346.898     13.5857     166.898     
1 1 1 34 3  28 o 9  18.7618 5.54447 2.8018      7.75378  0.385739    9.75918  2.91144    216.185     20.6738     216.185     
1 1 1 34 3  29 o 10 27.2904 5.71655 11.0721     8.11243  17.1025     8.79547  5.36176    209.19      45.7167     209.19      
1 1 1 34 3  30 o 17 49.7833 4.18831 48.6146     9.81947  42.7804     10.5478  37.1883    40.8671     7.75025     40.8671     
1 1 1 34 3  31 o 12 65.2596 3.59858 76.7445     11.6538  78.1446     11.6976  54.5056    270.429     18.4475     270.429     
1 1 1 34 3  32 o 17 52.4688 4.05927 39.808      10.0049  62.7706     10.6319  40.2152    33.412      9.53209     33.412      
1 1 1 34 3  33 o 16 67.2749 3.55631 83.6435     11.8721  81.1062     11.9305  44.9208    186.416     4.85369     6.41626     
1 1 1 34 3  34 f 0  45.9643 4.89167 31.896      11.0289  48.4141     10.2166  64.1849    129.95      0           0           
1 1 1 34 3  35 o 18 51.2116 4.24722 51.4321     10.6758  45.8412     10.6742  37.03      16.0653     4.69377     16.0653     
1 1 1 34 3  36 o 14 102.222 3.02958 184.483     15.4706  192.957     15.4947  92.8527    277.233     40.4975     277.233     
1 1 1 34 3  37 o 9  21.7095 5.87641 4.34968     9.04967  8.67254     8.97887  2.04791    280.032     1.54885     100.032     
1 1 1 34 3  38 o 10 117.538 3.10212 241.632     18.3631  258.187     18.091   89.9983    136.526     12.2959     136.526     
1 1 1 34 3  39 o 3  101.425 3.16782 197.182     15.6365  175.851     16.3882  80.1397    226.734     16.4615     226.734     
1 1 1 34 3  40 o 13 39.8015 5.42707 31.3752     10.5861  29.9769     10.2801  12.6627    163.063     28.2877     343.063     
1 1 1 34 3  41 f 0  44.5732 5.02048 34.0612     10.734   41.9661     10.8675  31.7446    294.01      0           0           
1 1 1 34 3  42 o 13 55.2866 4.3012  68.2544     12.1412  46.8277     11.1044  20.7186    288.552     35.4468     108.552     
1 1 1 34 3  43 o 13 28.8462 6.50216 11.6516     10.7894  20.6423     10.8613  13.3616    62.2722     8.14782     242.272     
1 1 1 34 3  44 o 11 30.4396 6.44453 19.3078     11.3111  17.978      9.89399  16.1763    346.571     5.21126     166.571     
1 1 1 34 3  45 o 5  56.4773 4.50188 55.7929     13.1935  64.9385     11.5078  45.1677    136.068     13.3446     136.068     
1 1 1 34 3  46 o 6  25.6029 6.444   11.5206     11.1401  12.6986     9.7437   13.4788    52.8483     0.361599    52.8482     
1 1 1 34 3  47 o 4  74.2835 3.76676 102.157     13.7144  103.092     14.142   67.0487    198.02      31.799      198.02      
1 1 1 34 3  48 o 18 57.3338 4.96157 66.6358     12.9742  60.862      14.705   48.869     218.747     20.3022     218.747     
1 1 1 34 3  49 o 12 29.8902 6.67875 19.9759     10.7745  17.2833     11.7297  19.7959    81.9318     7.07519     81.9318     
1 1 1 34 3  50 o 17 69.1851 4.07064 93.1257     13.6042  88.0307     14.3182  54.3451    275.963     14.0706     275.963     
1 1 1 34 3  51 o 6  33.5381 6.7406  29.4829     11.7338  18.8292     12.596   17.2907    343.244     7.81335     163.244     
1 1 1 34 3  52 o 7  28.916  6.59076 15.2247     11.0136  20.0184     10.8627  13.3466    252.344     8.10654     72.3444     
1 1 1 34 3  53 o 18 57.1231 4.53239 61.0316     12.9495  65.4781     12.5055  48.4859    129.337     21.485      129.337     
1 1 1 34 3  54 o 12 69.0117 4.10555 98.7922     14.5849  83.2564     13.539   49.8363    240.794     6.55261     240.794     
1 1 1 34 3  55 o 5  19.4057 5.89926 -4.7855     10.9025  6.66696     10.5438  0.0100392  74.2976     20.2997     74.2993     
1 1 1 34 3  56 o 13 30.8925 6.78977 24.4047     12.0127  17.3193     11.4078  17.3533    203.54      1.4838      23.5402     
1 1 1 34 3  57 o 16 35.3569 6.76661 23.922      12.5709  30.8868     12.1841  23.545     205.886     3.96214     205.886     
1 1 1 34 3  58 o 16 27.6466 7.04192 19.29       12.1344  12.016      13.311   13.8151    184.956     7.6332      184.956     
1 1 1 34 3  59 o 16 54.5334 5.57487 67.1942     16.2152  54.9979     13.4017  38.8788    0.464687    6.05973     0.464687    
1 1 1 34 3  60 o 15 19.3263 6.20752 -14.6672    14.6609  4.1895      12.9111  4.87861    244.914     8.54945     64.9139     
1 1 1 34 3  61 o 9  21.9928 6.60313 14.9859     13.5372  -13.4053    14.9367  7.92367    121.427     5.63339     301.427     
1 1 1 34 3  62 o 8  30.0845 8.0857  20.5576     17.9838  24.5941     16.0089  10.8144    145.984     14.1099     325.984     
1 1 1 34 3  63 o 12 27.2501 7.83066 32.07       19.3556  0.0861805   16.1183  7.6752     336.292     3.0188      336.292     
1 1 1 34 3  64 o 9  24.0904 7.62245 -7.05364    21.4332  16.7414     18.5407  7.43987    119.583     5.32316     299.584     
1 1 1 34 3  65 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 3  66 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 4  0  o 16 121.204 2.9557  262.197     17.9045  262.197     17.9045  114.247    360         46.3574     360         
1 1 1 34 4  1  o 8  74.1777 3.46665 92.6314     12.8286  105.423     12.7504  47.3088    304.5       8.9526      124.5       
1 1 1 34 4  2  o 7  72.8913 3.42118 92.8781     12.0808  98.1662     12.7744  61.7459    199.276     27.3561     199.276     
1 1 1 34 4  3  o 19 119.815 3.01095 256.021     16.3285  257.358     19.6228  112.356    349.441     51.8769     349.441     
1 1 1 34 4  4  o 12 42.8299 4.72894 28.9888     9.18854  39.1535     10.4336  1.14246    267.074     53.4344     87.0743     
1 1 1 34 4  5  o 1  65.9271 3.43671 83.2133     10.8052  73.3818     11.6317  44.117     288.401     0.702226    108.401     
1 1 1 34 4  6  o 4  114.211 2.88985 235.716     15.579   230.559     17.3749  72.6225    58.5111     21.6786     238.511     
1 1 1 34 4  7  o 13 102.811 2.79709 179.635     13.4975  198.341     15.2777  98.4294    287.156     51.9079     287.156     
1 1 1 34 4  8  o 17 48.4786 3.88452 40.9069     8.95815  44.5847     9.58773  27.2076    7.53656     6.57255     7.53657     
1 1 1 34 4  9  o 11 17.4656 5.14509 3.36325     6.97936  -1.69401    8.2648   9.30682    17.7496     24.8065     17.7496     
1 1 1 34 4  10 o 8  95.2089 2.75425 163.48      12.7193  160.535     13.488   75.2398    175.706     14.4378     175.706     
1 1 1 34 4  11 o 4  85.4893 2.82932 132.234     11.6717  129.262     12.4788  36.1053    57.5627     51.4072     237.563     
1 1 1 34 4  12 o 18 116.343 2.6203  244.046     14.799   239.243     15.693   75.6321    146.428     18.9806     326.428     
1 1 1 34 4  13 o 17 110.019 2.70569 213.588     14.702   218.925     15.0888  79.3246    69.8785     1.54958     249.878     
1 1 1 34 4  14 o 9  70.1625 3.27036 88.344      11.0402  88.6952     11.8165  41.6633    166.903     15.5585     346.903     
1 1 1 34 4  15 o 4  114.903 2.93715 238.064     16.66    234.5       17.103   104.012    333.498     41.4863     333.498     
1 1 1 34 4  16 o 8  117.715 3.03299 246.463     18.09    249.913     17.6272  102.921    120.156     34.5131     120.156     
1 1 1 34 4  17 o 13 37.2074 5.38732 35.8566     9.70871  17.4053     9.77868  2.13206    301.512     44.772      121.512     
1 1 1 34 4  18 o 8  69.6181 3.81153 95.1664     13.4949  80.61       12.8661  61.5902    39.0426     27.0294     39.0426     
1 1 1 34 4  19 o 12 31.4357 6.00781 21.1345     9.51417  16.4598     9.98085  12.7242    349.89      4.62518     169.89      
1 1 1 34 4  20 o 3  23.0341 5.81111 14.801      9.37929  -1.39275    9.3635   2.91479    275.824     8.05323     95.824      
1 1 1 34 4  21 o 2  34.9237 5.48566 26.2374     8.68494  20.1342     10.0586  0.72132    101.782     48.8786     101.782     
1 1 1 34 4  22 o 11 58.7127 3.87149 67.2481     10.8472  58.3589     11.5477  42.8983    200.226     3.77605     200.226     
1 1 1 34 4  23 f 0  98.3147 2.93185 174.913     14.2209  172.039     14.5977  78.1853    342.861     0           0           
1 1 1 34 4  24 o 12 21.2686 5.59478 9.32466     7.83269  2.93622     8.56705  1.82113    162.341     9.21798     342.341     
1 1 1 34 4  25 f 0  18.9729 5.52689 2.27839     8.67688  2.71876     8.29159  16.7962    36.1753     0           0           
1 1 1 34 4  26 o 17 75.444  3.45254 110.081     12.6676  96.1721     13.2033  41.6964    48.2343     25.2168     228.234     
1 1 1 34 4  27 o 14 55.8045 3.82622 59.8235     10.0077  54.038      11.0068  52.2115    350.779     30.9564     350.779     
1 1 1 34 4  28 o 5  105.776 2.98807 196.174     15.0888  206.622     16.522   83.1462    138.897     13.1541     138.897     
1 1 1 34 4  29 o 2  100.725 2.88902 185.402     14.107   179.692     14.9678  83.6695    55.7701     22.1265     55.7701     
1 1 1 34 4  30 o 19 132.549 2.77483 315.681     17.8977  315.731     18.9112  115.817    207.876     39.4294     207.876     
1 1 1 34 4  31 o 3  72.8507 3.31697 102.487     11.5821  90.212      12.3944  50.7088    96.9615     2.18777     276.961     
1 1 1 34 4  32 o 7  48.6127 4.25777 48.3808     9.63455  39.5238     10.4323  40.1345    16.96       16.1382     16.96       
1 1 1 34 4  33 o 12 28.9344 5.76736 18.0025     8.40819  14.3412     9.16027  13.6701    63.4871     4.36472     243.487     
1 1 1 34 4  34 o 17 22.311  5.7665  7.48521     8.0159   8.59184     8.78074  2.25562    128.036     19.3236     308.036     
1 1 1 34 4  35 o 5  18.7545 5.51241 0.114913    7.87872  4.5181      9.25198  1.23024    359.022     7.88411     179.022     
1 1 1 34 4  36 o 12 25.703  5.90674 14.4714     8.34062  9.82063     9.37071  8.24917    135.007     12.165      315.007     
1 1 1 34 4  37 o 2  136.135 2.7787  333.412     18.2918  334.488     19.5618  111.421    244.417     27.4411     244.417     
1 1 1 34 4  38 o 19 56.3684 3.92827 56.8742     10.8913  60.5305     11.0081  33.6921    289.185     10.9954     109.185     
1 1 1 34 4  39 o 12 148.033 2.80047 392.223     20.9976  398.603     20.5075  132.675    124.158     53.5812     124.158     
1 1 1 34 4  40 o 12 26.2713 6.06804 13.2694     8.94677  12.9665     9.43852  5.74531    266.724     21.0889     86.7235     
1 1 1 34 4  41 o 1  28.4667 5.8523  23.1373     9.09332  7.1469      10.2664  16.9853    2.80974     3.8238      2.80974     
1 1 1 34 4  42 o 12 30.317  6.34397 19.8784     10.7286  17.1216     9.91498  11.6409    69.2427     15.7281     249.243     
1 1 1 34 4  43 o 8  71.9469 3.58552 84.6709     12.4437  106.815     13.1818  53.9666    285.19      7.25192     285.19      
1 1 1 34 4  44 f 0  22.4725 5.98569 2.69987     8.84566  12.915      10.0753  15.161     216.221     0           0           
1 1 1 34 4  45 o 4  19.6657 5.76404 2.53605     8.85352  4.56721     9.74965  2.69044    338.521     29.1726     338.521     
1 1 1 34 4  46 o 4  33.7154 6.55968 22.9777     12.4295  24.6307     10.543   23.8314    213.947     6.12795     213.947     
1 1 1 34 4  47 o 10 18.5454 5.79844 -5.86238    11.8145  2.33595     9.91727  4.44032    237.201     6.96796     57.2015     
1 1 1 34 4  48 f 0  47.2369 5.5321  47.699      13.3303  42.0095     11.9564  25.4431    35.8994     0           0           
1 1 1 34 4  49 o 13 21.121  6.12861 4.04296     10.6432  6.58724     10.1788  6.08503    329.675     0.168883    149.675     
1 1 1 34 4  50 o 17 110.798 3.28314 213.768     18.8989  241         17.2705  85.8225    60.6392     17.5872     60.6392     
1 1 1 34 4  51 o 4  75.9859 4.03016 108.876     15.2112  110.282     15.2583  68.383     274.671     33.3042     274.671     
1 1 1 34 4  52 o 9  63.8349 4.66945 77.6099     13.9577  81.2637     15.4658  48.1797    57.5463     10.118      57.5463     
1 1 1 34 4  53 o 9  29.0478 6.9317  24.5811     12.4741  10.9862     12.4794  15.2275    238.978     1.70342     58.9781     
1 1 1 34 4  54 o 3  31.9531 6.57697 9.1936      11.5103  35.2621     13.0281  21.3153    9.96125     8.66234     9.96125     
1 1 1 34 4  55 o 9  24.2243 6.5553  5.38188     11.6946  14.7899     11.199   11.01      2.14769     1.19014     2.14769     
1 1 1 34 4  56 o 5  47.5003 5.51133 44.522      12.7452  47.3354     12.5674  29.9519    4.86521     2.83964     184.865     
1 1 1 34 4  57 o 5  26.9353 6.67255 19.9263     11.3601  9.74        11.5892  16.1015    175.118     5.14529     175.118     
1 1 1 34 4  58 o 18 48.1391 5.92502 47.9475     13.1244  49.4618     14.406   25.5354    66.3872     12.5228     246.387     
1 1 1 34 4  59 o 15 28.9053 7.27042 19.6491     13.0477  18.3295     13.4636  17.7523    119.536     4.03866     119.536     
1 1 1 34 4  60 o 7  34.7848 7.88251 31.0174     15.1256  29.7095     16.0282  24.2821    8.60887     15.0564     8.60886     
1 1 1 34 4  61 o 7  48.1251 8.04761 51.1026     20.132   66.2387     18.4534  33.6449    342.213     6.44414     342.213     
1 1 1 34 4  62 o 3  27.0528 7.80441 11.7138     18.6805  21.2646     15.7684  7.70597    296.729     2.77291     296.729     
1 1 1 34 4  63 o 13 24.53   7.53547 6.73416     18.6391  14.3897     16.3646  6.1099     170.997     12.7065     350.997     
1 1 1 34 4  64 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 5  0  o 4  17.5686 7.23758 6.89689     10.5321  6.89689     10.5321  16.7005    3.59713e-05 46.8472     3.59713e-05 
1 1 1 34 5  1  o 10 49.1537 4.53007 43.1743     11.4579  45.5663     10.2323  17.8271    141.379     30.5908     321.379     
1 1 1 34 5  2  o 15 99.0677 3.10358 171.185     15.6449  180.659     15.0642  73.5618    336.347     2.99871     336.347     
1 1 1 34 5  3  o 8  28.5968 6.28367 15.191      10.829   14.9042     9.10982  1.8554     210.379     19.4125     30.3788     
1 1 1 34 5  4  o 10 19.3729 5.48452 6.76273     8.37479  -0.989802   8.2761   6.77865    148.003     22.8942     148.003     
1 1 1 34 5  5  o 2  16.3308 5.10092 -2.78903    7.76027  -1.5701     8.60553  5.00444    18.7263     13.9323     18.7263     
1 1 1 34 5  6  o 12 29.4874 5.82726 20.2342     8.82943  12.2582     9.44981  2.68879    185.812     23.0753     5.81247     
1 1 1 34 5  7  o 8  74.9363 3.68419 99.2426     14.6249  103.47      12.7531  71.3052    76.79       41.0507     76.79       
1 1 1 34 5  8  o 13 27.3279 5.74396 17.7302     8.03379  9.04626     9.58568  5.65087    32.6438     42.0228     32.6438     
1 1 1 34 5  9  o 7  142.867 3.0703  380.724     20.4794  350.682     23.2005  108.507    320.992     5.34201     320.992     
1 1 1 34 5  10 o 2  20.4877 5.71416 3.87906     7.97802  5.45118     9.29729  9.47247    314.539     36.718      314.538     
1 1 1 34 5  11 o 14 77.997  3.43151 107.255     13.1521  111.915     13.5418  46.3376    194.185     20.2182     14.1853     
1 1 1 34 5  12 o 6  85.7766 3.49357 133.979     14.5356  131.112     15.3492  63.2106    297.041     2.05069     297.041     
1 1 1 34 5  13 o 14 46.4079 5.03533 44.3467     10.3801  35.9684     11.9515  31.427     195.953     2.52069     195.953     
1 1 1 34 5  14 o 16 22.8247 5.82759 13.3941     8.66515  -1.62238    10.3582  4.00831    83.198      32.3667     83.198      
1 1 1 34 5  15 o 6  42.7069 5.2972  29.5078     10.1571  39.3602     11.7088  30.431     117.948     6.77797     117.948     
1 1 1 34 5  16 o 13 46.6734 4.65307 35.0236     10.4991  45.9605     10.4799  21.903     12.3743     21.1499     192.374     
1 1 1 34 5  17 o 8  34.5525 5.33296 15.9358     8.28567  30.2927     9.86536  2.56859    115.958     41.679      295.958     
1 1 1 34 5  18 o 9  103.383 2.97801 195.757     14.888   187.956     15.863   72.8636    223.133     6.08954     43.1327     
1 1 1 34 5  19 o 2  60.6615 3.53205 70.9241     10.2487  62.6019     10.937   36.0741    163.681     14.4738     343.681     
1 1 1 34 5  20 o 7  24.1451 5.85185 9.44999     8.24164  10.7679     8.82628  4.88743    114.186     12.4502     294.186     
1 1 1 34 5  21 o 7  56.634  3.69977 58.7044     9.76166  58.0793     10.952   48.4121    51.2353     19.0772     51.2353     
1 1 1 34 5  22 o 1  31.1914 5.87544 23.135      8.37869  13.3621     11.0813  3.41481    351.692     34.038      171.692     
1 1 1 34 5  23 o 18 31.9436 5.4759  26.2422     8.63507  12.9984     9.24193  17.4033    149.046     0.448211    149.046     
1 1 1 34 5  24 o 3  70.6863 3.41409 88.9354     11.6638  92.1708     12.3778  58.6643    252.42      16.7995     252.42      
1 1 1 34 5  25 o 6  44.9779 4.43908 36.3561     9.72159  38.9231     9.73508  23.7157    165.796     14.405      345.796     
1 1 1 34 5  26 o 17 46.2798 4.58201 46.4212     10.2881  33.9679     10.1687  40.5039    250.04      25.221      250.04      
1 1 1 34 5  27 o 12 24.0884 5.3146  18.2861     7.93589  -1.90854    9.22249  3.58416    308.119     19.8084     128.119     
1 1 1 34 5  28 o 3  68.1857 3.45192 81.053      11.1221  88.1341     12.3163  67.3926    284.068     40.3799     284.068     
1 1 1 34 5  29 o 13 127.915 2.71702 296.378     17.176   291.91      17.6115  102.834    246.995     19.4023     246.995     
1 1 1 34 5  30 f 0  66.3836 3.45591 88.7067     11.0585  72.2098     11.5992  51.9735    345.675     0           0           
1 1 1 34 5  31 o 15 108.71  2.91436 209.523     16.0879  216.842     15.5921  99.23      206.77      41.6699     206.77      
1 1 1 34 5  32 o 1  63.2794 3.53146 67.1963     10.7271  79.3478     11.4792  37.0791    25.3866     15.6609     205.387     
1 1 1 34 5  33 o 16 75.8636 3.27246 106.857     12.2685  102.318     12.4847  70.698     10.4351     34.5202     10.4351     
1 1 1 34 5  34 o 15 18.6821 5.44343 4.3511      7.79989  0.486006    8.85482  1.51052    212.217     5.9875      32.2167     
1 1 1 34 5  35 o 18 20.0571 5.77684 2.53129     8.60662  5.21541     9.67145  1.08355    86.2714     17.7221     266.271     
1 1 1 34 5  36 o 6  19.0706 5.32488 9.63639     8.16777  -7.46773    8.95731  2.39375    106.942     9.31414     286.942     
1 1 1 34 5  37 o 19 31.3222 5.67039 26.0444     8.89369  12.3813     9.76918  15.0317    272.429     9.54865     92.4288     
1 1 1 34 5  38 o 6  20.61   5.72467 2.18796     8.22227  8.48918     9.27888  5.37175    301.64      5.49098     121.64      
1 1 1 34 5  39 o 12 101.675 2.966   190.612     14.8626  184.473     15.2842  70.7152    356.944     3.89012     176.944     
1 1 1 34 5  40 o 18 67.3804 3.61876 83.7595     11.5044  83.6329     12.7132  46.7444    32.2241     1.47094     212.224     
1 1 1 34 5  41 o 12 60.2252 3.88727 65.2178     11.324   69.8374     11.8844  42.0271    44.5224     0.164952    224.522     
1 1 1 34 5  42 o 4  25.0106 6.09935 9.31248     8.77794  14.3675     9.8619   11.6597    2.6465      4.32797     2.6465      
1 1 1 34 5  43 o 8  40.6381 5.2187  21.1139     9.47736  46.0446     10.824   29.5048    101.372     5.01438     101.372     
1 1 1 34 5  44 o 6  46.8154 4.68618 38.3212     10.0458  46.5817     11.3396  34.9195    168.312     6.34616     168.312     
1 1 1 34 5  45 f 0  14.0183 4.66084 -4.14625    7.72073  -12.8821    9.45405  10.1815    300.384     0           0           
1 1 1 34 5  46 o 19 31.5987 5.53935 6.9261      9.07903  34.9296     10.4725  19.9752    359.56      0.451925    359.56      
1 1 1 34 5  47 o 11 42.9815 5.42342 31.5311     11.1344  43.2977     11.2537  28.0168    34.3198     1.40547     214.32      
1 1 1 34 5  48 o 10 22.325  6.14044 6.69587     9.4303   9.58482     10.3172  7.26825    321.123     10.1303     141.123     
1 1 1 34 5  49 f 0  25.2203 6.26781 6.45291     9.76868  18.1372     10.6133  14.7504    87.0713     0           0           
1 1 1 34 5  50 o 15 67.3065 3.97471 79.8289     12.9827  92.6125     13.5623  59.0594    186.292     26.7337     186.292     
1 1 1 34 5  51 o 4  28.2204 6.69729 10.6464     11.825   22.4489     11.4393  13.4494    104.586     5.61698     284.586     
1 1 1 34 5  52 o 2  37.6548 6.52914 32.668      11.9585  28.8418     12.5403  24.5675    273.267     1.92075     273.267     
1 1 1 34 5  53 o 19 19.8781 6.01893 7.06326     10.9415  -3.29052    11.0263  0.929001   298.323     0.149485    118.323     
1 1 1 34 5  54 o 6  34.277  6.77431 31.8506     11.8667  19.687      13.099   15.2731    179.887     13.474      359.887     
1 1 1 34 5  55 o 10 43.4644 6.64572 42.1582     12.4771  39.7912     15.6032  34.4876    271.713     13.2979     271.713     
1 1 1 34 5  56 o 17 47.7443 6.32893 44.3192     13.0243  53.5514     16.1593  35.6782    218.254     8.89973     218.254     
1 1 1 34 5  57 o 5  39.0991 7.1716  27.6366     12.6031  43.7861     15.9175  21.4127    233.776     7.57855     53.7763     
1 1 1 34 5  58 o 6  41.7729 7.53406 48.4309     15.6595  35.2529     16.4158  30.1495    279.842     7.62159     279.842     
1 1 1 34 5  59 o 15 22.5392 6.79489 14.8369     13.9868  -6.42756    15.0261  8.34792    344.392     1.39333     164.392     
1 1 1 34 5  60 o 7  47.454  7.36792 43.6072     16.2427  66.6447     18.0598  34.4281    183.57      8.87419     183.57      
1 1 1 34 5  61 o 7  17.721  6.08475 -20.4378    16.201   -10.964     17.579   0.928558   349.209     3.10425     169.209     
1 1 1 34 5  62 o 14 27.3653 7.997   -13.3065    24.2872  33.6586     18.9346  7.99755    253.72      1.98687     253.72      
1 1 1 34 5  63 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 6  0  o 8  45.2054 4.79338 38.9871     10.1394  38.9871     10.1394  27.7885    180         12.2159     2.2312e-05  
1 1 1 34 6  1  o 3  49.0691 4.36977 41.5347     9.52746  47.0306     11.4825  29.2542    112.19      9.10815     292.19      
1 1 1 34 6  2  o 19 49.8044 4.41799 47.8909     10.2342  43.3432     11.214   26.6982    131.588     16.0568     311.588     
1 1 1 34 6  3  o 17 22.5336 5.86123 9.55257     8.15381  5.06964     9.55235  1.43559    100.186     6.74913     280.186     
1 1 1 34 6  4  o 15 21.8562 5.82079 9.10286     8.39966  3.43398     9.32948  0.0881333  192.619     17.5381     192.62      
1 1 1 34 6  5  o 17 52.5458 4.22749 45.5907     10.5132  55.759      11.3307  42.7649    213.013     14.4728     213.013     
1 1 1 34 6  6  o 15 64.9318 3.9701  69.8854     11.9891  83.6908     13.6113  62.878     186.392     36.0827     186.392     
1 1 1 34 6  7  o 9  65.4186 3.79367 87.9067     13.074   67.9775     11.5719  22.359     141.037     51.0173     321.037     
1 1 1 34 6  8  f 0  113.107 3.20344 219.075     18.7519  240.855     17.3603  89.5957    100.208     0           0           
1 1 1 34 6  9  o 15 65.7499 4.0708  83.6058     13.2381  73.9643     13.2708  28.2352    200.47      39.4821     20.4701     
1 1 1 34 6  10 o 8  17.0738 5.29884 0.775024    8.60479  -5.23028    9.07489  2.40162    135.304     13.1351     135.304     
1 1 1 34 6  11 f 0  18.3054 5.48417 3.22115     8.79213  -2.37073    8.85876  6.45905    98.1397     0           0           
1 1 1 34 6  12 o 12 86.6243 3.14096 132.909     13.0516  137.117     14.12    79.1893    116.219     32.3957     116.219     
1 1 1 34 6  13 o 6  28.6304 5.87118 15.9422     8.09683  15.0133     9.80984  10.782     310.641     9.83589     130.641     
1 1 1 34 6  14 o 8  72.3948 3.29258 102.221     11.2489  87.2648     12.332   58.5022    288.751     12.563      288.751     
1 1 1 34 6  15 o 3  52.4971 3.94376 55.8527     9.50576  45.2313     10.6287  31.5738    237.782     11.015      57.7821     
1 1 1 34 6  16 o 5  31.8851 5.63466 17.8203     8.52328  21.3273     9.44877  14.8032    213.079     5.19087     213.079     
1 1 1 34 6  17 o 4  26.8861 5.83557 14.5831     8.04716  12.326      9.30203  9.41287    14.4684     8.28442     194.468     
1 1 1 34 6  18 o 3  71.6398 3.47878 103.793     11.9697  82.7832     12.6305  44.2945    47.2266     15.4392     227.227     
1 1 1 34 6  19 o 12 61.1678 3.73405 76.3752     10.8935  60.4537     11.5368  42.9188    337.028     1.41288     157.028     
1 1 1 34 6  20 o 7  34.7455 5.37398 27.2777     8.46757  19.0746     9.77634  20.352     296.212     2.00417     116.211     
1 1 1 34 6  21 o 5  31.2742 5.86324 15.6895     8.3703   22.5        10.3672  16.0187    275.228     3.97948     95.2285     
1 1 1 34 6  22 o 7  25.1781 5.82911 12.2938     7.70585  10.6852     9.37564  7.97423    154.894     4.11541     334.894     
1 1 1 34 6  23 o 5  40.253  5.36164 29.5567     9.50623  32.4811     11.3242  21.0739    338.819     12.2177     158.819     
1 1 1 34 6  24 o 10 26.575  5.69903 17.1294     7.85582  8.65103     9.41506  9.40703    52.753      0.0200423   232.756     
1 1 1 34 6  25 o 8  69.2391 3.30291 87.7933     11.2814  86.2692     11.5016  62.7885    342.13      27.5031     342.13      
1 1 1 34 6  26 o 2  49.6098 4.07233 48.758      9.55342  42.3742     10.1953  46.0279    14.4157     34.9238     14.4157     
1 1 1 34 6  27 o 19 23.7673 6.13896 9.39458     8.6598   9.03893     10.42    6.54455    43.6247     10.1348     223.625     
1 1 1 34 6  28 o 15 23.7567 5.42749 -2.31928    7.77039  19.9614     9.52159  7.55073    2.53512     4.59369     182.535     
1 1 1 34 6  29 o 16 85.3269 3.06713 131.925     12.7808  131.669     13.356   69.1232    98.8586     15.2464     98.8586     
1 1 1 34 6  30 o 12 51.5768 3.97909 46.4707     9.50258  52.0038     10.7409  35.6168    329.221     0.555159    149.222     
1 1 1 34 6  31 o 7  86.9822 3.0296  145.908     12.4257  128.279     13.7337  73.293     17.1679     21.5607     17.1679     
1 1 1 34 6  32 f 0  54.4733 3.88514 54.1928     9.8802   55.3768     11.0154  55.7147    95.4577     0           0           
1 1 1 34 6  33 o 11 36.8133 5.43579 25.8704     9.42242  26.9386     9.98635  25.3596    177.552     3.99136     177.552     
1 1 1 34 6  34 o 7  62.7058 3.8327  82.0328     10.7548  63.4769     12.5536  57.7511    293.889     28.3177     293.889     
1 1 1 34 6  35 o 15 78.549  3.22469 109.151     12.2815  115.647     12.9994  41.659     236.409     29.4955     56.4087     
1 1 1 34 6  36 o 3  16.6614 5.18481 0.70599     7.87128  -4.0347     9.12318  0.975509   272.029     9.67617     92.0294     
1 1 1 34 6  37 o 3  22.2763 5.7101  -0.340885   8.24954  14.9926     9.56561  8.52254    73.8604     5.55107     253.86      
1 1 1 34 6  38 o 1  54.4252 4.01028 50.1139     10.2368  60.8048     11.3172  39.9449    223.922     3.83207     223.922     
1 1 1 34 6  39 o 1  91.9343 3.18401 151.061     13.5776  158.055     15.6336  70.6232    160.861     9.91472     160.861     
1 1 1 34 6  40 o 17 27.7425 6.10309 12.7904     8.7669   18.2462     10.0753  1.73385    76.5048     33.44       256.505     
1 1 1 34 6  41 o 5  57.2778 4.03556 65.1081     10.6613  58.4136     12.0103  48.9005    221.598     18.4322     221.598     
1 1 1 34 6  42 o 1  41.7522 5.54794 30.6976     10.844   39.4762     11.5116  30.7726    265.632     5.55427     265.632     
1 1 1 34 6  43 o 15 32.9774 5.88633 16.082      9.27297  29.3656     10.5448  25.1349    172.517     10.5328     172.517     
1 1 1 34 6  44 o 13 41.6256 5.28854 37.5806     9.88152  31.8135     11.2113  20.0788    256.246     16.6394     76.2463     
1 1 1 34 6  45 o 15 49.6557 4.73985 37.1527     10.8416  60.4371     11.7146  29.4556    117.855     9.39305     297.855     
1 1 1 34 6  46 o 8  22.6873 6.07069 12.3787     9.13698  3.92754     10.611   9.7147     144.562     3.46986     324.562     
1 1 1 34 6  47 o 18 28.454  6.2864  20.6492     9.55403  12.8882     10.9886  3.83782    290.606     29.2683     110.606     
1 1 1 34 6  48 o 15 21.0899 6.05793 -0.333667   10.1109  10.7139     10.6103  5.13026    153.402     0.694959    333.402     
1 1 1 34 6  49 o 5  29.0874 6.73076 19.8109     11.4995  16.8008     11.1384  16.6437    323.964     1.04059     323.964     
1 1 1 34 6  50 o 11 32.744  6.87414 26.7572     12.7676  21.0048     11.4701  22.2825    320.934     10.2889     320.934     
1 1 1 34 6  51 o 1  25.4746 7.05308 13.1699     13.8985  10.9743     12.2631  11.8717    132.09      3.29879     312.09      
1 1 1 34 6  52 o 6  23.9638 6.75321 5.79919     12.2183  12.9472     12.4411  11.22      253.051     1.18137     253.051     
1 1 1 34 6  53 o 3  28.8694 6.15538 33.8333     12.321   -7.68216    13.3627  18.4094    326.498     2.90994     326.498     
1 1 1 34 6  54 o 12 30.5374 7.27729 18.5403     13.222   23.607      13.2881  7.19021    188.522     24.9828     8.52164     
1 1 1 34 6  55 o 18 26.7288 6.99924 19.8796     12.6541  9.58405     12.9026  12.4227    145.296     6.85586     325.296     
1 1 1 34 6  56 o 3  41.1435 6.91752 38.5543     13.7858  38.6751     14.3224  29.3329    31.6803     5.96555     31.6803     
1 1 1 34 6  57 o 17 26.3738 7.2057  25.392      15.2555  2.94474     13.4261  12.6025    100.923     4.22661     280.923     
1 1 1 34 6  58 o 19 32.4639 7.81291 37.8313     15.3866  13.5919     19.1162  20.4864    17.0199     4.47365     17.0199     
1 1 1 34 6  59 o 3  25.9663 7.54506 20.8024     14.6709  4.85142     19.3433  7.7992     31.5846     13.5664     211.585     
1 1 1 34 6  60 o 16 30.4874 8.92764 40.1912     24.4049  17.0598     20.493   14.569     140.326     4.82039     140.326     
1 1 1 34 6  61 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 6  62 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 7  0  o 3  22.9341 6.99104 13.6234     8.25515  13.6234     8.25515  4.09135    360         18.283      180         
1 1 1 34 7  1  o 10 80.9314 3.03444 124.072     11.7619  111.757     12.6683  69.041     304.075     19.6825     304.075     
1 1 1 34 7  2  o 9  41.7426 4.69912 39.2727     10.2288  26.3974     8.74174  15.9747    343.543     26.3656     163.543     
1 1 1 34 7  3  o 17 116.392 2.90053 249.975     17.5082  236.36      16.2776  112.074    260.333     51.514      260.333     
1 1 1 34 7  4  o 5  72.9405 3.29967 102.579     12.3217  89.7707     11.6683  48.0116    358.931     10.8843     178.931     
1 1 1 34 7  5  o 17 30.9531 5.91613 17.3102     9.13498  19.5432     9.66244  0.184396   306.578     42.0569     306.578     
1 1 1 34 7  6  o 11 57.3872 3.85689 56.2373     10.624   64.0523     11.2906  42.5385    246.621     3.38045     246.621     
1 1 1 34 7  7  o 6  66.5148 3.84057 72.0514     12.6255  89.4907     12.6241  55.0269    36.2645     14.3999     36.2645     
1 1 1 34 7  8  f 0  37.7221 5.19879 28.8837     8.39184  25.0766     10.4335  36.9238    251.841     0           0           
1 1 1 34 7  9  o 6  90.0069 3.06597 142.618     12.3292  149.11      15.152   81.985     15.178      32.0047     15.178      
1 1 1 34 7  10 o 9  70.6411 3.37265 92.7922     11.5797  87.844      12.128   65.631     346.494     30.0425     346.494     
1 1 1 34 7  11 o 19 56.4874 3.69777 50.586      10.0894  66.2668     10.4966  15.8569    313.383     50.5572     133.383     
1 1 1 34 7  12 f 0  50.9069 3.86131 48.0915     9.66923  46.8494     9.72218  28.6029    240.974     0           0           
1 1 1 34 7  13 o 6  158.308 2.73354 442.707     21.1337  455.85      22.2374  136.441    37.5206     36.7186     37.5206     
1 1 1 34 7  14 o 7  46.4921 4.25166 35.6057     9.34224  44.6434     9.95919  25.3577    291.15      14.5411     111.15      
1 1 1 34 7  15 o 11 19.4721 5.43871 7.56231     7.90699  -0.755761   8.44476  7.78384    273.715     37.685      273.715     
1 1 1 34 7  16 o 17 40.1429 4.90948 26.7308     9.17483  34.3935     9.84316  28.3844    86.3073     4.57452     86.3073     
1 1 1 34 7  17 o 18 86.6666 3.06567 143.832     12.8714  127.509     13.5788  88.2236    66.8881     51.1555     66.8881     
1 1 1 34 7  18 o 5  43.7826 4.7228  38.3206     9.224    33.7183     10.645   21.6539    143.127     17.7481     323.127     
1 1 1 34 7  19 o 12 61.4112 3.70788 71.7887     10.0758  66.1242     12.2728  26.6124    158.558     35.9437     338.558     
1 1 1 34 7  20 o 17 57.2449 3.80743 65.1848     10.1927  55.1944     11.1948  39.1247    87.6682     3.37838     267.668     
1 1 1 34 7  21 o 7  60.7291 3.77414 68.5281     10.1514  66.6109     12.4069  31.1128    233.65      25.5359     53.65       
1 1 1 34 7  22 o 9  23.8629 5.96735 7.7002      8.40122  11.9107     9.48235  3.07157    306.482     36.1238     306.482     
1 1 1 34 7  23 o 9  55.0355 4.47186 65.8157     9.9853   47.5662     13.0188  48.2617    308.914     20.3896     308.914     
1 1 1 34 7  24 o 9  68.1796 3.59841 84.5726     11.1862  85.2783     13.1413  35.7695    204.217     27.4053     24.2172     
1 1 1 34 7  25 o 13 92.4444 3.18271 154.443     13.7494  155.359     15.5925  95.9106    182.083     58.5401     182.083     
1 1 1 34 7  26 o 1  76.5971 3.36271 104.167     11.6887  109.444     13.9413  81.3594    193.134     54.6523     193.134     
1 1 1 34 7  27 o 18 30.7215 6.06147 24.0255     9.48904  12.4885     10.7002  9.01858    193.649     22.1615     13.6492     
1 1 1 34 7  28 o 19 60.6359 4.19771 74.7216     10.3712  61.819      13.9405  50.2111    50.5196     14.8833     50.5196     
1 1 1 34 7  29 o 5  30.4892 5.60009 6.61658     8.29123  30.8153     10.6212  18.1069    197.289     1.08428     197.289     
1 1 1 34 7  30 o 8  52.38   4.33027 47.6323     10.1943  55.0498     12.1197  44.4909    223.135     16.8757     223.135     
1 1 1 34 7  31 o 16 76.2957 3.83311 122.664     13.5121  92.5609     15.0561  69.2026    170.578     29.4482     170.578     
1 1 1 34 7  32 o 19 18.3043 5.3868  -7.64511    7.66418  8.61769     9.81466  2.5032     2.80306     6.19455     182.803     
1 1 1 34 7  33 o 1  58.1926 4.25955 66.1219     10.468   60.4291     13.54    33.5759    108.79      15.7366     288.79      
1 1 1 34 7  34 o 11 47.2076 4.87982 34.2643     10.0601  51.9305     12.337   26.3942    115.684     13.3841     295.684     
1 1 1 34 7  35 o 5  26.6126 5.62696 22.4883     8.62386  -0.0545995  10.9983  8.7844     337.797     16.6878     157.797     
1 1 1 34 7  36 o 8  67.7898 3.71606 97.2311     11.4458  73.6971     13.0583  51.1016    199.652     5.58713     199.652     
1 1 1 34 7  37 f 0  40.2779 5.27782 34.406      9.47933  29.4775     10.912   29.9158    22.49       0           0           
1 1 1 34 7  38 o 5  45.9078 4.78723 37.4624     9.87018  44.1889     11.5137  30.154     120.533     3.35421     300.533     
1 1 1 34 7  39 o 3  38.0993 5.74184 31.4249     10.1877  27.4149     11.0646  31.9726    349.03      15.0722     349.03      
1 1 1 34 7  40 o 16 18.8807 5.54412 -5.09373    8.27538  8.97394     9.89165  5.3364     150.465     2.29177     330.465     
1 1 1 34 7  41 o 7  54.5939 4.35011 60.5956     10.6797  53.5651     12.4084  37.4524    5.37657     1.404       185.377     
1 1 1 34 7  42 o 4  22.2437 6.11744 2.6346      9.03375  12.8876     10.9464  9.74168    267.627     2.32088     87.6267     
1 1 1 34 7  43 o 12 60.2178 4.09835 64.7403     11.5501  73.6213     12.8916  36.762     323.743     10.9177     143.743     
1 1 1 34 7  44 o 18 24.6528 6.2491  7.53857     9.18838  16.1016     10.6965  7.6099     113.656     15.0131     293.656     
1 1 1 34 7  45 o 7  19.1671 5.90672 -0.0399479  10.4935  2.33177     10.8368  2.44586    104.37      0.891368    284.37      
1 1 1 34 7  46 o 18 31.3803 6.62658 17.8327     11.1476  25.141      11.4971  18.1492    25.5478     2.3121      205.548     
1 1 1 34 7  47 f 0  24.1835 6.64468 10.194      10.7907  10.8511     12.3059  5.64679    100.016     0           0           
1 1 1 34 7  48 f 0  25.1806 6.81127 11.1349     11.069   13.1827     12.9132  30.0694    275.557     0           0           
1 1 1 34 7  49 o 15 31.3218 7.01009 20.2657     11.6389  23.6062     13.0236  8.46919    282.988     23.6361     102.988     
1 1 1 34 7  50 o 1  36.7045 6.81129 18.0227     13.0908  42.4862     13.7356  21.482     94.3093     4.62427     274.309     
1 1 1 34 7  51 o 7  41.0402 6.51046 44.3975     12.3209  28.874      14.0842  25.4645    165.964     3.42607     345.964     
1 1 1 34 7  52 o 6  18.876  6.00355 6.95415     12.4588  -24.2055    14.2416  4.69043    50.8577     9.80736     230.858     
1 1 1 34 7  53 o 10 28.4395 7.19536 5.75528     14.3216  27.3785     13.9967  17.9584    75.3787     4.12293     75.3787     
1 1 1 34 7  54 o 4  37.2883 7.74335 33.0589     14.8472  34.7481     15.9968  20.5928    32.1277     6.99007     212.128     
1 1 1 34 7  55 o 1  60.5087 5.92886 73.349      16.8456  83.5914     18.1506  48.3752    324.732     15.5744     324.732     
1 1 1 34 7  56 o 13 35.3399 7.2206  56.2419     17.4316  4.50295     15.8568  25.3402    56.7666     9.07047     56.7666     
1 1 1 34 7  57 o 18 30.5057 8.11086 29.63       17.7283  20.9041     16.0213  17.8489    226.911     4.41934     226.911     
1 1 1 34 7  58 o 19 22.086  7.19156 -0.812388   17.6463  5.18017     19.0686  5.94322    236.05      5.53376     56.0496     
1 1 1 34 7  59 f 0  23.9469 7.76961 -20.6274    27.6814  17.5736     19.8283  7.09655    158.004     0           0           
1 1 1 34 7  60 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 8  0  o 4  83.1587 3.19238 124.612     13.2138  124.612     13.2138  94.6845    180         63.6126     180         
1 1 1 34 8  1  o 12 93.6342 3.29377 156.682     15.0001  160.25      15.8107  77.7326    97.6442     16.7018     97.6442     
1 1 1 34 8  2  o 4  33.5194 5.63065 25.9134     9.17365  17.575      9.6275   13.4283    75.5703     17.4048     255.57      
1 1 1 34 8  3  o 6  26.0998 5.67788 19.025      8.56163  4.66393     9.24635  4.7257     162.003     43.8424     162.003     
1 1 1 34 8  4  o 4  42.9366 4.38789 35.4003     9.02616  33.2559     9.28887  9.63243    115.974     42.1622     295.974     
1 1 1 34 8  5  o 11 19.1975 5.35704 5.08589     7.463    3.22891     7.78569  0.246198   62.2165     13.6993     242.217     
1 1 1 34 8  6  o 16 41.1373 4.5088  26.493      8.72027  37.2434     9.13713  22.7332    65.7431     11.3051     245.743     
1 1 1 34 8  7  o 10 49.7807 3.82307 45.9265     9.48898  45.0304     9.2802   28.0702    185.286     14.9721     5.2862      
1 1 1 34 8  8  o 10 18.4852 5.20739 -1.12347    7.5355   6.80607     7.53479  6.69115    260.351     33.3385     260.351     
1 1 1 34 8  9  o 2  40.6186 4.74658 33.7073     9.09156  28.5276     9.48033  2.05695    302.613     54.0143     122.613     
1 1 1 34 8  10 o 19 69.1258 3.21783 86.1425     10.8835  86.9664     11.2845  50.4618    101.838     0.0181626   281.835     
1 1 1 34 8  11 o 17 64.0825 3.52263 72.8833     11.384   76.713      11.0443  55.9013    209.768     19.8875     209.768     
1 1 1 34 8  12 o 3  30.1511 5.66332 18.6417     8.34861  16.5868     9.10027  12.0721    229.064     13.7571     49.0644     
1 1 1 34 8  13 o 14 127.847 2.69621 284.693     16.7944  302.902     17.7198  116.498    219.259     42.7081     219.259     
1 1 1 34 8  14 o 15 19.1802 5.35452 8.85918     8.15461  -4.01218    8.34208  1.37657    312.974     8.1398      132.974     
1 1 1 34 8  15 o 18 42.0831 4.58882 34.34       9.71642  32.2589     9.01892  35.7415    340.706     19.4808     340.706     
1 1 1 34 8  16 o 13 14.1383 4.59132 -2.52814    7.68018  -7.83677    7.26903  0.832629   196.407     3.62593     196.407     
1 1 1 34 8  17 o 17 82.3338 3.2803  134.813     14.0143  111.718     12.9348  73.5459    157.94      26.8696     157.94      
1 1 1 34 8  18 o 2  28.2868 5.91371 17.3851     8.68039  13.4202     9.41383  10.9487    310.192     12.6433     130.192     
1 1 1 34 8  19 o 10 84.6499 3.08694 132.664     12.8103  126.815     13.2705  69.4054    36.0009     14.7799     36.0009     
1 1 1 34 8  20 o 6  35.3995 5.61309 24.7862     9.09042  24.0918     10.3351  23.6792    330.272     13.8629     330.272     
1 1 1 34 8  21 o 1  93.4687 3.0389  158.694     13.785   157.496     14.5917  68.5563    50.4969     0.447793    230.497     
1 1 1 34 8  22 o 12 36.1407 5.27007 25.0569     8.5956   25.4851     9.85035  17.0468    297.39      14.8619     117.39      
1 1 1 34 8  23 o 11 22.308  5.63582 1.44239     7.83701  14.0216     9.0873   4.16448    241.683     16.0248     61.6827     
1 1 1 34 8  24 o 5  24.0222 6.07547 9.72691     8.10003  10.111      10.4726  7.83456    217.905     9.78607     37.9054     
1 1 1 34 8  25 o 5  28.4105 6.25227 17.3306     10.1135  14.0758     9.62316  11.4208    298.807     4.65019     298.807     
1 1 1 34 8  26 o 10 23.8902 5.69244 2.06165     8.17391  17.2485     9.34055  9.00751    170.07      2.90481     350.07      
1 1 1 34 8  27 o 15 17.0933 5.24981 0.931642    7.79203  -1.99155    9.02273  0.401832   248.972     1.95879     68.9721     
1 1 1 34 8  28 o 2  19.2477 5.67918 -1.33928    9.28169  5.41878     9.28121  0.540828   139.508     22.2779     139.508     
1 1 1 34 8  29 o 5  29.4822 6.00237 16.8881     8.63713  17.5773     10.0797  14.6575    102.007     7.93552     282.007     
1 1 1 34 8  30 o 11 20.6142 5.78661 4.19104     8.28614  6.48548     9.54217  5.99872    59.3949     6.66104     239.395     
1 1 1 34 8  31 o 18 41.7146 5.02278 33.9384     9.34433  33.281      10.8331  26.0463    330.377     5.69911     150.377     
1 1 1 34 8  32 o 8  51.7542 4.26191 47.4041     10.2844  53.5323     11.4191  44.9563    139.146     17.6621     139.146     
1 1 1 34 8  33 o 8  23.7939 5.99316 4.38751     8.63617  15.4225     10.0075  9.80739    21.194      8.60227     201.194     
1 1 1 34 8  34 o 8  28.3393 6.18715 14.0202     8.76116  18.5092     10.5895  17.2099    260.264     0.200574    80.2637     
1 1 1 34 8  35 o 12 26.5775 6.30117 12.6577     8.69119  15.3123     11.0997  16.1179    320.209     2.55834     320.209     
1 1 1 34 8  36 o 17 54.0595 4.44018 42.3698     10.4594  71.0704     13.0347  37.4013    326.243     1.65415     146.243     
1 1 1 34 8  37 o 11 36.0389 6.25399 30.8863     9.56769  22.8077     13.3271  17.2915    201.359     14.6161     21.3587     
1 1 1 34 8  38 o 3  46.4305 5.50335 56.1993     10.4139  31.302      12.9215  30.9627    324.974     2.60372     144.974     
1 1 1 34 8  39 o 2  42.0516 5.58845 35.2689     9.99365  36.446      12.6045  24.1748    107.207     9.66107     287.207     
1 1 1 34 8  40 o 7  46.0218 5.27688 42.8085     10.2117  41.9446     13.0309  39.3224    316.587     16.4478     316.587     
1 1 1 34 8  41 o 5  49.1312 4.95806 40.0479     10.4427  56.1727     13.3421  42.6349    109.798     18.4376     109.798     
1 1 1 34 8  42 o 10 18.9521 5.71862 8.51295     9.82819  -14.3711    12.0782  5.05779    22.8648     4.22425     202.865     
1 1 1 34 8  43 o 18 21.785  6.34803 5.11677     10.6606  7.25786     11.72    5.71671    198.047     13.1207     18.0467     
1 1 1 34 8  44 o 8  62.2094 5.11346 73.7758     13.8281  80.5889     17.316   54.0879    300.429     22.4074     300.429     
1 1 1 34 8  45 o 9  18.715  6.11223 -4.68417    11.9483  -5.59886    14.7982  2.24487    232.793     13.1905     52.7926     
1 1 1 34 8  46 o 12 52.8009 5.62084 44.1815     12.7211  71.9081     16.0887  51.6299    108.589     35.0325     108.589     
1 1 1 34 8  47 o 18 19.9052 6.18022 5.06454     11.053   -5.32974    13.4742  5.57445    54.7507     4.58438     234.751     
1 1 1 34 8  48 o 3  26.4114 7.14196 13.31       11.9166  14.4718     14.496   12.7072    176.039     5.57054     356.039     
1 1 1 34 8  49 o 16 33.3224 6.75246 36.4608     12.6629  11.7174     13.7284  23.8115    167.16      6.31391     167.16      
1 1 1 34 8  50 o 5  47.8012 6.25892 44.0161     13.9481  53.7819     14.9352  34.3438    290.75      4.27993     290.75      
1 1 1 34 8  51 o 2  48.5974 6.40155 51.0606     14.289   51.3295     15.7138  41.1306    70.8405     17.893      70.8405     
1 1 1 34 8  52 o 2  22.9613 6.83847 9.68745     12.3564  4.45118     14.8678  10.0401    102.277     2.31856     102.277     
1 1 1 34 8  53 o 11 38.019  7.57174 38.1855     14.1411  32.5435     16.3313  22.9739    334.617     3.20097     154.617     
1 1 1 34 8  54 o 19 23.4499 7.25379 3.75806     17.5349  10.1499     15.2741  9.4076     235.382     0.563579    235.382     
1 1 1 34 8  55 o 3  52.4555 7.80278 84.8154     20.8286  54.8836     19.0925  42.5897    157.059     17.0214     157.059     
1 1 1 34 8  56 o 13 25.3309 7.6757  21.295      18.2935  4.93799     17.11    8.38566    271.496     1.46327     271.496     
1 1 1 34 8  57 o 14 23.3009 7.30561 -1.93245    18.5643  15.1517     16.6863  6.6641     161.942     2.546       341.942     
1 1 1 34 8  58 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 9  0  o 11 15.8681 6.46159 6.00724     8.24434  6.00724     8.24434  15.4742    360         51.9111     360         
1 1 1 34 9  1  o 19 33.0021 5.4894  24.7813     9.18773  17.6893     8.75053  20.1988    152.097     0.18765     332.096     
1 1 1 34 9  2  o 6  37.0113 5.12065 28.5291     9.09519  24.0352     9.20586  19.462     177.047     11.4293     357.047     
1 1 1 34 9  3  o 1  69.0349 3.42867 93.7083     11.5116  80.0259     11.9542  66.6653    333.568     33.6638     333.568     
1 1 1 34 9  4  o 8  29.3312 5.44983 23.7785     8.34067  9.1127      8.91811  13.242     44.0276     9.59964     224.028     
1 1 1 34 9  5  o 15 53.6432 3.97408 56.8332     9.58267  49.3855     11.1898  37.0962    166.298     2.94707     346.298     
1 1 1 34 9  6  o 7  87.774  2.9402  138.436     12.3383  139.754     13.4341  71.1302    261.926     12.0518     261.926     
1 1 1 34 9  7  o 7  64.7564 3.54697 83.8005     11.395   69.607      11.3642  51.0247    115.578     7.73793     115.578     
1 1 1 34 9  8  o 19 55.225  3.87791 57.6408     10.2713  54.6304     10.8712  48.0357    180.032     17.9081     180.032     
1 1 1 34 9  9  o 5  20.7102 5.48602 9.38628     7.69266  2.20824     8.2392   3.33886    352.159     5.31573     172.159     
1 1 1 34 9  10 o 12 57.787  3.44162 56.8944     9.88195  65.1632     9.82071  50.6631    279.501     18.9474     279.501     
1 1 1 34 9  11 o 17 17.1568 5.07168 -2.67122    7.56711  4.37749     7.45363  14.1057    111.239     48.8958     111.239     
1 1 1 34 9  12 o 2  22.8424 5.65823 11.8197     8.27954  5.90674     7.99138  2.25777    197.038     22.4006     17.0381     
1 1 1 34 9  13 o 14 56.0216 3.67834 53.9345     9.83371  61.3921     10.5861  34.6661    86.8643     11.894      266.864     
1 1 1 34 9  14 o 12 31.9661 5.55011 21.1921     8.53129  18.7311     9.15042  17.6613    176.96      9.23024     176.96      
1 1 1 34 9  15 o 7  36.1991 5.20357 20.5875     8.7882   30.4098     9.47638  25.3342    279.655     4.08724     279.655     
1 1 1 34 9  16 o 18 76.4588 3.13706 112.539     11.6654  99.8231     12.1945  64.709     85.3756     17.4424     85.3756     
1 1 1 34 9  17 f 0  43.8742 4.91042 48.6343     9.83574  26.0806     10.2464  25.172     346.022     0           0           
1 1 1 34 9  18 o 16 17.3543 5.29516 -5.36268    7.55833  4.39827     9.52795  0.201206   220.411     13.4888     220.41      
1 1 1 34 9  19 o 7  67.3095 3.44165 84.1761     11.8357  81.3611     11.2253  56.3161    248.617     15.0658     248.617     
1 1 1 34 9  20 o 17 35.8068 5.82062 27.9213     10.4648  22.7334     10.0187  21.4749    286.919     4.63186     106.919     
1 1 1 34 9  21 o 17 14.6524 4.78273 -7.17633    7.94892  -4.22176    8.45685  2.30186    129.536     13.2713     129.536     
1 1 1 34 9  22 o 19 68.9093 3.61163 86.7946     11.9992  87.4356     12.7567  56.509     87.4638     13.0989     87.4638     
1 1 1 34 9  23 o 17 33.7367 5.69392 18.2683     9.40472  26.9059     9.72301  24.1167    66.0908     7.12123     66.0908     
1 1 1 34 9  24 o 9  38.0568 5.39332 27.1163     9.8107   29.4417     10.0457  24.6718    345.251     2.22326     165.251     
1 1 1 34 9  25 o 14 52.7963 4.65368 50.3208     12.2155  55.1149     11.8198  53.5277    301.926     35.7423     301.926     
1 1 1 34 9  26 o 3  56.8774 4.09153 60.1751     11.5599  60.4159     11.4396  49.0685    13.315      17.2756     13.315      
1 1 1 34 9  27 o 17 28.9296 5.37112 0.328971    8.35786  32.1639     10.6621  18.7403    162.39      8.81402     162.39      
1 1 1 34 9  28 o 12 56.1433 4.32532 67.8488     11.2249  51.2357     12.2523  52.5785    282.293     26.0065     282.293     
1 1 1 34 9  29 o 2  90.9124 3.33797 155.571     14.7755  147.487     15.4953  92.0416    117.469     51.939      117.469     
1 1 1 34 9  30 o 7  16.7036 5.22785 -3.63372    8.0087   0.763198    9.28795  2.31727    355.701     9.68342     175.701     
1 1 1 34 9  31 o 12 19.629  5.68079 3.37672     8.27015  4.69363     9.48622  5.60176    264.713     9.44234     84.713      
1 1 1 34 9  32 o 16 72.256  3.46514 96.101      12.0834  96.9924     12.8522  53.9494    32.0831     3.30255     32.0831     
1 1 1 34 9  33 o 8  24.8543 6.18902 10.8027     8.7642   12.7927     10.3866  13.5156    45.2736     1.51703     225.274     
1 1 1 34 9  34 o 11 35.2116 5.83392 28.6275     9.50835  22.2384     10.8387  14.5217    149.425     19.6354     329.425     
1 1 1 34 9  35 o 1  26.7991 6.23492 13.4885     9.08677  15.771      10.301   15.3947    126.293     1.92371     306.293     
1 1 1 34 9  36 o 12 29.4817 6.09555 21.3907     9.11572  14.5246     10.5098  19.6903    79.2613     11.7267     79.2613     
1 1 1 34 9  37 o 18 57.0955 4.14108 63.8798     10.9163  60.6169     12.3216  45.7901    346.155     10.9549     346.155     
1 1 1 34 9  38 o 7  80.5483 3.36845 116.087     12.8614  125.506     14.2131  63.8758    125.442     12.2343     125.442     
1 1 1 34 9  39 o 4  51.9938 4.76915 57.3415     11.8312  49.0038     12.2891  40.7524    215.85      9.06857     215.85      
1 1 1 34 9  40 o 5  53.4903 4.97011 49.6385     12.3502  64.2962     13.5994  54.8745    121.703     38.6928     121.703     
1 1 1 34 9  41 f 0  44.7513 5.87078 50.8068     11.9744  33.0955     13.0328  16.5762    253.882     0           0           
1 1 1 34 9  42 o 7  16.886  5.56622 -7.19659    11.9077  -6.38852    11.1486  0.680324   203.583     18.0516     203.582     
1 1 1 34 9  43 o 10 21.7648 6.13039 15.1603     10.9329  -10.2126    12.537   5.44104    154.622     0.209755    334.622     
1 1 1 34 9  44 o 16 73.316  4.40917 112.958     16.2798  96.0665     15.758   56.7596    136.634     10.4909     136.634     
1 1 1 34 9  45 o 3  53.5733 5.73305 64.6756     13.6681  53.8489     15.6532  47.8701    249.547     23.3043     249.547     
1 1 1 34 9  46 o 12 23.1804 6.44548 -5.08906    12.0419  17.8155     12.3353  9.05034    195.689     8.55        15.6891     
1 1 1 34 9  47 o 12 49.2082 5.96256 54.7031     13.8532  46.8384     14.3872  32.7622    23.3088     2.00401     203.309     
1 1 1 34 9  48 o 9  26.564  7.05694 11.0063     12.6256  18.0614     13.0796  15.3745    53.3378     7.23316     53.3378     
1 1 1 34 9  49 o 16 38.3729 7.91624 28.8006     13.821   44.1315     18.5681  30.9984    214.34      14.0733     214.34      
1 1 1 34 9  50 o 16 26.2197 7.63724 12.0362     14.5528  15.1015     17.8239  14.6564    262.649     5.50195     262.649     
1 1 1 34 9  51 o 16 67.6458 6.5804  122.901     19.5578  80.4352     21.735   52.5626    209.039     12.1329     209.039     
1 1 1 34 9  52 o 12 19.7419 6.50225 0.777787    15.0936  -11.5021    16.8581  5.30935    219.458     2.87777     39.4581     
1 1 1 34 9  53 o 7  20.2595 6.64714 -0.110936   15.2255  -4.62094    17.2213  5.30078    151.502     4.33471     331.502     
1 1 1 34 9  54 o 3  27.5324 8.06192 30.1053     19.2775  6.75654     18.6222  11.7204    303.578     3.81174     303.578     
1 1 1 34 9  55 o 16 22.4121 7.04852 -25.9687    17.9336  22.3057     17.9745  6.28787    308.177     6.59595     128.177     
1 1 1 34 9  56 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 9  57 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 10 0  o 3  70.9773 3.26556 91.3861     11.5011  91.3861     11.5011  39.1316    360         29.4588     180         
1 1 1 34 10 1  o 1  41.4935 4.70999 42.7551     9.2895   23.7364     9.14821  33.8403    53.9978     12.2245     53.9978     
1 1 1 34 10 2  f 0  75.5566 3.15535 102.13      11.5885  105.162     12.1992  54.6385    117.738     0           0           
1 1 1 34 10 3  f 0  60.9024 3.55647 61.7862     11.0155  74.318      10.3301  20.1615    283.747     0           0           
1 1 1 34 10 4  o 10 23.4683 5.54349 15.3101     8.30213  3.2875      8.11636  8.14489    233.261     5.60861     53.2607     
1 1 1 34 10 5  o 13 101.767 2.7924  174.352     14.4768  199.767     13.8459  97.4945    91.3434     43.2758     91.3434     
1 1 1 34 10 6  o 5  94.3559 2.83556 165.68      13.7704  155.94      12.9877  90.5124    69.2135     40.8304     69.2135     
1 1 1 34 10 7  o 15 95.0147 2.90922 155.241     13.9053  171.334     13.695   76.8567    277.654     11.8854     277.654     
1 1 1 34 10 8  o 13 39.1302 5.11023 25.3517     9.41537  33.7885     9.85927  17.9928    9.78728     19.0919     189.787     
1 1 1 34 10 9  o 5  19.2223 5.43514 6.44032     7.70217  0.613736    8.53781  1.27013    234.737     15.7971     54.7374     
1 1 1 34 10 10 o 6  22.2831 5.7606  8.57595     7.99194  7.59712     8.80856  5.10523    86.1263     13.8727     266.126     
1 1 1 34 10 11 o 8  27.7702 5.85707 15.5065     8.33649  14.4505     9.23735  8.40519    59.6542     19.1474     239.654     
1 1 1 34 10 12 o 7  37.0627 5.26835 23.1459     9.0998   30.3131     9.80746  10.2218    267.255     31.9803     87.2551     
1 1 1 34 10 13 o 10 32.9419 5.646   22.5436     8.56212  20.0817     9.93518  20.7586    108.652     0.56113     288.652     
1 1 1 34 10 14 f 0  64.1852 3.61656 79.5713     10.7305  71.7037     12.1713  36.1444    343.11      0           0           
1 1 1 34 10 15 o 19 59.1196 3.87373 73.9155     10.4323  55.7557     11.7664  31.3622    255.981     23.9622     75.9815     
1 1 1 34 10 16 o 16 66.4878 3.52127 77.8625     11.5048  84.2207     11.7853  44.9338    276.449     7.78544     96.4492     
1 1 1 34 10 17 o 4  41.1138 4.95721 26.2874     9.71337  39.0979     9.77917  29.3957    81.5782     2.17826     81.5782     
1 1 1 34 10 18 f 0  22.824  5.69209 13.8965     8.27773  1.5311      9.37014  26.2254    188.748     0           0           
1 1 1 34 10 19 o 15 90.8217 3.2022  162.476     14.2649  138.338     14.6759  70.9945    55.5228     7.44748     55.5229     
1 1 1 34 10 20 o 7  17.6707 5.29867 5.2056      7.78411  -8.03343    9.91734  0.684988   259.188     15.5764     79.1885     
1 1 1 34 10 21 o 1  56.8995 3.79542 53.505      10.2208  66.7393     11.1459  36.3258    267.581     10.1193     87.5809     
1 1 1 34 10 22 f 0  25.4996 6.018   14.1307     8.63232  10.1699     9.64151  23.4069    153.049     0           0           
1 1 1 34 10 23 o 3  22.6693 5.88843 10.691      8.50151  6.03381     9.3284   7.47564    56.9785     11.853      236.979     
1 1 1 34 10 24 o 7  59.3842 3.94522 59.4665     11.2813  72.2657     11.8835  34.6969    181.945     17.2979     1.94506     
1 1 1 34 10 25 o 16 52.7022 4.57248 59.0623     12.2707  46.9491     11.3326  45.6875    194.337     16.3017     194.337     
1 1 1 34 10 26 o 15 19.7268 5.81483 3.71822     9.25924  2.65233     9.84876  2.50055    160.123     0.042615    340.123     
1 1 1 34 10 27 o 3  45.5627 5.17016 40.506      10.8605  40.6702     11.9222  36.9172    173.814     9.95298     173.814     
1 1 1 34 10 28 o 10 31.5547 6.12332 16.6509     9.78387  24.439      10.3563  23.9858    214.795     9.09049     214.795     
1 1 1 34 10 29 o 16 26.2122 6.41667 9.08879     11.027   16.9495     10.1018  15.524     251.868     0.120306    251.868     
1 1 1 34 10 30 o 17 25.4221 6.36518 11.0627     9.56938  13.8971     10.7163  10.5655    230.171     11.3062     50.1705     
1 1 1 34 10 31 o 10 19.012  5.696   0.441406    8.96855  4.39405     9.8638   5.34574    296.964     1.08753     116.964     
1 1 1 34 10 32 o 1  40.0572 5.49545 34.9607     9.79201  29.9446     11.3669  32.7132    240.061     10.9897     240.061     
1 1 1 34 10 33 f 0  50.7357 4.51952 49.3658     10.6757  50.3434     11.7686  19.7506    344.027     0           0           
1 1 1 34 10 34 o 10 21.6222 5.96574 11.5527     8.99119  -0.182154   11.0982  6.11063    80.7926     13.8107     260.793     
1 1 1 34 10 35 o 17 35.6282 6.1522  23.0104     10.8857  31.0054     11.0195  18.129     255.349     12.5227     75.3486     
1 1 1 34 10 36 o 10 73.6358 4.12847 88.5954     14.028   119.81      16.1744  62.5041    246.243     19.3559     246.243     
1 1 1 34 10 37 o 12 24.7952 6.56979 6.50018     10.7743  16.5213     11.7447  11.1502    57.219      4.13636     57.219      
1 1 1 34 10 38 o 6  77.6122 3.92842 120.303     14.4829  108.845     15.7245  64.9966    300.416     18.9492     300.416     
1 1 1 34 10 39 o 18 27.0202 7.04058 14.9046     11.0783  15.3745     14.1831  14.7494    51.6511     1.04018     231.651     
1 1 1 34 10 40 o 2  23.7294 6.7871  9.51228     13.1679  8.9275      11.8519  4.70561    172.201     1.34623     172.201     
1 1 1 34 10 41 o 17 27.0733 6.66462 24.7885     12.2844  3.4849      12.2611  15.1399    87.1807     1.94608     87.1807     
1 1 1 34 10 42 o 9  34.4264 7.02624 28.5775     12.6518  25.1622     13.0044  7.81388    254.799     31.0644     74.7988     
1 1 1 34 10 43 f 0  23.1965 6.80993 8.27584     12.2887  7.01265     13.7979  5.71043    254.666     0           0           
1 1 1 34 10 44 f 0  53.654  5.9618  53.5345     14.0322  67.3222     17.0142  37.3929    340.148     0           0           
1 1 1 34 10 45 o 14 43.0644 6.76344 39.292      13.9107  42.737      14.5281  40.2705    123.176     25.5204     123.176     
1 1 1 34 10 46 o 11 29.6541 7.26026 8.5738      12.712   31.0992     15.1148  20.9498    275.238     8.50515     275.238     
1 1 1 34 10 47 o 14 31.3455 7.67331 33.8707     15.7896  12.06       15.5499  15.5526    355.135     9.39655     175.135     
1 1 1 34 10 48 o 11 25.8776 7.25842 24.7491     15.5805  -2.48277    15.1972  14.7289    129.515     0.618561    129.514     
1 1 1 34 10 49 o 5  37.3708 7.55047 18.7376     16.4612  51.2173     16.3802  29.8869    25.0553     13.5532     25.0552     
1 1 1 34 10 50 o 2  25.8632 7.54251 14.9289     15.8034  13.9487     15.8437  8.35835    137.9       3.84208     137.9       
1 1 1 34 10 51 o 15 22.6906 7.0266  -1.03067    16.1481  13.1153     15.2349  8.49995    21.6446     4.04137     201.645     
1 1 1 34 10 52 o 12 23.002  7.16206 9.75781     15.9073  6.43567     16.2143  6.0171     64.2502     0.0136081   64.2484     
1 1 1 34 10 53 o 19 50.1435 7.91593 61.141      19.075   71.208      19.7406  44.9771    44.3392     28.1776     44.3392     
1 1 1 34 10 54 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 10 55 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 11 0  f 0  99.3127 2.88304 177.326     14.2937  177.326     14.2937  58.6611    180         0           0           
1 1 1 34 11 1  o 18 15.8347 4.9647  -1.1267     7.95903  -2.60364    7.7144   0.509377   143.263     10.2176     143.263     
1 1 1 34 11 2  o 18 44.9105 4.31082 33.4822     9.39324  42.5124     9.37205  34.4005    143.872     5.4686      143.872     
1 1 1 34 11 3  o 19 20.0723 5.45883 1.73477     8.01817  8.53432     7.89222  4.3428     51.349      33.6376     51.349      
1 1 1 34 11 4  o 12 84.3391 2.96516 129.81      12.4506  128.084     12.5345  80.8806    324.423     36.573      324.423     
1 1 1 34 11 5  o 15 58.0827 3.57322 60.5005     10.3238  63.5226     10.2635  46.1912    292.734     7.65224     292.734     
1 1 1 34 11 6  o 14 26.4976 5.71554 11.845      8.28984  15.332      8.35225  2.89322    125.529     42.1555     125.529     
1 1 1 34 11 7  o 19 90.2437 3.07647 149.787     14.7126  146.021     12.9939  88.0583    81.2128     41.9289     81.2128     
1 1 1 34 11 8  o 9  22.8324 5.87635 10.3426     9.23037  7.23395     8.21235  8.25955    359.838     4.35969     179.838     
1 1 1 34 11 9  o 14 50.0077 4.03957 49.8228     10.1793  43.4577     9.6932   41.7724    256.016     12.2678     256.016     
1 1 1 34 11 10 o 13 79.9367 3.24093 116.785     12.8351  116.186     13.0207  66.4737    108.839     14.1647     108.839     
1 1 1 34 11 11 o 13 20.6078 5.66814 6.76368     8.64326  4.83418     8.18636  1.23668    74.5762     21.9116     254.576     
1 1 1 34 11 12 o 17 23.6755 5.8578  7.64273     8.78647  12.1458     8.5514   10.1637    183.574     3.51918     3.57392     
1 1 1 34 11 13 o 4  19.1432 5.47189 5.72657     8.13983  1.52507     8.27721  3.94737    141.405     4.99861     321.405     
1 1 1 34 11 14 o 4  119.159 2.85497 262.259     16.4902  252.039     17.5137  107.354    108.706     36.1183     108.706     
1 1 1 34 11 15 o 17 16.7601 5.31252 -5.37352    8.12403  0.0881658   10.23    0.824712   332.421     18.453      332.421     
1 1 1 34 11 16 o 10 44.8503 4.66195 32.875      9.55609  44.2341     10.7427  37.1603    102.538     11.2922     102.538     
1 1 1 34 11 17 o 18 38.3701 5.45633 26.6201     9.61928  31.4744     10.6502  26.4415    159.879     0.397998    339.879     
1 1 1 34 11 18 o 2  27.7834 6.08831 19.6924     9.39841  10.3008     9.96397  8.24841    319.56      21.0695     139.56      
1 1 1 34 11 19 o 9  53.6376 4.10061 60.5396     10.403   47.712      11.0224  32.9153    210.193     12.6112     30.1931     
1 1 1 34 11 20 o 1  64.7824 3.61562 86.5378     11.1537  69.2063     11.8882  54.9517    141.417     14.9521     141.417     
1 1 1 34 11 21 o 5  28.9767 5.92465 19.4387     8.82847  14.2885     9.57994  2.36763    304.404     35.8395     124.404     
1 1 1 34 11 22 o 1  19.5031 5.65    2.20605     8.22436  5.61078     9.39573  1.89856    95.4692     28.7213     95.4692     
1 1 1 34 11 23 o 5  19.0417 5.5188  7.3854      8.32261  -3.10512    9.46992  3.38247    121.73      15.3064     301.73      
1 1 1 34 11 24 o 8  44.8696 4.78254 38.071      9.93495  40.0514     10.8988  14.8023    353.797     35.5779     173.797     
1 1 1 34 11 25 o 10 31.502  5.72862 28.978      9.20566  11.145      10.3491  14.8159    239.711     13.7232     59.7105     
1 1 1 34 11 26 o 15 19.7836 5.78746 5.62157     8.51885  1.44885     10.4688  7.40969    144.897     3.21193     324.897     
1 1 1 34 11 27 f 0  15.8818 5.10374 0.249184    8.5128   -10.5947    9.92595  27.6225    348.663     0           0           
1 1 1 34 11 28 o 18 47.4936 4.71472 42.9177     10.2689  45.0592     11.5355  39.8331    66.8637     12.4674     66.8637     
1 1 1 34 11 29 o 17 27.058  6.36571 15.309      9.68109  14.803      10.539   9.70631    21.0048     16.6119     201.005     
1 1 1 34 11 30 o 11 17.7635 5.65524 -0.104833   10.7545  -4.8219     10.495   4.36861    63.9431     7.22941     243.943     
1 1 1 34 11 31 o 10 19.7298 5.91781 8.10281     10.687   -4.41582    10.4604  6.75741    243.905     6.12571     63.905      
1 1 1 34 11 32 o 14 40.1648 6.62016 41.0205     12.9394  29.1613     13.4231  23.3894    11.6836     9.20503     191.684     
1 1 1 34 11 33 o 12 17.6724 5.6795  4.36675     11.4411  -23.1459    12.8438  2.37979    329.725     1.40194     149.725     
1 1 1 34 11 34 f 0  55.3545 5.12142 62.1187     13.8307  60.461      13.8979  38.5035    53.1302     0           0           
1 1 1 34 11 35 o 8  65.0732 4.92846 83.6313     15.8305  84.2086     15.8133  40.6213    79.1        12.4584     259.1       
1 1 1 34 11 36 o 2  29.9965 6.74068 27.3683     11.8791  11.3387     12.3783  13.97      127.573     11.0589     307.573     
1 1 1 34 11 37 o 7  29.1037 6.94927 12.452      11.9908  24.7095     12.7267  17.7847    349.492     1.57323     349.492     
1 1 1 34 11 38 o 17 54.4164 5.61006 75.9093     13.7745  47.0565     14.7403  47.7045    26.0141     20.1865     26.0141     
1 1 1 34 11 39 o 18 27.3336 6.95177 7.73158     12.6149  22.9231     12.8789  15.4165    266.081     0.478813    86.0811     
1 1 1 34 11 40 o 1  34.6934 7.08602 21.3726     12.5326  33.954      13.8409  27.4186    134.157     16.8964     134.157     
1 1 1 34 11 41 f 0  25.459  6.78883 -0.590535   12.8982  22.104      13.1519  15.3217    293.092     0           0           
1 1 1 34 11 42 o 2  99.5852 4.30032 181.902     20.1323  202.081     22.595   91.371     97.2946     40.1124     97.2946     
1 1 1 34 11 43 o 10 25.0394 7.37754 9.39556     15.0111  11.3082     15.6956  13.9783    246.792     4.67211     246.792     
1 1 1 34 11 44 f 0  41.5836 8.14301 48.0624     18.2229  37.881      16.9973  19.9303    296.34      0           0           
1 1 1 34 11 45 f 0  25.7077 7.44318 9.07761     15.6946  15.9941     15.1296  22.9087    91.5321     0           0           
1 1 1 34 11 46 o 18 19.7905 6.37033 -16.8576    15.3296  6.82652     14.144   6.85009    128.042     0.972625    308.042     
1 1 1 34 11 47 o 3  25.7582 7.51766 18.3242     16.4802  9.24924     15.1434  14.1653    211.609     1.11065     211.609     
1 1 1 34 11 48 o 10 22.6063 7.10216 2.37165     16.2543  8.89977     16.1213  6.49411    4.50002     1.15032     4.50002     
1 1 1 34 11 49 o 2  30.8234 7.96555 34.9124     16.7034  16.593      16.8497  19.441     231.64      8.24151     231.64      
1 1 1 34 11 50 o 10 24.0874 7.37496 10.9285     16.4564  11.8838     16.3313  9.49195    335.502     2.02262     155.502     
1 1 1 34 11 51 o 7  32.0329 8.1628  39.9712     17.6553  20.0335     17.3341  13.4474    164.383     12.733      344.383     
1 1 1 34 11 52 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 11 53 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 12 0  o 9  48.2501 4.13557 43.9025     9.6093   43.9025     9.6093   28.8673    360         15.7771     180         
1 1 1 34 12 1  o 16 42.125  4.91177 34.2329     9.95976  34.0867     10.0556  36.8779    217.004     15.5591     217.004     
1 1 1 34 12 2  o 7  43.48   4.53753 37.1742     9.77515  34.7557     9.40625  26.7106    76.7902     9.45017     256.79      
1 1 1 34 12 3  o 10 31.3311 5.63103 17.8299     8.8034   21.2992     8.949    20.0177    133.66      1.35193     313.66      
1 1 1 34 12 4  o 2  66.6504 3.45059 81.6763     11.0742  81.5642     11.8022  68.0479    138.533     38.4648     138.533     
1 1 1 34 12 5  o 18 49.973  4.02876 44.6144     9.85884  48.8286     9.94384  36.098     20.5843     0.728966    200.584     
1 1 1 34 12 6  o 14 46.9296 4.25664 37.9346     9.6843   45.2228     9.81214  46.0278    216.199     38.4733     216.199     
1 1 1 34 12 7  o 5  45.4987 4.32301 36.5444     9.59078  41.7961     9.57865  27.4329    130.31      11.386      310.31      
1 1 1 34 12 8  o 16 21.3499 5.55835 2.11395     8.19571  11.4884     8.21985  5.38227    143.35      15.003      323.35      
1 1 1 34 12 9  o 4  19.1118 5.61847 2.93171     9.34019  2.89529     8.4098   4.78062    244.492     2.86193     64.4917     
1 1 1 34 12 10 o 19 81.7455 3.01911 122.969     12.2946  120.617     12.3542  69.7323    299.208     17.2283     299.208     
1 1 1 34 12 11 o 19 23.6172 5.83725 10.083      8.34855  10.3368     8.66731  11.7712    86.7829     2.23609     86.7829     
1 1 1 34 12 12 o 18 20.6391 5.68893 4.39517     8.71921  7.39138     8.35179  7.79472    252.846     1.60743     72.8463     
1 1 1 34 12 13 o 5  38.7615 5.25458 33.5582     9.90105  25.806      9.74377  36.8471    271.638     25.5394     271.638     
1 1 1 34 12 14 o 11 40.8778 5.46697 31.8084     10.6456  34.4554     10.9335  34.5419    334.385     12.1057     334.385     
1 1 1 34 12 15 o 10 19.2749 5.60495 5.57964     9.09287  1.47247     8.39575  4.3238     348.907     13.4916     168.907     
1 1 1 34 12 16 o 15 113.714 2.88708 239.771     16.5329  231.295     16.3179  98.022     307.253     25.2885     307.253     
1 1 1 34 12 17 o 6  18.7504 5.54741 6.6144      9.33767  -2.70193    8.63014  2.5759     77.9056     29.1581     77.9056     
1 1 1 34 12 18 o 15 43.0348 4.82982 41.0778     9.77931  31.2512     10.1486  36.5345    162.484     12.3132     162.484     
1 1 1 34 12 19 o 14 63.2753 3.70915 72.932      11.1059  76.6008     12.1989  49.9777    350.378     6.66205     350.378     
1 1 1 34 12 20 o 14 21.6644 5.59709 13.5977     8.54545  -0.0707462  8.77351  9.53652    90.0651     5.85784     270.065     
1 1 1 34 12 21 o 9  25.5955 5.89662 17.2776     8.86988  8.23204     9.14975  9.73494    66.6055     14.5565     246.606     
1 1 1 34 12 22 o 8  56.9151 4.12379 69.327      10.82    54.1351     11.9565  47.3188    69.9377     11.6485     69.9377     
1 1 1 34 12 23 o 17 44.3385 4.96342 37.4382     10.0768  40.1672     11.2417  31.5918    72.349      0.383479    252.349     
1 1 1 34 12 24 o 12 46.782  4.73132 38.769      10.3253  47.0385     11.2163  28.3265    142.501     11.093      322.501     
1 1 1 34 12 25 o 7  37.4409 5.61916 29.3317     9.74668  28.2163     10.6807  30.9722    111.517     11.1363     111.517     
1 1 1 34 12 26 o 12 38.156  6.16897 30.1121     10.8227  31.4288     12.2572  32.2343    28.4782     13.1285     28.4782     
1 1 1 34 12 27 o 10 28.4677 6.77552 19.9421     9.57832  12.3095     14.9747  9.27827    132.091     20.0764     312.091     
1 1 1 34 12 28 o 17 22.0923 6.36734 12.4545     11.0642  -3.66747    12.9606  5.71301    188.129     16.1163     8.12895     
1 1 1 34 12 29 o 13 36.3133 6.84679 29.0489     11.5998  29.3889     13.8475  18.2521    84.8124     14.0327     264.812     
1 1 1 34 12 30 o 1  60.5277 4.75698 68.7331     13.9127  75.6146     14.4526  36.1454    247.095     15.7525     67.0948     
1 1 1 34 12 31 o 4  28.8092 7.10909 20.151      11.8603  15.6943     13.7438  18.0825    201.904     1.19979     201.904     
1 1 1 34 12 32 o 3  47.2567 6.35136 42.0389     12.9958  54.0245     16.0316  42.3749    198.432     20.0275     198.432     
1 1 1 34 12 33 o 3  34.4753 6.74864 16.9537     12.1443  36.7334     13.0774  22.4292    190.863     0.636225    10.8628     
1 1 1 34 12 34 o 11 19.9511 6.25639 0.94043     12.7009  0.481491    12.1826  5.23161    238.554     8.71265     58.5545     
1 1 1 34 12 35 o 9  21.573  6.56598 7.04481     13.3075  1.43513     12.4494  5.87719    256.077     12.1088     76.0772     
1 1 1 34 12 36 o 16 53.9522 5.78835 61.1869     15.2892  60.1196     15.0304  49.366     254.923     23.8222     254.923     
1 1 1 34 12 37 o 18 19.277  6.11505 5.098       12.9356  -9.12831    12.1375  2.58724    159.613     16.7746     339.613     
1 1 1 34 12 38 o 18 56.2976 5.85564 62.7141     15.7517  69.6349     16.2897  51.4463    252.31      24.1127     252.31      
1 1 1 34 12 39 o 11 61.591  5.9762  86.4542     17.9872  72.8565     17.7962  63.7783    358.195     41.8655     358.195     
1 1 1 34 12 40 f 0  26.3898 7.37246 7.36149     14.9272  19.2455     14.6471  11.704     167.129     0           0           
1 1 1 34 12 41 o 5  50.9373 7.44108 63.913      18.8705  56.3951     17.8741  45.7301    248.741     21.6392     248.741     
1 1 1 34 12 42 o 10 27.7295 7.6604  21.2872     15.9318  12.9385     15.0976  4.18184    168.209     2.76783     168.209     
1 1 1 34 12 43 o 13 24.714  7.37496 7.40886     15.2376  13.731      16.1343  10.3192    128.331     9.64511     308.331     
1 1 1 34 12 44 o 1  23.142  7.16017 5.24774     16.1702  8.27828     15.4905  11.189     129.554     1.74501     309.554     
1 1 1 34 12 45 o 8  21.0128 6.69283 10.3796     15.6549  -9.7252     14.9664  7.74802    326.639     4.67738     146.639     
1 1 1 34 12 46 o 5  24.5899 7.31701 20.7602     15.9823  0.706171    16.2477  11.7798    298.046     0.525023    118.046     
1 1 1 34 12 47 o 11 43.9229 8.19141 57.2242     18.4216  48.1395     18.2966  33.422     357.377     9.50336     357.377     
1 1 1 34 12 48 f 0  21.0737 6.79348 -7.93732    16.8693  9.90258     15.8861  15.8822    90.6909     0           0           
1 1 1 34 12 49 o 4  24.4131 7.39746 4.8667      16.8575  19.578      16.3799  4.31002    307.861     0.695048    307.861     
1 1 1 34 12 50 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 13 0  o 12 58.0311 3.75435 62.4543     10.6972  62.4543     10.6972  41.7755    180         5.04227     360         
1 1 1 34 13 1  o 17 61.6051 3.70886 65.6836     11.0014  75.8177     11.674   53.4194    126.32      15.3495     126.32      
1 1 1 34 13 2  o 6  41.2345 4.94527 33.4226     9.90487  32.9411     9.80381  29.3157    213.34      0.819375    33.3396     
1 1 1 34 13 3  o 8  60.7332 3.66491 63.6358     11.1264  73.7834     10.8899  45.794     284.02      1.05478     284.02      
1 1 1 34 13 4  o 11 25.5446 5.60408 4.28055     8.73302  19.9651     8.72999  11.9796    74.7415     9.68672     254.741     
1 1 1 34 13 5  o 13 42.4518 4.81775 26.43       9.66618  44.5719     9.67436  32.9273    164.359     4.78378     164.359     
1 1 1 34 13 6  o 10 52.6923 4.00181 48.9495     10.3494  55.7071     10.4147  48.7276    319.208     20.5939     319.208     
1 1 1 34 13 7  o 6  69.6516 3.37503 95.4675     11.8469  83.8718     11.5492  49.5042    295.923     5.47284     115.923     
1 1 1 34 13 8  o 6  27.4708 5.87603 9.95279     9.26304  20.0785     8.99015  16.3455    60.9569     9.58984     60.9569     
1 1 1 34 13 9  o 19 30.8164 5.7178  17.3253     8.96677  21.4218     8.97606  23.6652    153.981     7.59449     153.981     
1 1 1 34 13 10 o 8  33.0061 5.63786 24.7223     9.19949  19.6485     9.30493  27.8585    78.4871     13.4595     78.4871     
1 1 1 34 13 11 o 12 33.5713 5.28502 9.53064     9.35831  37.039      9.33292  18.6769    29.1171     10.0895     209.117     
1 1 1 34 13 12 o 1  56.7788 3.84555 58.1458     10.8131  63.0975     10.7847  58.5736    51.655      34.7851     51.655      
1 1 1 34 13 13 o 6  62.7683 3.81332 73.677      11.6424  74.2234     12.1112  57.0795    314.099     21.3758     314.099     
1 1 1 34 13 14 o 18 51.8474 4.12928 50.8738     10.655   51.4064     10.4264  41.5863    219.465     7.1694      219.465     
1 1 1 34 13 15 o 16 84.0332 3.24684 133.517     12.9999  127.371     14.1738  70.7535    135.168     15.6073     135.168     
1 1 1 34 13 16 o 1  35.2317 5.8283  34.7122     10.7193  17.4477     9.96623  27.9142    92.265      7.64157     92.265      
1 1 1 34 13 17 o 17 28.3498 6.14742 13.5802     9.5176   19.8939     9.81315  16.9724    61.7136     3.67624     241.714     
1 1 1 34 13 18 o 5  29.635  6.30409 20.4078     9.69438  16.5338     10.7432  22.7956    247.125     11.4886     247.125     
1 1 1 34 13 19 o 17 29.5589 6.26032 22.5675     10.1316  14.249      10.2687  20.4676    146.209     2.57687     146.209     
1 1 1 34 13 20 o 10 14.4742 4.76606 -3.85999    8.54265  -8.25748    8.35235  0.751758   290.292     10.0847     110.292     
1 1 1 34 13 21 o 5  20.4212 5.65316 11.3375     9.01552  -1.11832    8.92205  5.74246    195.779     13.32       15.7789     
1 1 1 34 13 22 o 19 38.9399 5.63348 32.4033     9.86197  30.2216     11.3479  28.4907    226.394     2.29464     226.394     
1 1 1 34 13 23 o 11 41.4286 5.17001 34.9192     10.1985  34.413      10.4803  31.9924    262.877     5.47089     262.877     
1 1 1 34 13 24 o 3  18.1061 5.65073 -1.60945    10.475   1.2634      9.6725   3.13711    286.718     13.8079     106.718     
1 1 1 34 13 25 o 6  44.4303 5.72481 42.0547     12.4518  39.8091     12.1039  43.6675    182.244     27.3004     182.244     
1 1 1 34 13 26 f 0  39.9929 6.43149 42.3034     13.8424  27.7405     11.4905  31.3532    334.336     0           0           
1 1 1 34 13 27 o 2  46.9924 5.91586 41.6441     13.3669  51.0358     13.4041  35.5294    341.184     4.2991      341.184     
1 1 1 34 13 28 o 1  24.9712 6.95462 7.11729     13.8259  14.8523     12.3351  13.0395    16.1023     1.89156     196.102     
1 1 1 34 13 29 o 9  29.1523 5.9352  -6.04393    11.8797  36.0901     12.3008  17.1007    263.154     3.21114     83.1536     
1 1 1 34 13 30 o 6  35.6445 6.76881 34.9841     12.4939  22.288      12.7401  16.3996    62.4168     16.4487     242.417     
1 1 1 34 13 31 o 10 19.9695 6.46681 -17.6514    10.8966  11.9605     17.587   3.97987    275.315     1.53144     95.3153     
1 1 1 34 13 32 o 1  30.3413 7.44816 20.7604     12.3224  21.6936     15.5246  18.7709    4.0461      0.168652    184.046     
1 1 1 34 13 33 o 7  21.7663 6.54183 11.5517     12.213   -7.81449    14.8968  8.88736    350.702     3.3269      170.702     
1 1 1 34 13 34 o 14 34.8655 7.59461 25.7341     12.7695  32.3453     16.4108  22.521     66.0076     1.46137     246.008     
1 1 1 34 13 35 o 15 20.8983 6.67553 -18.8087    13.5756  12.0086     17.1584  5.9095     87.1616     12.7799     267.162     
1 1 1 34 13 36 o 19 30.8908 8.15508 20.6725     15.483   24.9477     18.4269  13.1481    317.013     15.2216     137.013     
1 1 1 34 13 37 o 7  25.5579 7.37026 13.9969     15.1613  10.1463     14.6636  14.8963    179.331     0.205372    359.331     
1 1 1 34 13 38 o 12 46.9056 7.84859 80.6001     20.5891  30.3139     18.0205  29.7291    117.65      6.42427     297.65      
1 1 1 34 13 39 o 9  39.3771 8.51574 31.0987     20.4048  50.4644     18.2524  34.2551    207.833     18.2959     207.833     
1 1 1 34 13 40 o 3  21.4582 6.86591 -23.3078    19.3941  10.7695     15.7537  9.75731    188.864     0.969757    8.8638      
1 1 1 34 13 41 o 19 29.2733 8.38496 23.0551     20.8818  20.7145     17.4549  18.3276    81.4176     9.98182     81.4176     
1 1 1 34 13 42 o 18 22.5518 7.16956 -11.7955    20.1889  12.2513     16.2086  6.3868     263.975     14.256      83.9753     
1 1 1 34 13 43 o 7  28.4148 8.31885 16.1626     21.5147  25.682      18.2598  16.6815    310.913     6.27386     310.913     
1 1 1 34 13 44 o 8  29.6907 8.32223 20.3679     18.8417  30.2732     18.4713  17.6179    44.1853     7.41556     44.1853     
1 1 1 34 13 45 f 0  36.0045 8.8493  38.0567     18.6284  43.812      20.4469  18.8218    151.938     0           0           
1 1 1 34 13 46 o 15 19.9616 6.61338 -9.41457    16.6938  3.91358     16.8394  4.19338    241.527     5.82788     61.5273     
1 1 1 34 13 47 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 13 48 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 14 0  o 16 77.743  3.26728 110.411     12.6255  110.411     12.6255  48.5831    1.43982e-05 21.7698     180         
1 1 1 34 14 1  o 2  51.8139 4.12786 56.0067     10.4867  46.6253     10.4824  31.6977    4.21422     13.8546     184.214     
1 1 1 34 14 2  o 1  37.2303 5.44865 24.3043     9.57032  32.2065     10.1142  26.3763    117.996     0.404516    297.995     
1 1 1 34 14 3  o 12 42.1422 5.00267 37.3754     10.1955  33.08       10.163   34.5406    94.7265     8.37502     94.7265     
1 1 1 34 14 4  o 15 76.4464 3.26819 98.1469     12.3949  118.789     12.4357  68.4294    287.069     21.8286     287.069     
1 1 1 34 14 5  o 5  32.5283 5.74386 25.8096     9.39027  18.1466     9.45286  27.6843    147.038     18.5148     147.038     
1 1 1 34 14 6  o 9  51.574  4.12561 56.0899     10.4351  45.7708     10.404   42.1504    188.626     8.16683     188.626     
1 1 1 34 14 7  o 18 18.2704 5.42635 -0.679333   8.47989  5.2551      8.59261  6.19308    146.137     3.85034     326.137     
1 1 1 34 14 8  o 19 48.531  4.34032 44.5282     10.3028  46.3554     10.3341  44.5855    207.575     18.6652     207.575     
1 1 1 34 14 9  o 13 26.6418 6.0361  15.4711     9.06762  13.7807     9.19632  17.3789    21.519      1.11679     21.5191     
1 1 1 34 14 10 o 9  19.7301 5.59793 7.75948     8.58492  1.99877     8.56251  6.66264    119.515     9.65275     299.515     
1 1 1 34 14 11 o 18 38.8581 5.20004 38.4324     9.81449  23.194      9.58406  33.6574    241.239     12.9525     241.239     
1 1 1 34 14 12 o 3  37.1053 5.82013 33.2475     10.2785  24.2617     10.8827  29.8042    133.389     7.89797     133.389     
1 1 1 34 14 13 o 13 19.121  5.60298 6.66474     9.03114  0.255139    8.83017  5.78697    307.331     0.388406    127.331     
1 1 1 34 14 14 o 13 25.3806 5.97143 16.9945     9.08232  8.85479     9.20893  10.8704    116.346     12.0471     296.346     
1 1 1 34 14 15 o 4  54.8374 4.31853 62.5608     11.9609  53.9494     11.355   54.3213    194.006     29.0284     194.006     
1 1 1 34 14 16 o 17 19.4483 5.4941  12.4917     9.58776  -8.41897    8.82135  6.85099    352.01      0.775086    172.01      
1 1 1 34 14 17 o 10 18.1438 5.52874 4.42754     9.29076  -2.08203    9.22824  1.83134    164.541     0.277417    344.541     
1 1 1 34 14 18 o 19 34.9736 6.15872 25.6011     10.4312  26.9346     11.076   25.2127    332.742     2.20911     332.742     
1 1 1 34 14 19 o 13 30.4602 6.56579 28.3535     11.5032  11.6125     11.8388  20.4935    313.681     0.836285    313.681     
1 1 1 34 14 20 o 15 64.5302 4.55551 84.7449     15.6749  78.2937     13.3528  69.2202    204.022     44.8623     204.022     
1 1 1 34 14 21 o 7  42.4583 6.23163 44.7724     13.9445  32.9242     11.7633  31.0484    277.254     1.76491     277.254     
1 1 1 34 14 22 o 8  23.5317 6.54509 10.6285     12.0874  9.01255     10.5308  7.72897    151.102     14.3867     331.102     
1 1 1 34 14 23 o 12 23.979  6.58267 13.1645     12.2605  8.27937     10.3862  4.28522    39.8494     23.0273     219.849     
1 1 1 34 14 24 o 12 27.2501 6.68741 22.5177     12.3573  9.52904     10.5299  14.9731    37.5095     4.22278     217.51      
1 1 1 34 14 25 o 2  26.5121 6.8049  16.0006     12.5427  13.8855     10.7944  11.1827    47.3477     5.54676     47.3477     
1 1 1 34 14 26 o 5  22.6772 6.48292 -2.87681    14.3882  13.4683     10.751   9.77264    180.516     3.6081      0.516304    
1 1 1 34 14 27 o 12 20.4342 6.24829 6.9453      12.0989  -1.35946    11.6549  6.31371    277.492     7.34314     97.4916     
1 1 1 34 14 28 o 15 23.0064 6.49914 4.74773     11.56    12.5748     11.4776  10.1546    279.852     4.75673     99.8524     
1 1 1 34 14 29 o 17 16.8378 5.54285 -2.96994    12.1052  -8.93806    10.534   2.77938    243.9       4.91862     63.8997     
1 1 1 34 14 30 o 9  18.1966 5.78174 -6.2313     11.2784  2.39504     11.07    2.77662    313.513     0.918601    133.513     
1 1 1 34 14 31 o 5  25.4612 6.8702  25.1949     14.6933  -3.08945    12.2412  14.6615    124.877     0.778322    304.876     
1 1 1 34 14 32 o 17 20.3404 6.36724 -3.30258    14.276   4.38483     11.884   7.23262    102.784     0.795375    102.784     
1 1 1 34 14 33 o 17 37.033  6.63457 57.7901     16.1044  6.42363     13.4107  27.2088    17.6302     3.61143     17.6302     
1 1 1 34 14 34 o 19 23.3005 6.95024 9.27041     15.3334  6.80749     12.3964  12.4516    234.232     1.42399     54.2323     
1 1 1 34 14 35 o 15 22.2266 7.01384 5.52906     15.7856  -0.0293753  16.1261  10.9544    46.9566     1.90784     226.957     
1 1 1 34 14 36 o 2  36.7264 7.45567 56.1617     17.3303  8.33423     17.9094  28.7722    155.81      8.63012     155.81      
1 1 1 34 14 37 o 11 25.1251 7.80302 12.1911     16.1843  5.56366     22.6779  3.56823    294.869     26.1806     114.869     
1 1 1 34 14 38 o 7  28.1762 8.42827 8.08527     17.9846  31.111      23.1502  18.0929    302.059     7.52341     302.059     
1 1 1 34 14 39 o 8  46.4471 9.28539 72.1094     21.0761  56.0488     26.5594  38.4988    36.8379     14.2534     36.8379     
1 1 1 34 14 40 o 2  24.3623 7.89573 8.16743     18.336   7.11554     25.7161  11.1234    33.1053     1.84541     33.1053     
1 1 1 34 14 41 o 19 48.0229 9.1291  43.3577     20.5784  100.958     26.4737  43.1988    357.785     23.5418     357.785     
1 1 1 34 14 42 f 0  21.816  7.31392 -2.15384    17.4802  1.46227     25.0158  10.1535    144.406     0           0           
1 1 1 34 14 43 o 3  23.6236 7.87406 13.3172     24.5408  -3.99505    24.0853  8.67646    288.223     4.94875     108.223     
1 1 1 34 14 44 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 14 45 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 15 0  o 7  19.5321 7.19968 11.1787     9.19466  11.1787     9.19466  9.74107    180         3.71698     2.2353e-05  
1 1 1 34 15 1  o 7  17.9829 5.35482 6.46534     8.5171   -3.30865    8.61657  4.04781    341.227     0.968776    161.227     
1 1 1 34 15 2  o 14 20.6298 5.76649 9.80529     8.82373  1.85944     9.41842  3.94134    125.339     18.7469     305.339     
1 1 1 34 15 3  o 14 28.5462 5.43338 29.5776     9.44997  2.40942     9.66491  20.5131    247.771     3.93185     247.771     
1 1 1 34 15 4  o 13 19.5867 5.4105  12.3794     8.85348  -6.26942    8.66764  7.45939    214.226     0.634929    34.2256     
1 1 1 34 15 5  o 18 29.9494 5.99948 15.4358     9.3395   22.9769     9.71547  13.8865    309.483     14.2396     129.483     
1 1 1 34 15 6  o 18 23.3402 6.05918 9.62918     9.0339   11.2495     9.54891  2.15387    131.129     36.8961     131.129     
1 1 1 34 15 7  o 13 23.8748 6.04943 9.62963     8.99545  12.8412     9.42603  8.27708    148.84      15.1486     328.84      
1 1 1 34 15 8  o 4  25.4031 6.13921 16.0319     9.2001   10.1425     9.97002  14.0356    28.3773     7.02256     28.3773     
1 1 1 34 15 9  f 0  23.9572 6.22095 10.2116     9.88436  12.104      9.73715  5.42532    147.087     0           0           
1 1 1 34 15 10 o 18 43.4379 5.5781  39.3097     10.9354  38.6903     12.4002  29.7407    20.0273     3.82466     200.027     
1 1 1 34 15 11 o 9  23.8783 6.3228  13.2456     10.5817  8.53778     9.9312   12.9662    306.447     4.10795     306.447     
1 1 1 34 15 12 o 2  23.7743 5.99708 3.03091     9.66988  17.4011     9.77357  13.503     20.726      3.22838     20.726      
1 1 1 34 15 13 o 11 17.5828 5.4252  -4.77115    9.28092  4.44621     9.25111  4.27694    43.4009     8.35454     223.401     
1 1 1 34 15 14 o 1  51.7515 5.19776 59.9207     12.7335  48.7084     13.2281  33.0892    328.316     10.335      148.316     
1 1 1 34 15 15 o 3  19.6868 6.01306 2.40697     10.9764  2.7491      10.7134  6.843      244.166     2.78545     64.1657     
1 1 1 34 15 16 o 3  18.2979 5.74215 -5.1015     11.0747  3.20776     10.3528  4.98306    193.08      5.5044      13.0803     
1 1 1 34 15 17 o 6  31.9367 6.2458  36.9517     12.066   7.00434     11.7909  25.4302    264.795     11.9148     264.795     
1 1 1 34 15 18 o 11 29.6138 6.92338 23.0469     12.546   16.5755     11.4533  12.5373    218.467     8.22325     218.467     
1 1 1 34 15 19 o 4  30.9267 6.64528 11.5533     12.6901  30.2231     11.7006  23.1631    58.667      9.72298     58.667      
1 1 1 34 15 20 o 1  32.0441 6.87365 15.6568     13.1672  30.5878     12.1488  11.2209    67.6448     22.3231     247.645     
1 1 1 34 15 21 o 13 17.2646 5.53025 5.21858     11.3767  -16.1116    10.3917  2.68714    72.0861     9.27225     252.086     
1 1 1 34 15 22 o 19 33.8626 6.92629 29.6784     13.0495  23.1377     11.8512  18.3587    208.141     9.86638     28.1406     
1 1 1 34 15 23 o 16 54.7369 5.22984 61.1635     14.3153  61.1379     13.6269  43.4207    150.752     7.20084     150.752     
1 1 1 34 15 24 o 7  21.8781 6.12014 -7.96318    12.2852  15.5822     10.7471  7.49224    328.324     11.1961     148.323     
1 1 1 34 15 25 o 5  26.1965 6.75028 22.7815     12.8398  5.11265     11.4782  16.0248    36.1056     1.57161     36.1057     
1 1 1 34 15 26 o 14 22.5977 6.89439 -0.758967   17.9731  8.61158     11.7615  9.87715    245.003     2.15895     245.003     
1 1 1 34 15 27 o 3  27.2269 7.56895 11.6418     18.379   17.7168     13.0277  16.3909    298.511     1.14082     118.511     
1 1 1 34 15 28 o 16 28.2031 7.958   17.9054     21.9854  16.3388     12.8654  19.5402    93.1423     6.21215     93.1423     
1 1 1 34 15 29 f 0  41.1721 7.88131 33.0637     21.2532  49.2923     14.6313  18.4518    168.327     0           0           
1 1 1 34 15 30 o 2  21.667  6.89779 3.12722     18.8593  1.02834     12.3341  10.3421    120.888     3.2061      300.888     
1 1 1 34 15 31 o 4  39.4855 8.01825 40.5904     18.7048  37.8952     14.8868  35.3719    43.6618     18.5663     43.6618     
1 1 1 34 15 32 o 12 25.0398 7.34506 10.3178     17.4464  12.7556     13.2222  12.1926    186.348     7.20588     6.34814     
1 1 1 34 15 33 o 17 25.5189 7.44093 22.0528     17.7196  5.04989     13.1753  10.3594    212.745     12.4422     32.7453     
1 1 1 34 15 34 o 9  34.9737 8.05665 29.9514     18.9652  34.5596     14.5197  17.0251    337.861     14.3653     157.861     
1 1 1 34 15 35 o 6  26.8938 7.78781 23.9457     19.7554  11.7488     13.4635  13.8831    213.608     6.05959     33.608      
1 1 1 34 15 36 o 2  29.6633 7.98995 28.661      18.8845  19.7206     14.0231  20.0018    66.2386     9.66353     66.2386     
1 1 1 34 15 37 o 13 22.9419 7.29313 6.47368     17.7354  7.26225     17.3306  9.68157    175.796     0.565722    175.796     
1 1 1 34 15 38 o 12 26.6571 7.93338 15.0576     18.5441  21.6208     17.783   14.4327    321.305     3.25306     321.305     
1 1 1 34 15 39 o 9  24.9474 7.67595 11.9473     18.0945  16.5379     17.8698  11.5656    161.511     0.0547317   161.511     
1 1 1 34 15 40 o 18 22.6711 7.2577  12.6173     18.2382  2.12286     17.3264  1.66401    15.6661     0.15951     15.6661     
1 1 1 34 15 41 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 15 42 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 15 43 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 16 0  o 5  72.5724 3.99888 98.6254     14.3348  98.6254     14.3348  78.7766    360         46.0373     360         
1 1 1 34 16 1  o 5  26.8032 6.00807 0.727489    10.501   26.7185     10.8783  10.3944    62.996      15.8747     242.996     
1 1 1 34 16 2  o 14 75.673  3.899   107.021     14.2964  112.231     15.0743  62.731     326.079     11.1279     326.079     
1 1 1 34 16 3  o 13 38.5738 5.8327  31.5917     11.1461  31.6143     10.7206  35.432     172.218     18.7041     172.218     
1 1 1 34 16 4  o 16 29.0228 6.52026 18.708      11.0629  18.563      10.2668  20.581     176.56      5.09965     176.56      
1 1 1 34 16 5  o 8  20.2731 5.87372 9.4927      9.79724  0.0261339   9.85054  6.10403    123.529     11.4705     303.529     
1 1 1 34 16 6  o 8  27.0955 6.41093 19.2836     10.5691  12.4547     10.1529  5.66859    342.183     3.55166     342.183     
1 1 1 34 16 7  o 13 40.5081 5.81065 42.3403     11.7346  27.8442     11.0821  30.7606    14.2403     3.63963     14.2403     
1 1 1 34 16 8  o 3  18.2344 5.65272 2.20842     10.1988  -0.339008   9.58131  2.16883    83.9782     16.6071     263.978     
1 1 1 34 16 9  o 17 35.8064 6.41864 34.8492     11.432   22.1643     12.1469  28.1177    271.078     7.39539     271.078     
1 1 1 34 16 10 o 9  27.517  6.63151 24.5565     12.109   7.96488     11.0477  15.0501    166.865     5.67519     346.865     
1 1 1 34 16 11 o 8  19.9068 6.24126 -3.32194    12.3823  4.56487     12.609   0.205722   356.667     24.7679     176.667     
1 1 1 34 16 12 o 13 55.3999 5.14421 64.6604     14.42    60.2282     13.4577  47.9584    209.442     14.528      209.442     
1 1 1 34 16 13 o 1  19.1611 5.9094  -34.2526    16.9438  9.4794      10.6056  2.77951    91.6651     0.750505    271.665     
1 1 1 34 16 14 o 8  56.989  5.30768 57.7693     14.8543  75.7283     14.2566  43.8299    85.2367     3.44619     85.2367     
1 1 1 34 16 15 o 2  49.5826 5.98641 60.7054     14.2806  44.5385     14.1815  42.3881    194.752     13.2072     194.752     
1 1 1 34 16 16 o 13 23.7234 6.6824  12.2792     12.4191  8.15763     11.4788  11.8638    108.905     2.25228     288.905     
1 1 1 34 16 17 o 19 60.3036 5.47963 71.4815     15.7727  78.9896     16.5805  58.9893    84.0903     29.8707     84.0903     
1 1 1 34 16 18 o 17 48.8969 5.9648  42.8686     14.3561  59.3228     13.402   49.0156    321.159     29.3644     321.159     
1 1 1 34 16 19 o 13 37.5608 6.85283 26.3417     14.0498  38.1358     12.504   28.5842    279.922     5.05858     279.923     
1 1 1 34 16 20 o 7  27.2045 6.97757 16.9031     12.6939  15.6397     11.8341  13.1078    210.405     9.95388     30.4047     
1 1 1 34 16 21 o 17 23.3958 6.79433 1.75932     15.1321  12.8737     11.738   5.43136    256.683     20.2027     76.6833     
1 1 1 34 16 22 o 8  40.2862 7.53733 33.0807     18.6309  43.9298     13.5605  33.544     111.602     11.0315     111.602     
1 1 1 34 16 23 o 16 20.9596 6.53864 -6.34937    16.0454  6.84154     12.1176  8.95551    142.97      6.5907      322.97      
1 1 1 34 16 24 o 13 24.5601 7.23174 13.7626     16.7719  7.52913     12.5798  13.9191    284.483     6.05192     284.483     
1 1 1 34 16 25 o 15 20.6305 6.64803 7.53718     17.8413  -6.37404    11.5799  1.56979    151.586     0.548376    151.586     
1 1 1 34 16 26 o 4  28.907  7.94384 15.0365     18.5478  23.2175     15.4111  14.4648    275.62      10.0564     95.6203     
1 1 1 34 16 27 o 17 27.4482 7.39571 32.6926     17.4158  0.47044     12.9613  18.8014    159.04      4.17149     159.04      
1 1 1 34 16 28 o 2  20.2568 6.46114 12.4112     16.1991  -13.1949    11.855   8.85249    359.047     3.75714     179.047     
1 1 1 34 16 29 o 10 20.1416 6.44997 -9.00614    16.9448  4.90648     12.4268  8.77297    130.751     3.02913     310.751     
1 1 1 34 16 30 o 14 22.039  7.08194 3.40126     20.5299  2.698       13.5411  7.079      266.325     2.57882     266.325     
1 1 1 34 16 31 f 0  25.5017 7.70627 32.7145     22.029   -1.79103    12.5401  10.6685    174.453     0           0           
1 1 1 34 16 32 o 18 20.5075 6.76885 9.79854     20.0554  -8.93272    12.5955  7.54468    6.50931     1.02661     186.509     
1 1 1 34 16 33 o 14 18.7383 6.32878 -11.8293    21.1808  -4.04524    12.2369  4.66187    64.6826     2.50467     244.683     
1 1 1 34 16 34 o 18 21.3831 7.00112 6.94286     22.0222  0.518408    12.7966  7.11951    151.849     0.684284    331.849     
1 1 1 34 16 35 o 3  46.9394 8.70134 66.4805     26.749   65.7054     16.8268  30.8123    355.958     4.07552     175.958     
1 1 1 34 16 36 o 2  21.2438 6.70639 -12.4566    18.902   12.9949     13.6831  5.8363     110.805     1.30352     290.805     
1 1 1 34 16 37 o 19 20.8    6.78825 6.5276      19.2529  0.550138    13.3375  5.17312    132.233     2.84949     312.233     
1 1 1 34 16 38 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 16 39 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 17 0  o 5  54.9887 4.98364 59.4106     13.116   59.4106     13.116   45.1763    180         5.66103     180         
1 1 1 34 17 1  o 8  100.584 3.63945 202.586     18.6687  182.403     17.8937  106.476    230.181     60.232      230.181     
1 1 1 34 17 2  o 17 29.365  7.01532 17.4331     13.6889  21.7344     11.31    6.73602    224.085     28.0919     44.085      
1 1 1 34 17 3  o 4  29.1937 6.75603 19.3593     11.3234  19.3605     11.4521  19.9418    178.615     2.71415     178.615     
1 1 1 34 17 4  o 15 25.7122 7.03982 14.1859     13.5807  13.1235     12.2682  15.162     295.005     0.452511    295.005     
1 1 1 34 17 5  o 15 53.2252 5.68381 59.3218     15.019   59.6258     14.3407  37.1263    32.017      5.01371     212.017     
1 1 1 34 17 6  o 16 23.0594 6.72022 7.53888     12.4252  9.55951     12.684   11.3037    90.4211     1.40918     90.4211     
1 1 1 34 17 7  o 14 40.7308 6.82344 30.8033     14.5503  44.9545     13.2744  37.3201    289.648     18.6223     289.648     
1 1 1 34 17 8  o 5  29.7355 7.33077 25.4331     13.8487  15.7369     13.3894  17.2732    115.431     5.51168     295.431     
1 1 1 34 17 9  o 16 46.2205 6.55771 47.4775     14.8771  47.1961     14.4434  33.5171    185.621     0.645314    5.62063     
1 1 1 34 17 10 o 3  18.9187 6.20949 -11.7907    12.4193  1.91319     15.5264  2.89175    260.816     17.0148     80.8159     
1 1 1 34 17 11 o 11 30.2266 7.2114  25.5028     13.3977  17.1635     12.7727  22.2758    128.992     5.93526     128.992     
1 1 1 34 17 12 o 15 20.7673 6.53295 -0.680002   15.2488  3.29335     12.3173  7.9119     257.587     8.32787     77.5868     
1 1 1 34 17 13 o 12 23.3409 6.59736 18.5478     13.0541  -4.04555    12.4564  13.2278    100.233     0.594655    100.233     
1 1 1 34 17 14 o 12 45.248  6.81229 47.3581     15.2329  44.8271     14.7159  44.4053    12.1053     25.1534     12.1053     
1 1 1 34 17 15 o 18 109.274 4.51261 231.534     25.8716  238.551     23.1623  105.001    23.424      44.1689     23.424      
1 1 1 34 17 16 o 2  35.6243 7.63715 21.3888     18.1057  39.1386     14.1381  26.7331    275.234     3.86393     275.234     
1 1 1 34 17 17 o 19 89.0552 6.13269 164.569     26.3202  175.108     27.7316  88.1304    229.361     42.2104     229.361     
1 1 1 34 17 18 o 14 24.2234 7.25035 2.30493     18.1406  13.0967     13.6071  13.7362    245.108     2.34395     65.1084     
1 1 1 34 17 19 o 8  49.0792 7.80527 51.9381     20.634   64.8335     17.0638  50.1055    128.104     31.2088     128.104     
1 1 1 34 17 20 o 12 25.676  7.2959  4.17895     18.0721  18.1455     12.9647  16.9878    13.0178     4.02476     13.0178     
1 1 1 34 17 21 o 7  65.6423 7.2083  82.4857     24.6163  114.837     17.9406  51.1663    26.9797     4.63902     26.9797     
1 1 1 34 17 22 o 17 43.0874 8.16672 54.9915     20.8766  41.2285     15.1775  31.0528    311.2       0.271394    311.2       
1 1 1 34 17 23 o 5  21.4061 6.76111 -2.53242    17.8964  6.09858     12.6348  9.93949    37.8603     5.00588     217.86      
1 1 1 34 17 24 o 4  34.2506 8.44347 40.0901     21.6384  26.2739     14.1009  18.0583    98.8803     11.9242     278.88      
1 1 1 34 17 25 o 12 23.7354 7.02222 -5.42694    18.7002  16.9263     13.0403  13.0733    292.961     4.93741     292.961     
1 1 1 34 17 26 o 11 45.1637 8.9638  59.5306     26.5733  59.1083     17.61    37.1412    97.7529     10.7483     97.7529     
1 1 1 34 17 27 o 19 35.852  8.11854 31.8705     20.6631  39.1946     14.5788  21.1582    277.412     7.59238     97.4117     
1 1 1 34 17 28 o 1  31.0582 8.12921 26.6201     19.9941  28.2036     14.6461  20.036     46.902      12.5136     46.902      
1 1 1 34 17 29 o 1  35.4368 8.5083  48.3576     21.0511  28.9126     15.0101  24.6138    58.545      1.90612     58.545      
1 1 1 34 17 30 o 8  21.5999 6.90986 8.66642     18.6964  2.96597     13.0513  8.50792    144.02      4.00101     324.02      
1 1 1 34 17 31 o 2  21.8424 6.95505 7.72608     18.9337  5.51683     13.1305  2.01758    77.0207     0.313352    77.0207     
1 1 1 34 17 32 o 2  21.3557 6.85982 2.22313     19.586   6.70893     13.1739  4.26081    113.333     0.197362    293.333     
1 1 1 34 17 33 o 16 18.6835 6.26134 -6.24884    18.8882  -2.30657    12.5926  3.13374    237.348     10.3594     57.3476     
1 1 1 34 17 34 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 17 35 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 17 36 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 18 0  o 11 71.7556 6.0076  103.421     20.8074  103.421     20.8074  70.2641    180         29.75       180         
1 1 1 34 18 1  o 8  55.6557 7.36329 88.2016     22.2886  57.4476     17.4193  49.4241    80.5806     16.0525     80.5806     
1 1 1 34 18 2  o 18 48.2812 7.09842 62.3348     18.2382  45.6085     15.0669  34.24      58.6324     3.33632     238.632     
1 1 1 34 18 3  o 5  21.3325 6.58461 7.87723     13.445   -1.09362    13.4797  11.2287    346.934     1.24441     166.934     
1 1 1 34 18 4  o 15 17.3945 5.70925 -9.08487    12.4527  -2.21746    11.6232  5.07972    31.6717     1.0672      211.672     
1 1 1 34 18 5  o 6  49.0689 7.62446 46.4655     20.5211  69.1575     16.3625  34.6834    153.266     3.54395     333.266     
1 1 1 34 18 6  o 15 57.1372 6.36968 64.7419     17.3617  78.5199     17.798   57.2902    164.518     29.9809     164.518     
1 1 1 34 18 7  o 2  22.4793 6.65671 14.8421     13.5877  -2.69581    12.7652  11.1156    67.4472     4.41585     67.4472     
1 1 1 34 18 8  o 12 37.5445 7.47245 28.4971     15.2309  40.0909     14.6102  35.3821    308.734     20.3684     308.734     
1 1 1 34 18 9  o 4  24.5061 7.93198 4.52505     20.2399  2.77537     23.6661  12.3055    27.8925     6.86515     207.893     
1 1 1 34 18 10 o 19 17.4878 5.81663 9.81127     15.3457  -34.3863    10.5486  5.35404    112.921     1.44085     292.921     
1 1 1 34 18 11 o 11 35.9933 9.46755 49.2823     26.4182  29.7929     19.1307  27.1228    279.7       4.73003     279.7       
1 1 1 34 18 12 o 14 29.6601 8.02536 21.5231     19.6924  21.9826     14.2884  22.8311    60.5798     9.12458     60.5798     
1 1 1 34 18 13 o 1  54.1266 8.19428 66.4549     24.3001  80.9831     18.7902  40.9918    269.799     1.65663     269.799     
1 1 1 34 18 14 o 5  27.5374 7.85271 29.6028     19.5402  6.77276     14.1738  18.1545    298.898     10.0581     298.898     
1 1 1 34 18 15 o 18 37.7544 8.3914  26.807      22.0712  49.7542     17.315   26.9158    202.305     0.289659    202.305     
1 1 1 34 18 16 o 12 31.5854 9.14619 37.5041     25.7362  22.2839     20.2352  15.5307    109.669     12.9243     289.669     
1 1 1 34 18 17 o 12 37.716  8.43932 30.9696     22.3704  47.079      16.6902  34.9101    128.874     21.0258     128.874     
1 1 1 34 18 18 o 6  25.529  7.66052 10.861      20.7344  14.7712     14.35    16.6013    125.803     4.25613     125.804     
1 1 1 34 18 19 f 0  55.028  8.2077  78.2017     24.6507  78.7882     19.0461  29.132     300.295     0           0           
1 1 1 34 18 20 f 0  24.3359 7.50245 9.68205     20.2786  11.3285     14.6336  11.062     43.6207     0           0           
1 1 1 34 18 21 o 6  30.8553 8.38818 42.6766     21.2441  13.9647     15.9968  23.407     165.195     10.545      165.195     
1 1 1 34 18 22 f 0  23.2526 7.30145 9.70659     19.8329  7.70372     14.2669  2.84327    310.177     0           0           
1 1 1 34 18 23 o 11 31.5757 8.30741 23.0242     21.6331  35.0627     16.2661  21.7954    177.479     2.70959     177.479     
1 1 1 34 18 24 o 9  25.481  7.79606 18.2949     21.8936  13.8562     14.9974  13.7465    198.263     2.26074     18.263      
1 1 1 34 18 25 o 1  17.9848 6.12765 -0.0754053  18.3578  -14.809     12.7814  3.96932    114.412     4.41082     294.412     
1 1 1 34 18 26 o 1  24.8284 7.89751 7.23754     21.4522  19.3575     20.3042  10.4708    233.756     8.94872     53.7556     
1 1 1 34 18 27 o 4  21.0609 6.87061 -0.604828   20.0678  5.53082     14.4515  7.1999     74.0302     4.15582     254.03      
1 1 1 34 18 28 o 11 30.1035 8.34103 24.7542     23.4912  33.0325     16.2978  19.3592    286.005     4.79152     286.005     
1 1 1 34 18 29 o 19 21.2951 6.99743 11.2063     20.422   -1.81593    14.8638  4.58796    281.145     0.96412     101.145     
1 1 1 34 18 30 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 18 31 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 18 32 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 19 0  o 12 38.9921 10.7792 46.2639     20.1256  46.2639     20.1256  29.9106    6.49423e-06 0.503136    180         
1 1 1 34 19 1  o 9  26.78   8.39965 29.1236     26.6219  4.72955     17.3459  14.3505    248.931     6.94391     68.9307     
1 1 1 34 19 2  o 1  33.8334 8.69445 3.90043     28.8633  50.5384     20.0884  24.081     277.492     1.18242     277.492     
1 1 1 34 19 3  o 19 26.9438 8.44631 25.2896     26.5299  8.65771     18.2192  17.4626    224.104     1.15108     224.104     
1 1 1 34 19 4  o 5  27.4214 8.49791 44.3486     27.5303  -6.79627    17.0247  18.2468    218.742     8.90962     218.742     
1 1 1 34 19 5  o 13 29.2737 8.82107 22.571      28.8239  23.6593     18.6311  13.3667    316.672     13.9985     136.672     
1 1 1 34 19 6  f 0  24.672  7.6551  -6.28363    28.0898  15.1765     14.1085  14.581     40.3563     0           0           
1 1 1 34 19 7  f 0  22.9709 7.71987 8.08621     33.5701  0.168684    12.893   6.54183    236.945     0           0           
1 1 1 34 19 8  o 2  32.2072 10.4258 136.178     109.171  28.3615     19.5147  15.5588    335.619     13.7162     155.619     
1 1 1 34 19 9  o 14 25.1694 7.67079 20.5849     20.5082  7.28693     14.2691  6.14019    173.38      3.61113     173.38      
1 1 1 34 19 10 o 11 22.3034 7.67266 9.03536     34.6371  -7.15668    14.341   8.00554    278.92      2.70171     278.92      
1 1 1 34 19 11 o 2  26.1599 7.75695 10.5553     21.0684  19.1352     14.9829  13.6644    111.468     7.16008     291.468     
1 1 1 34 19 12 o 6  25.9312 7.87785 15.4616     22.0234  15.3529     15.4683  16.5839    193.889     4.3417      193.889     
1 1 1 34 19 13 o 6  25.3899 7.75053 22.8222     20.5727  7.45269     15.1285  15.5925    127.489     3.9887      127.489     
1 1 1 34 19 14 o 6  22.4259 7.06396 -1.2165     19.7314  10.911      14.0496  8.62052    222.561     2.66295     222.561     
1 1 1 34 19 15 f 0  30.5355 8.50202 36.3038     21.9586  22.4427     16.1775  26.7653    357.805     0           0           
1 1 1 34 19 16 o 4  20.7076 6.87957 7.44183     19.4932  -10.3171    16.6739  8.28429    304.86      4.60299     124.86      
1 1 1 34 19 17 o 16 23.6184 7.14711 -12.2578    20.7247  21.1275     14.8677  12.2506    121.643     1.52034     301.643     
1 1 1 34 19 18 o 16 27.4944 8.03624 22.2438     21.4059  21.5783     15.4462  17.026     261.201     1.53898     261.201     
1 1 1 34 19 19 o 6  19.1417 6.38432 -13.7019    19.8419  1.66642     13.5921  2.46738    151.128     0.556631    331.128     
1 1 1 34 19 20 o 18 34.7454 8.59379 63.8611     22.505   18.227      16.7778  27.6203    233.853     14.9429     233.853     
1 1 1 34 19 21 o 11 19.443  6.43535 -12.0626    19.2606  4.07771     13.7684  2.95713    351.723     0.947368    171.723     
1 1 1 34 19 22 o 18 26.9182 8.06089 30.398      21.3045  15.2603     16.0927  9.75876    34.4256     4.4059      34.4256     
1 1 1 34 19 23 o 2  23.6387 7.48895 16.8982     21.2351  9.11716     15.2388  8.22568    276.984     11.4881     96.984      
1 1 1 34 19 24 o 12 21.3038 6.97465 16.7856     20.1129  -5.51994    14.2439  4.44379    355.531     0.791182    175.531     
1 1 1 34 19 25 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 19 26 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 19 27 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 20 0  o 10 12.6846 6.5469  -41.6999    25.0485  -41.6999    25.0485  0.950799   360         10.4044     360         
1 1 1 34 20 1  o 3  28.8332 9.55433 42.6866     38.6287  26.0343     30.6899  14.0826    145.9       10.0714     325.9       
1 1 1 34 20 2  o 13 25.3751 8.54193 -22.9896    36.3228  29.0089     28.673   11.5388    98.2786     8.98917     278.279     
1 1 1 34 20 3  o 12 27.1311 9.39382 1.51231     37.5576  46.2894     46.3642  15.7861    90.2336     3.58301     90.2336     
1 1 1 34 20 4  o 2  24.081  8.47727 -18.9646    35.1026  7.8603      43.9203  5.57368    100.219     2.00021     100.219     
1 1 1 34 20 5  o 6  24.9533 8.80861 -16.4788    36.5127  22.0954     50.0931  12.7055    61.384      1.52418     61.384      
1 1 1 34 20 6  o 7  25.8805 9.07975 4.55057     38.8824  18.0781     50.8794  8.25356    81.2863     3.45482     81.2863     
1 1 1 34 20 7  o 11 24.2623 8.85419 -109.831    152.719  -45.3242    47.1849  11.2233    44.613      0.708463    44.6129     
1 1 1 34 20 8  o 6  26.0498 8.47401 -2.86129    38.0528  25.5821     21.497   14.5491    139.115     0.568443    319.115     
1 1 1 34 20 9  o 6  27.7923 9.17086 30.0516     38.8755  27.6813     26.4393  15.4203    228.178     5.70615     228.178     
1 1 1 34 20 10 o 7  21.7249 7.48117 -12.5996    36.5568  -0.529761   18.3361  7.88875    93.069      0.800789    273.069     
1 1 1 34 20 11 o 6  24.9854 8.38861 23.8867     35.4985  8.68095     21.3659  11.5467    184.002     2.42347     184.002     
1 1 1 34 20 12 o 14 24.0945 8.00299 19.6138     37.0085  8.99165     15.1104  11.2227    313.125     0.256293    313.125     
1 1 1 34 20 13 o 7  23.177  7.86033 21.8199     37.6971  3.36869     14.59    6.51661    299.068     1.13356     299.068     
1 1 1 34 20 14 o 1  23.9509 8.06702 27.6231     38.4948  5.90781     15.3564  9.47828    34.1628     1.01196     34.1628     
1 1 1 34 20 15 o 7  19.8564 6.74095 -4.32636    19.5637  -5.0364     19.3318  5.37182    270.155     7.98105     90.1547     
1 1 1 34 20 16 o 14 23.553  7.48334 19.662      21.127   7.21476     15.3352  8.21856    84.5491     0.993007    84.5491     
1 1 1 34 20 17 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 20 18 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 20 19 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 20 20 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 20 21 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 0  x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 1  x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 2  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 3  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 4  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 5  x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 6  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 7  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 8  x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 9  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 10 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 11 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 34 21 12 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 0  0  o 4  75.0435 4.9389  102.707     18.1833  102.707     18.1833  37.8169    180         33.8011     360         
1 1 1 35 0  1  o 18 213.304 3.08276 809.515     32.9224  809.515     32.9224  188.576    240         57.5382     240         
1 1 1 35 0  2  o 17 77.7779 3.37311 108.759     13.0331  108.759     13.0331  29.9965    300         56.5348     120         
1 1 1 35 0  3  o 19 81.2436 3.31819 118.509     13.4059  118.509     13.4059  62.5124    180         3.42306     180         
1 1 1 35 0  4  f 0  197.099 3.09405 691.389     30.5274  691.389     30.5274  127.903    240         0           0           
1 1 1 35 0  5  o 18 75.4066 3.78518 102.708     14.1352  102.708     14.1352  55.6009    300         1.50718     120         
1 1 1 35 0  6  o 5  23.0976 7.71565 14.0814     10.0968  14.0814     10.0968  2.36479    8.72243e-06 8.82292     8.72243e-06 
1 1 1 35 0  7  o 2  171.262 3.21684 522.517     27.565   522.517     27.565   127.917    240         0.445311    59.9999     
1 1 1 35 0  8  o 14 135.611 3.1454  327.945     21.3241  327.945     21.3241  64.7057    120         73.4343     300         
1 1 1 35 0  9  o 5  56.0865 4.37256 58.0735     11.9095  58.0735     11.9095  23.2702    8.18071e-07 36.69       180         
1 1 1 35 0  10 f 0  55.6904 4.58966 57.5206     12.3554  57.5206     12.3554  20.0257    60          0           0           
1 1 1 35 0  11 o 5  106.829 3.34947 204.18      17.8514  204.18      17.8514  108.167    120         56.8234     120         
1 1 1 35 0  12 o 17 247.886 3.71355 1095.54     46.0852  1095.54     46.0852  226.568    180         83.1686     180         
1 1 1 35 0  13 o 6  109.82  3.10917 215.466     17.049   215.466     17.049   57.7826    240         48.227      60          
1 1 1 35 0  14 o 16 140.302 2.97243 350.866     20.857   350.866     20.857   139.652    120         70.206      120         
1 1 1 35 0  15 o 13 102.869 2.89221 188.984     14.8563  188.984     14.8563  96.3861    180         39.5981     180         
1 1 1 35 0  16 o 6  49.5624 4.20409 45.6518     10.0447  45.6518     10.0447  7.56499    60          58.0654     240         
1 1 1 35 0  17 o 14 14.8468 6.27798 4.21866     8.29847  4.21866     8.29847  11.0488    120         26.3122     120         
1 1 1 35 0  18 o 14 147.727 2.78987 388.752     20.6206  388.752     20.6206  155.711    180         92.0365     180         
1 1 1 35 0  19 o 2  48.82   4.54431 44.7151     10.5831  44.7151     10.5831  29.1033    60          8.72954     240         
1 1 1 35 0  20 o 14 26.8937 7.24282 17.6419     9.18649  17.6419     9.18649  0.429764   120         6.09053     120         
1 1 1 35 0  21 o 12 70.5379 3.37331 89.8078     11.7973  89.8078     11.7973  47.9077    180         8.49382     8.65139e-06 
1 1 1 35 0  22 o 7  67.0332 4.40697 82.3539     14.4938  82.3539     14.4938  32.6145    240         33.8591     60          
1 1 1 35 0  23 o 17 131.323 3.1126  308.019     20.4323  308.019     20.4323  106.189    120         18.4539     120         
1 1 1 35 0  24 o 19 55.2692 4.35549 56.5931     11.6804  56.5931     11.6804  51.5568    180         29.985      180         
1 1 1 35 0  25 o 8  33.5732 7.03942 24.9684     10.3016  24.9684     10.3016  14.1609    60          13.0857     240         
1 1 1 35 0  26 o 19 11.2854 5.3995  -4.23208    9.00874  -4.23208    9.00874  4.24498    300         10.2        300         
1 1 1 35 0  27 o 12 61.0874 4.7712  69.3011     14.152   69.3011     14.152   50.4386    1.79732e-06 11.1978     1.79732e-06 
1 1 1 35 0  28 o 17 35.3153 6.3959  26.3992     9.7837   26.3992     9.7837   24.9972    240         6.37483     240         
1 1 1 35 0  29 o 7  146.183 2.79702 381.297     20.4566  381.297     20.4566  137.456    120         60.8996     120         
1 1 1 35 0  30 o 16 18.2105 6.93032 8.69542     8.74624  8.69542     8.74624  1.47723    8.65164e-06 13.7056     8.65164e-06 
1 1 1 35 0  31 o 8  94.5027 2.9973  160.158     14.1298  160.158     14.1298  70.8434    60          3.79175     60          
1 1 1 35 0  32 o 15 12.9257 5.87313 0.495401    8.68707  0.495401    8.68707  3.08074    300         9.16983     300         
1 1 1 35 0  33 o 3  11.1187 5.29631 -3.43176    8.4848   -3.43176    8.4848   2.72215    180         7.10694     180         
1 1 1 35 0  34 o 8  35.7577 6.33831 27.0441     9.82461  27.0441     9.82461  10.5917    240         30.5144     60          
1 1 1 35 0  35 o 2  20.5601 7.3503  11.5147     9.40027  11.5147     9.40027  1.93998    120         5.35047     300         
1 1 1 35 0  36 o 19 13.9604 6.2232  1.97707     9.21514  1.97707     9.21514  3.12077    180         11.3391     180         
1 1 1 35 0  37 f 0  71.9836 3.67744 94.3319     13.1036  94.3319     13.1036  61.1267    60          0           0           
1 1 1 35 0  38 o 18 155.62  3.00556 433.654     23.4001  433.654     23.4001  161.946    300         99.8285     300         
1 1 1 35 0  39 o 8  45.9219 5.20187 40.9574     11.0512  40.9574     11.0512  21.5668    3.63505e-06 22.8398     180         
1 1 1 35 0  40 o 10 16.8631 6.97104 6.58125     9.82621  6.58125     9.82621  0.00382118 60.0004     1.30384     240         
1 1 1 35 0  41 o 15 162.535 3.18958 473.966     25.9348  473.966     25.9348  128.218    120         23.9426     120         
1 1 1 35 0  42 o 10 19.0456 7.49981 9.54499     10.6188  9.54499     10.6188  2.26405    180         10.6526     8.63869e-06 
1 1 1 35 0  43 o 17 75.6783 3.82048 104.605     14.3164  104.605     14.3164  59.3881    60          11.0263     60          
1 1 1 35 0  44 o 8  72.0013 3.95009 95.0959     14.0504  95.0959     14.0504  55.3578    120         8.4471      120         
1 1 1 35 0  45 o 3  127.876 3.17646 294.326     20.2991  294.326     20.2991  111.29     1.41128e-06 41.3952     1.41128e-06 
1 1 1 35 0  46 o 6  20.0373 7.74048 11.0548     11.0724  11.0548     11.0724  3.14273    60          33.6741     60          
1 1 1 35 0  47 o 4  71.2348 3.73168 93.0762     13.1497  93.0762     13.1497  44.8984    120         10.6223     300         
1 1 1 35 0  48 o 7  18.8058 7.35487 9.66965     10.1314  9.66965     10.1314  0.665827   2.89029e-05 0.185578    180         
1 1 1 35 0  49 o 8  40.4347 6.30139 34.2494     11.1709  34.2494     11.1709  28.0016    60          0.679965    240         
1 1 1 35 0  50 f 0  18.2603 7.48932 8.65358     11.1982  8.65358     11.1982  4.78868    120         0           0           
1 1 1 35 0  51 o 17 13.1984 6.09748 -0.0500672  9.90735  -0.0500672  9.90735  0.23698    180         3.53962     180         
1 1 1 35 0  52 o 8  108.922 3.30043 215.629     17.9401  215.629     17.9401  90.034     60          28.6075     60          
1 1 1 35 0  53 o 13 19.2984 7.53701 10.6074     10.6227  10.6074     10.6227  4.03899    120         1.27976     300         
1 1 1 35 0  54 o 16 15.3952 6.77665 4.14979     10.5677  4.14979     10.5677  0.518998   2.75401e-06 3.72476     180         
1 1 1 35 0  55 o 10 40.5069 6.76327 35.5508     11.9228  35.5508     11.9228  32.6889    240         9.78229     240         
1 1 1 35 0  56 o 17 77.8696 3.86244 112.301     14.8992  112.301     14.8992  77.9368    300         48.878      300         
1 1 1 35 0  57 o 2  33.0323 8.59123 28.4089     13.1475  28.4089     13.1475  22.1881    180         0.00996017  8.58548e-06 
1 1 1 35 0  58 o 18 13.1902 6.20225 -1.54606    10.983   -1.54606    10.983   0.0592231  240         0.640219    240         
1 1 1 35 0  59 o 14 8.64119 4.41998 -18.195     10.0646  -18.195     10.0646  11.5545    120         30.416      120         
1 1 1 35 0  60 o 10 16.8652 7.40546 5.73247     12.5423  5.73247     12.5423  3.68631    180         6.91247     8.79438e-06 
1 1 1 35 0  61 o 7  86.3673 4.46274 140.388     19.0737  140.388     19.0737  69.7256    240         22.6826     240         
1 1 1 35 0  62 o 10 17.1404 7.58326 6.06176     13.4076  6.06176     13.4076  3.79624    120         7.1287      300         
1 1 1 35 0  63 o 8  14.6137 6.85834 -0.291204   13.3213  -0.291204   13.3213  0.0148493  0.000197039 0.199156    180         
1 1 1 35 0  64 o 9  23.7139 9.28421 19.2398     16.1635  19.2398     16.1635  7.60961    240         1.11644     240         
1 1 1 35 0  65 f 0  23.3514 10.2598 19.4754     24.1109  19.4754     24.1109  6.15817    300         0           0           
1 1 1 35 0  66 o 4  31.5367 11.8688 40.5737     25.3988  40.5737     25.3988  17.5199    1.42735e-06 6.65141     1.42735e-06 
1 1 1 35 0  67 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 1  0  o 13 69.9794 3.54656 88.482      12.2879  88.482      12.2879  35.2754    0.00012207  28.048      0.00012207  
1 1 1 35 1  1  o 14 102.701 3.0627  180.587     15.7607  196.533     15.6683  67.0776    123.495     14.3751     303.495     
1 1 1 35 1  2  o 7  97.3603 3.09213 182.492     14.996   156.883     15.0306  61.9747    332.485     16.3235     152.485     
1 1 1 35 1  3  o 13 108.149 3.03392 207.384     16.4593  210.512     16.3602  81.7833    26.4236     7.42143     26.4236     
1 1 1 35 1  4  f 0  115.716 3.00715 235.683     17.5161  242.622     17.2947  83.1169    69.673      0           0           
1 1 1 35 1  5  o 3  77.8287 3.57378 104.458     13.8777  113.192     13.8287  45.2519    154.124     19.0593     334.124     
1 1 1 35 1  6  o 9  136.359 3.04342 331.024     21.3341  333.093     20.1882  101.021    36.7246     2.16868     36.7248     
1 1 1 35 1  7  f 0  118.06  3.19515 251.046     18.1937  247.413     19.5095  88.8823    116.93      0           0           
1 1 1 35 1  8  o 8  19.5649 5.66708 6.10529     9.06584  -2.74845    9.23269  20.6034    95.6081     55.6947     95.6081     
1 1 1 35 1  9  o 8  70.362  3.37526 85.0239     11.8352  92.8542     11.8068  28.3068    114.711     42.3189     294.711     
1 1 1 35 1  10 o 19 81.6005 3.20521 116.03      13.0836  122.616     13.0178  70.3935    338.873     30.0799     338.873     
1 1 1 35 1  11 o 11 130.789 2.89728 300.65      18.8881  310.265     19.0435  123.054    239.864     57.2112     239.864     
1 1 1 35 1  12 o 13 91.3619 2.98316 149.015     13.6429  149.567     13.6002  46.3536    350.87      38.6634     170.87      
1 1 1 35 1  13 o 6  29.2088 5.80095 12.2514     8.85293  19.6505     9.08135  1.20656    206.861     23.1923     206.861     
1 1 1 35 1  14 o 1  58.4471 3.65359 63.9032     10.5677  59.4976     10.6016  30.7459    1.36665     15.9176     181.367     
1 1 1 35 1  15 o 8  29.699  5.65897 21.3138     8.82819  11.7981     8.79763  7.22556    280.22      44.6208     280.22      
1 1 1 35 1  16 o 6  82.5482 3.15868 130.71      13.3361  113.899     12.6896  70.0928    69.3986     27.4878     69.3986     
1 1 1 35 1  17 o 14 35.2286 5.34191 25.4945     9.20687  21.3199     9.09985  8.31445    133.137     10.2421     313.137     
1 1 1 35 1  18 o 6  119.064 2.8055  252.638     16.6994  253.964     16.7335  103.235    281.171     34.9545     281.171     
1 1 1 35 1  19 o 17 23.5267 5.66165 -8.16165    10.3128  17.895      9.48324  8.68801    178.865     37.1306     178.865     
1 1 1 35 1  20 o 7  26.8842 6.13449 19.1637     9.70306  4.40695     10.6793  7.30332    331.148     43.2124     331.148     
1 1 1 35 1  21 o 7  53.1573 4.55294 55.9463     11.8771  47.8476     11.8188  33.2726    289.417     3.47859     109.417     
1 1 1 35 1  22 o 11 25.4538 6.29861 16.7692     10.5153  2.48364     10.654   1.68778    258.214     14.1482     78.2138     
1 1 1 35 1  23 o 12 93.176  3.5727  160.27      16.7178  152.606     16.5189  59.3963    327.022     15.7497     147.022     
1 1 1 35 1  24 o 4  140.992 3.23365 350.406     23.4066  363.151     22.183   114.669    69.5213     23.4331     69.5213     
1 1 1 35 1  25 o 4  20.7209 5.82445 0.0239694   9.53493  7.64198     9.05966  14.4937    335.082     53.5431     335.082     
1 1 1 35 1  26 o 14 68.5666 3.99526 84.2728     13.5634  86.6986     13.6487  38.024     348.2       21.6601     168.2       
1 1 1 35 1  27 o 7  53.6234 4.49406 60.1394     11.3677  46.187      11.9914  26.0175    241.35      22.8173     61.3505     
1 1 1 35 1  28 o 17 126.233 2.95119 283.253     18.62    288.709     18.6666  108.536    277.536     34.1789     277.536     
1 1 1 35 1  29 o 15 177.852 2.976   581.286     26.5204  553.872     26.5174  161.625    284.327     64.3641     284.327     
1 1 1 35 1  30 o 4  82.6082 3.33919 131.095     13.7124  115.716     13.7719  48.681     110.017     21.0181     290.017     
1 1 1 35 1  31 o 8  140.22  2.97084 342.32      20.8375  364.753     20.8517  112.533    254.945     22.0729     254.945     
1 1 1 35 1  32 o 12 31.6923 6.00594 23.1318     9.96197  15.8914     9.68197  8.06366    284.1       24.0743     104.1       
1 1 1 35 1  33 o 19 60.1718 3.93058 65.1681     11.7677  67.5431     11.6634  33.9695    158.353     16.3613     338.353     
1 1 1 35 1  34 o 13 21.9481 5.78229 -0.689714   9.20212  12.463      9.1284   3.06646    173.473     3.95028     353.473     
1 1 1 35 1  35 o 2  53.1107 4.3462  50.8417     11.4195  53.7939     11.2741  49.8639    31.103      32.2288     31.103      
1 1 1 35 1  36 o 13 87.6028 3.23447 129.55      13.8323  148.795     14.4527  67.3336    44.8653     10.4661     44.8653     
1 1 1 35 1  37 o 1  44.2161 4.84671 41.0705     10.3703  33.0189     10.3198  25.4387    322.926     8.39279     142.926     
1 1 1 35 1  38 o 3  79.4924 3.40002 122.197     13.3467  107.877     13.5567  59.4473    184.692     6.99201     184.692     
1 1 1 35 1  39 o 1  88.45   3.2103  138.76      14.1959  145.028     14.1623  73.2217    229.682     21.8629     229.682     
1 1 1 35 1  40 o 1  52.2988 4.41754 55.4595     11.4029  46.8578     11.23    32.755     289.714     5.96009     109.714     
1 1 1 35 1  41 o 8  57.3844 4.15595 65.9474     12.2454  56.4474     11.3184  40.5238    238.641     2.28841     238.641     
1 1 1 35 1  42 o 14 22.664  6.09809 7.99726     9.94417  7.50857     9.21745  7.25419    144.882     4.35372     324.882     
1 1 1 35 1  43 o 15 23.7921 6.16744 4.08968     10.6264  13.2298     9.43652  9.00826    257.086     0.204987    77.0864     
1 1 1 35 1  44 o 6  54.501  4.66838 52.4002     12.951   60.1377     11.8185  38.8484    321.796     3.19785     321.796     
1 1 1 35 1  45 o 5  80.6163 3.79308 138.612     15.95    102.966     14.4462  58.0474    225.654     3.50055     225.654     
1 1 1 35 1  46 o 18 76.9637 3.9098  95.6297     15.3003  125.45      14.2126  57.7692    310.882     8.54642     310.882     
1 1 1 35 1  47 o 19 42.4605 5.91992 44.765      12.3465  28.5818     11.9251  27.8283    255.857     0.61943     75.8569     
1 1 1 35 1  48 o 14 69.581  3.96647 91.283      13.4333  90.2075     13.9827  58.8844    187.503     22.2528     187.503     
1 1 1 35 1  49 o 12 91.6167 3.62616 162.859     16.3728  149.195     16.7429  71.1983    86.9089     15.3397     86.9089     
1 1 1 35 1  50 o 17 62.1715 4.3928  73.4578     13.9033  74.39       13.0765  49.1738    204.432     13.9318     204.432     
1 1 1 35 1  51 o 17 25.0924 6.40699 10.0168     10.4273  14.0171     10.3492  8.45171    242.025     12.7468     62.0245     
1 1 1 35 1  52 o 18 59.6508 4.26701 66.5253     12.5842  69.7028     12.5688  37.8659    254.917     5.09385     74.9166     
1 1 1 35 1  53 o 17 55.1057 4.61391 65.0161     12.3083  53.2574     12.5093  46.9865    124.534     21.5175     124.534     
1 1 1 35 1  54 o 3  52.5711 5.1566  60.6269     12.8924  49.6621     13.3304  40.0966    137.886     11.2453     137.886     
1 1 1 35 1  55 o 8  31.4862 6.49665 15.5639     11.0539  27.2888     11.2998  17.6443    45.8487     1.25292     225.849     
1 1 1 35 1  56 o 11 42.9636 5.98802 31.6166     12.6656  45.8414     12.1064  37.2578    93.1253     26.3606     93.1253     
1 1 1 35 1  57 o 3  36.7772 6.25651 38.7442     11.6881  19.5523     11.8361  29.1842    276.26      16.6854     276.26      
1 1 1 35 1  58 o 1  42.7547 6.42591 43.9239     14.1011  34.4535     12.6253  19.9386    202.88      16.032      22.8796     
1 1 1 35 1  59 o 11 24.7826 6.62303 14.3286     11.3108  8.93972     11.4099  11.5617    188.37      4.31801     188.37      
1 1 1 35 1  60 o 3  43.6263 6.66623 53.2807     14.1701  31.5943     14.3832  22.5057    337.751     11.5014     157.751     
1 1 1 35 1  61 o 13 24.7077 7.18473 17.518      14.6101  0.583934    15.4385  11.0207    129.902     3.09935     129.902     
1 1 1 35 1  62 o 17 19.2098 6.30697 -5.72474    14.398   -3.45151    14.7468  3.34591    34.3803     2.33587     214.38      
1 1 1 35 1  63 o 5  29.9669 7.93763 13.2398     18.6912  30.2343     15.7877  14.6215    59.4267     3.75816     239.427     
1 1 1 35 1  64 o 2  33.1332 8.72231 15.9946     24.6999  43.7621     19.3295  18.7556    99.6691     2.86158     99.6691     
1 1 1 35 1  65 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 1  66 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 2  0  f 0  15.9111 6.73241 4.86648     9.55538  4.86648     9.55538  41.3043    3.59989e-05 0           0           
1 1 1 35 2  1  o 11 91.2229 3.16989 147.953     14.4409  150.134     14.4524  68.2203    234.297     6.56624     234.297     
1 1 1 35 2  2  o 10 160.924 2.9704  465.427     23.8999  459.716     23.968   134.75     192.364     31.9838     192.364     
1 1 1 35 2  3  o 18 77.3836 3.34234 104.709     12.6589  110.314     13.1422  31.4261    161.664     47.8122     341.664     
1 1 1 35 2  4  o 4  95.7101 3.13961 160.446     13.716   167.624     16.2577  75.0144    222.146     13.4473     222.146     
1 1 1 35 2  5  o 11 78.9036 3.12805 112.809     12.657   110.351     11.9785  31.5185    238.759     50.0534     58.759      
1 1 1 35 2  6  o 9  173.688 2.78825 540.87      24.293   535.365     24.246   152.399    155.051     48.2446     155.051     
1 1 1 35 2  7  o 4  82.0587 3.17292 110.047     12.9988  131.854     12.9034  62.1766    335.73      9.64523     335.73      
1 1 1 35 2  8  o 3  19.6857 5.20184 -6.33957    8.01178  11.1445     7.98319  7.708      320.815     22.7429     320.815     
1 1 1 35 2  9  o 15 44.7287 4.26438 32.7224     9.26156  40.773      9.26062  19.0432    356.275     13.7558     176.275     
1 1 1 35 2  10 o 1  72.7395 3.08196 91.3578     11.123   98.4733     11.2345  50.1063    268.434     0.0132038   88.4334     
1 1 1 35 2  11 o 6  80.2686 3.03366 117.092     12.3676  113.802     11.9506  46.5583    22.7242     20.8977     202.724     
1 1 1 35 2  12 o 15 75.0595 3.0587  103.865     11.4385  98.2034     11.4668  51.2604    216.193     2.23325     36.1929     
1 1 1 35 2  13 o 7  62.1569 3.38344 65.6102     10.4188  73.6851     10.4708  25.3278    70.821      35.9453     250.821     
1 1 1 35 2  14 o 11 21.8261 5.66767 6.5021      8.10077  7.69147     8.16788  27.8833    135.711     79.9865     135.711     
1 1 1 35 2  15 o 15 119.781 2.77446 263.344     16.61    249.567     16.6434  91.0815    269.907     7.38516     269.907     
1 1 1 35 2  16 f 0  68.4357 3.64045 84.8491     12.7349  84.2435     12.0442  50.1457    192.43      0           0           
1 1 1 35 2  17 o 6  23.7752 5.99918 4.42428     9.60123  12.5713     9.04966  0.590916   158.177     13.4152     158.177     
1 1 1 35 2  18 o 17 53.6435 4.38365 55.3345     11.5557  50.0741     11.5515  42.2444    98.1892     16.4031     98.1892     
1 1 1 35 2  19 o 3  72.9474 3.95706 89.9676     15.0947  103.103     13.3638  50.8027    235.527     2.04434     55.5273     
1 1 1 35 2  20 o 5  50.2415 4.8833  47.4754     11.5523  45.944      12.3504  28.3446    31.2496     12.012      211.25      
1 1 1 35 2  21 o 8  101.706 3.41177 186.919     17.7548  185.398     16.9172  84.3573    77.7262     20.8996     77.7262     
1 1 1 35 2  22 o 9  87.7016 3.21869 139.213     13.9954  137.469     14.198   77.2869    186.152     28.5541     186.152     
1 1 1 35 2  23 o 11 29.6964 5.82953 9.28615     9.18204  24.0371     9.70782  2.31965    268.418     43.3313     268.418     
1 1 1 35 2  24 o 10 52.5931 4.10358 57.0141     10.8933  44.6641     10.3033  38.6025    9.42336     5.34542     9.42336     
1 1 1 35 2  25 o 1  39.5935 5.42173 50.8392     10.9395  12.4789     10.2012  12.6286    230.974     28.294      50.974      
1 1 1 35 2  26 o 13 16.9472 5.30774 1.37549     9.44841  -7.91914    8.80136  11.5725    273.546     40.1913     273.546     
1 1 1 35 2  27 o 2  125.693 3.10849 275.675     19.5209  292.976     19.5667  108.142    70.7827     33.5717     70.7827     
1 1 1 35 2  28 o 4  36.8674 5.41968 29.6839     9.90539  22.5181     9.48726  20.597     336.183     5.39253     156.183     
1 1 1 35 2  29 o 19 180.277 2.84581 581.357     25.7146  585.359     25.7055  163.91     102.142     64.8941     102.142     
1 1 1 35 2  30 o 6  89.2829 3.10593 141.291     13.8238  146.454     13.8823  47.3386    171.032     34.1486     351.032     
1 1 1 35 2  31 o 18 96.7343 2.99004 173.961     14.1399  163.507     14.7422  82.6675    112.38      26.6689     112.38      
1 1 1 35 2  32 o 2  18.0241 5.36449 6.20586     9.04171  -7.08837    8.47407  0.109443   210.795     2.00063     30.7951     
1 1 1 35 2  33 o 11 100.782 2.891   182.625     14.4734  183.471     14.6683  66.6479    11.2632     11.7035     191.263     
1 1 1 35 2  34 o 3  23.3184 5.9071  8.66023     8.62439  9.62162     8.89322  3.64883    318.399     17.8267     138.399     
1 1 1 35 2  35 o 3  39.0571 5.16592 22.8849     9.65813  36.1807     9.69495  18.3733    160.966     15.2699     340.966     
1 1 1 35 2  36 o 2  106.786 2.86594 205.297     15.3029  206.058     15.3154  94.7271    135.557     37.0856     135.557     
1 1 1 35 2  37 o 15 14.8006 4.84362 -5.70997    8.40755  -6.75875    8.57968  1.29164    104.156     7.35577     104.156     
1 1 1 35 2  38 o 15 99.1397 3.03713 182.299     15.3499  173.526     14.7592  82.3663    333.426     23.8786     333.426     
1 1 1 35 2  39 o 14 54.1146 4.20111 55.1108     10.935   53.8283     11.4583  48.1229    26.4549     23.8241     26.4549     
1 1 1 35 2  40 o 19 57.2905 4.09777 65.8088     11.1895  56.2139     11.8643  44.8464    64.8405     11.0031     64.8405     
1 1 1 35 2  41 o 12 50.7268 4.52586 55.3746     11.3319  41.9813     11.0008  27.4221    16.1295     15.1563     196.129     
1 1 1 35 2  42 o 3  88.5123 3.20701 144.278     14.2415  141.335     14.1143  68.5625    114.933     12.2942     114.933     
1 1 1 35 2  43 o 19 48.4967 4.62465 42.2716     10.8753  47.2657     11.005   32.9394    180.469     0.256089    0.468924    
1 1 1 35 2  44 o 8  52.6227 4.43249 61.3877     11.2712  44.1053     11.3089  36.2452    91.8024     0.296228    91.8024     
1 1 1 35 2  45 o 17 48.8225 4.71302 44.0035     11.0708  47.575      11.3861  40.1227    137.038     14.763      137.038     
1 1 1 35 2  46 o 4  38.387  5.97949 28.7514     11.5226  31.3269     10.8663  29.3126    110.673     9.5553      110.673     
1 1 1 35 2  47 o 14 27.7137 6.64138 15.6947     11.7328  15.3111     10.2667  8.51455    215.825     18.0379     35.8247     
1 1 1 35 2  48 o 11 42.7335 6.20253 38.2662     12.118   37.3133     13.5378  34.4698    8.91212     13.8075     8.91212     
1 1 1 35 2  49 o 15 55.2722 4.86593 56.2575     12.9995  63.1732     13.3511  40.2264    260.93      5.5162      260.93      
1 1 1 35 2  50 o 14 47.4803 5.47985 38.9085     12.2013  52.3163     12.8668  36.9751    82.7353     11.3526     82.7353     
1 1 1 35 2  51 o 8  34.8212 6.7797  27.2843     11.6021  25.4454     12.882   22.4482    270.391     2.00712     270.391     
1 1 1 35 2  52 o 3  18.0205 5.72174 -0.535928   10.303   -3.55115    11.2783  2.63704    343.233     6.06885     163.233     
1 1 1 35 2  53 o 10 28.607  6.78406 22.2265     12.2457  12.8025     10.9846  14.3531    315.711     3.47763     135.711     
1 1 1 35 2  54 o 14 36.3737 6.3633  34.513      11.8336  22.6745     11.516   17.7179    33.5725     10.8268     213.572     
1 1 1 35 2  55 o 14 17.4438 5.55982 -12.1143    10.8769  3.08351     10.5948  2.29491    65.24       8.82062     245.24      
1 1 1 35 2  56 o 13 66.9479 4.72127 85.7773     15.3355  89.4451     15.9241  47.0638    342.494     3.92178     342.494     
1 1 1 35 2  57 o 10 69.4886 4.43686 96.6088     14.8967  90.5094     15.6102  49.118     326.085     4.61167     326.085     
1 1 1 35 2  58 o 15 31.2212 6.95586 24.5959     12.1943  19.1376     12.2739  21.7415    123.286     9.47676     123.286     
1 1 1 35 2  59 o 19 36.8246 7.2244  24.8232     14.5842  38.2078     13.7513  27.0457    181.247     9.73057     181.247     
1 1 1 35 2  60 o 2  19.8198 6.37263 -2.24345    13.0349  -0.404537   14.5933  4.31211    147.245     11.1237     327.245     
1 1 1 35 2  61 o 4  19.6069 6.37528 2.39914     14.2833  -9.44479    14.9436  4.20539    345.589     8.13237     165.589     
1 1 1 35 2  62 o 15 23.3035 7.29282 7.80402     18.801   6.31959     14.844   7.08035    286.554     1.19395     106.554     
1 1 1 35 2  63 o 8  28.703  8.26452 26.4298     21.1321  18.1735     16.2076  10.3277    228.217     3.61368     228.217     
1 1 1 35 2  64 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 2  65 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 3  0  o 1  38.7755 6.12926 30.6655     10.4018  30.6655     10.4018  13.6729    1.18067e-05 25.2508     180         
1 1 1 35 3  1  o 7  78.8355 3.41551 124.659     13.6221  99.5315     13.1503  47.2767    336.405     18.089      156.405     
1 1 1 35 3  2  o 11 154.107 2.9956  424.437     22.5103  424.978     23.7004  120.352    40.0753     12.4024     40.0753     
1 1 1 35 3  3  o 2  41.6676 5.07345 31.9921     9.84809  32.7001     10.5704  3.55938    189.694     62.9242     189.694     
1 1 1 35 3  4  o 11 39.582  5.37863 23.5975     10.3171  35.7011     10.1553  16.4764    326.26      3.06143     146.26      
1 1 1 35 3  5  o 4  48.1384 4.84078 39.7588     10.5101  45.8828     12.2024  21.7956    278.95      18.8502     98.9497     
1 1 1 35 3  6  o 5  121.341 2.98127 272.25      18.1398  254.796     18.0504  93.0129    289.259     7.87525     289.259     
1 1 1 35 3  7  o 7  101.894 3.03387 187.81      15.3131  184.095     15.5959  94.9907    119.105     43.8199     119.105     
1 1 1 35 3  8  o 11 54.4668 4.23026 62.17       10.3715  46.5846     11.799   40.5345    206.835     13.3602     206.835     
1 1 1 35 3  9  o 6  84.7377 3.16448 127.352     12.9813  130.376     13.795   63.5925    41.996      5.74679     41.996      
1 1 1 35 3  10 o 14 82.4873 3.26521 109.921     12.7397  135.222     14.1476  51.2692    77.5317     16.5017     257.532     
1 1 1 35 3  11 o 10 41.6622 5.12335 40.8123     9.80723  24.8549     10.4121  3.0431     190.257     50.2676     10.2568     
1 1 1 35 3  12 o 6  31.176  6.05162 17.7217     10.0695  19.1702     9.43867  8.0102     134.92      14.7264     314.92      
1 1 1 35 3  13 o 13 62.5481 3.96772 72.2815     12.3277  69.7947     12.2798  47.5544    243.618     8.72324     243.618     
1 1 1 35 3  14 o 9  18.963  5.70178 -1.23862    10.1298  2.047       8.92503  0.475419   142.683     2.51673     142.683     
1 1 1 35 3  15 o 3  121.809 3.13892 271.886     19.1898  260.505     19.0641  90.4691    73.6492     1.44011     73.6491     
1 1 1 35 3  16 o 11 44.0008 5.15429 35.8368     10.7775  36.5691     11.158   26.7947    290.791     4.64778     110.791     
1 1 1 35 3  17 o 14 71.7677 3.61911 86.8186     13.1587  99.6395     12.6017  52.3425    55.9344     1.4865      55.9346     
1 1 1 35 3  18 o 4  38.2079 5.12857 25.9886     9.47504  29.0451     9.43867  21.6571    239.439     5.63156     59.439      
1 1 1 35 3  19 o 13 77.4533 3.40327 116.869     13.388   99.9494     12.8732  37.5962    335.804     37.6254     155.804     
1 1 1 35 3  20 o 9  17.9198 5.2497  6.53097     8.38888  -7.18873    8.29127  8.87739    14.3063     35.504      14.3063     
1 1 1 35 3  21 o 17 25.1288 5.96116 15.1909     8.50912  5.21094     10.2649  6.18898    56.7387     11.1889     236.739     
1 1 1 35 3  22 o 8  72.6407 3.41281 103.547     12.6173  87.6212     12.0616  70.0195    322.575     38.0237     322.575     
1 1 1 35 3  23 o 11 23.9578 5.65482 3.79653     8.30428  15.3065     8.60104  3.76925    289.549     16.9554     109.549     
1 1 1 35 3  24 o 11 80.4854 3.21605 128.801     12.2647  105.588     13.3305  65.1206    218.589     14.5612     218.589     
1 1 1 35 3  25 o 6  57.5525 4.00444 60.6696     12.2651  60.7111     10.4402  52.8692    26.9566     27.9468     26.9566     
1 1 1 35 3  26 o 8  65.7135 3.56659 82.9441     11.4594  74.2172     11.7962  60.7429    185.921     30.1266     185.921     
1 1 1 35 3  27 o 12 108.69  2.97332 210.166     15.6875  215.342     16.6373  96.7501    185.429     35.9501     185.429     
1 1 1 35 3  28 o 8  53.0624 4.14416 67.6019     10.3469  38.2765     10.4502  43.5521    357.683     14.9476     357.683     
1 1 1 35 3  29 o 15 158.824 2.81105 444.009     22.8568  463.059     21.8275  121.186    256.976     10.3356     256.976     
1 1 1 35 3  30 o 2  53.5598 4.18891 47.9256     11.3284  58.415      10.5555  42.4242    27.0732     11.4748     27.0732     
1 1 1 35 3  31 o 7  66.2951 3.55581 78.4712     11.9677  81.8958     11.4594  50.6675    283.451     7.76011     283.451     
1 1 1 35 3  32 o 2  46.9996 5.08092 39.1758     11.375   44.7245     11.7844  36.4921    224.317     10.4236     224.317     
1 1 1 35 3  33 o 5  43.4013 4.89364 38.6245     10.5466  32.9182     10.0143  29.3829    287.351     0.881109    287.351     
1 1 1 35 3  34 o 5  24.4525 6.17202 8.91327     10.2104  11.4256     9.0219   13.2899    137.489     58.6413     137.489     
1 1 1 35 3  35 o 3  34.9949 5.82683 19.6513     10.5532  28.5306     9.72371  12.5274    210.113     21.2632     30.1126     
1 1 1 35 3  36 o 9  17.5474 5.3871  1.56318     8.86304  -2.75002    8.84961  0.206783   38.602      11.477      218.602     
1 1 1 35 3  37 o 14 44.7351 5.07132 35.7761     11.512   40.7948     10.2969  25.6152    80.4229     9.69113     260.423     
1 1 1 35 3  38 o 11 16.7806 5.28508 0.836495    9.14759  -7.08434    9.15103  0.600133   323.234     8.6144      143.234     
1 1 1 35 3  39 o 17 133.703 2.88766 324.302     19.656   322.598     18.9912  106.908    322.904     22.244      322.904     
1 1 1 35 3  40 o 19 63.8183 3.87435 78.9602     12.5509  71.9973     11.9906  50.7072    298.532     12.3116     298.532     
1 1 1 35 3  41 o 12 17.2742 5.4092  -1.43903    9.26868  -1.78501    9.2706   4.70638    321.442     29.3642     321.442     
1 1 1 35 3  42 o 9  30.863  6.26298 20.6123     10.3317  18.1497     10.0727  8.40864    90.7286     5.95228     90.7286     
1 1 1 35 3  43 o 2  52.5499 4.6988  48.058      11.9101  57.9742     12.2066  52.9341    38.3455     37.096      38.3455     
1 1 1 35 3  44 o 4  49.6878 4.803   53.4972     11.7249  42.197      11.4409  27.5423    218.096     13.4453     38.096      
1 1 1 35 3  45 o 7  57.8632 4.4311  77.4482     12.4458  51.5402     12.3272  35.5607    342.447     9.14924     162.447     
1 1 1 35 3  46 o 4  30.7136 5.64734 2.63308     10.5976  34.1794     10.4949  16.2009    293.206     6.65753     113.206     
1 1 1 35 3  47 f 0  64.9644 4.19801 80.8048     13.217   79.8676     13.8013  37.9437    17.9033     0           0           
1 1 1 35 3  48 o 16 25.3797 6.60965 19.2076     12.4028  4.67129     10.5794  13.2393    299.277     2.13091     299.277     
1 1 1 35 3  49 o 2  25.3839 6.56742 7.27135     11.8372  16.4158     10.7358  10.2059    24.0859     9.03342     204.086     
1 1 1 35 3  50 o 12 28.9305 6.77821 20.0414     12.0733  15.8227     10.8494  16.153     243.821     0.695636    63.8205     
1 1 1 35 3  51 o 4  91.9431 3.87995 166.218     18.4128  153.672     17.1856  76.2946    111.774     25.9051     111.774     
1 1 1 35 3  52 o 6  33.4221 6.70924 30.8492     11.6163  17.8685     12.847   21.3       186.333     3.36791     186.333     
1 1 1 35 3  53 o 8  24.0777 6.65715 5.51447     11.0836  14.5458     12.4894  8.1595     310.474     1.81284     310.474     
1 1 1 35 3  54 o 15 38.0834 6.79387 34.0195     12.035   29.6014     14.0641  23.8994    93.2494     0.68518     273.249     
1 1 1 35 3  55 o 1  24.6781 6.78483 9.71624     11.2997  12.4825     12.7735  12.8147    102.786     2.66074     102.786     
1 1 1 35 3  56 o 16 36.4186 6.81928 33.0107     12.2581  25.9803     13.2689  25.7827    156.357     6.37548     156.357     
1 1 1 35 3  57 o 19 21.5589 6.47552 4.40201     11.4153  5.94568     12.9502  8.50624    103.544     3.71138     283.544     
1 1 1 35 3  58 o 3  35.0078 7.3006  38.8478     14.7795  19.4957     13.6279  15.9013    277.128     12.7039     97.1277     
1 1 1 35 3  59 o 14 25.0491 7.34744 13.5196     15.0456  9.52877     15.3135  3.67193    202.625     22.6758     22.6252     
1 1 1 35 3  60 o 19 17.8755 5.97361 -8.14748    13.848   -7.72821    14.3186  2.06024    96.1682     3.47385     276.168     
1 1 1 35 3  61 o 6  24.5632 7.52922 20.2067     18.5021  -0.375562   16.4833  8.29153    217.802     0.142171    37.8021     
1 1 1 35 3  62 o 12 25.3687 7.82377 9.79273     19.1995  15.8146     18.4501  8.95659    336.346     2.3639      156.346     
1 1 1 35 3  63 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 4  0  o 16 95.0922 3.30377 162.322     15.6569  162.322     15.6569  82.2045    180         21.152      180         
1 1 1 35 4  1  o 8  94.4167 3.37161 151.094     16.1907  169.789     15.5195  69.3542    158.715     0.396672    158.715     
1 1 1 35 4  2  o 16 82.8313 3.47643 122.647     13.7209  124.548     14.9895  61.3431    168.105     2.50935     168.106     
1 1 1 35 4  3  o 13 87.8085 3.27151 144.108     14.2917  133.189     14.3773  53.7621    111.087     21.1949     291.087     
1 1 1 35 4  4  o 14 72.3493 3.73215 100.772     14.2878  88.73       12.6029  34.2931    85.5946     36.6528     265.595     
1 1 1 35 4  5  o 16 55.0598 4.64103 63.3698     11.8441  48.5388     12.8427  36.0916    111.792     4.00101     291.792     
1 1 1 35 4  6  o 14 49.1543 4.5978  46.4955     11.2739  42.606      10.8212  28.0792    259.206     11.112      79.2058     
1 1 1 35 4  7  o 9  23.1562 6.16766 9.64523     10.4703  5.63141     9.05569  1.32234    296.383     6.55409     116.383     
1 1 1 35 4  8  o 18 74.4745 4.02637 89.643      15.8835  112.259     13.3267  71.827     52.1163     38.8247     52.1163     
1 1 1 35 4  9  o 19 73.9022 4.39952 93.4482     15.6451  105.951     16.6382  47.2444    171.559     12.8877     351.559     
1 1 1 35 4  10 o 4  24.9919 6.4206  15.8779     11.3342  2.01513     10.533   4.30551    357.815     4.10333     177.815     
1 1 1 35 4  11 o 14 97.2705 3.37182 166.383     15.8031  174.31      16.9687  56.4079    304.511     30.9987     124.511     
1 1 1 35 4  12 o 4  61.761  4.24443 80.4168     11.7458  59.664      13.5285  45.6651    179.092     3.42585     179.092     
1 1 1 35 4  13 o 17 65.9283 3.91664 76.745      11.5938  81.3178     13.9848  31.3244    232.82      33.1737     52.82       
1 1 1 35 4  14 o 6  74.6708 3.28487 103.099     11.2151  97.9944     13.1067  62.5061    6.274       17.385      6.274       
1 1 1 35 4  15 o 18 117.064 2.82013 252.002     15.8913  239.346     17.0858  86.9839    226.707     0.861133    226.707     
1 1 1 35 4  16 o 13 15.6466 4.75677 4.22414     7.0362   -14.096     8.45714  4.37604    326.056     17.4662     326.056     
1 1 1 35 4  17 o 8  117.335 2.83944 261.329     16.3488  232.983     16.913   104.908    160.037     37.1371     160.037     
1 1 1 35 4  18 o 14 114.543 2.91212 240.297     16.7261  230.917     16.6483  99.1836    113.407     29.9384     113.407     
1 1 1 35 4  19 o 10 28.3225 5.85487 16.1586     8.64902  14.3325     9.05127  11.0648    177.914     0.185939    357.914     
1 1 1 35 4  20 o 4  57.4678 3.56556 60.922      9.81661  59.2314     10.4863  27.7587    10.5516     26.829      190.552     
1 1 1 35 4  21 o 4  37.0563 5.23168 30.0158     8.6734   22.4231     9.981    18.9299    122.366     10.735      302.366     
1 1 1 35 4  22 o 14 37.9164 5.06133 23.7091     8.57599  31.1341     9.98053  11.3497    63.6019     29.0856     243.602     
1 1 1 35 4  23 o 19 18.674  5.25029 7.95506     7.66876  -4.50395    8.37122  4.87827    334.601     28.4903     334.601     
1 1 1 35 4  24 o 18 103.768 2.9332  196.28      15.1856  191.586     15.257   79.248     66.5855     6.88125     66.5855     
1 1 1 35 4  25 f 0  66.5548 3.48889 80.4309     11.72    80.7669     11.384   50.9397    246.856     0           0           
1 1 1 35 4  26 o 3  49.2081 4.50466 42.9154     11.4735  47.4177     10.0304  37.1781    245.882     7.20254     245.882     
1 1 1 35 4  27 f 0  27.1877 6.0901  13.689      8.25163  14.238      10.4139  14.9203    350.266     0           0           
1 1 1 35 4  28 o 4  31.9803 5.55723 21.4009     8.49459  18.3766     9.23697  18.3581    348.178     0.904559    168.178     
1 1 1 35 4  29 o 5  29.8797 5.7012  21.0423     8.54938  13.574      9.24683  14.6871    78.3081     5.78306     258.308     
1 1 1 35 4  30 o 10 20.901  5.59006 1.31309     7.78708  10.5245     8.81776  3.31015    200.413     4.29122     20.4127     
1 1 1 35 4  31 o 4  33.7736 5.43404 30.0992     8.86526  14.6452     9.53913  22.6041    31.9983     6.2648      31.9983     
1 1 1 35 4  32 o 6  42.004  4.81259 26.4017     9.2924   41.352      10.1054  25.0671    197.995     6.68704     17.9945     
1 1 1 35 4  33 o 8  51.2558 4.12282 49.4215     10.041   48.18       10.7332  40.5766    176.34      10.9912     176.34      
1 1 1 35 4  34 o 13 35.062  5.51545 25.2405     9.0034   22.8384     9.88623  24.504     174.093     6.60105     174.093     
1 1 1 35 4  35 o 10 21.5595 5.77787 4.87896     8.03217  9.07479     9.19283  3.42248    175.61      0.967699    355.61      
1 1 1 35 4  36 o 19 15.9143 5.03433 -0.00206277 7.85894  -6.75972    8.97616  1.97592    169.773     17.5564     169.773     
1 1 1 35 4  37 o 13 81.61   3.23985 118.827     12.3161  124.089     14.0491  63.3368    65.0384     10.3424     65.0384     
1 1 1 35 4  38 o 12 28.9802 6.01574 10.1834     8.69891  23.5773     10.5135  18.3631    33.8743     7.74146     33.8743     
1 1 1 35 4  39 o 1  40.0373 5.20821 31.257      9.21317  31.3422     10.8659  20.2024    184.722     14.3511     4.72168     
1 1 1 35 4  40 o 12 36.3611 5.81932 21.2726     10.2764  32.2577     10.5769  22.7649    109.661     2.55851     289.661     
1 1 1 35 4  41 o 8  54.7875 4.58943 65.9835     12.2712  49.1811     12.1736  47.6064    224.016     19.9502     224.016     
1 1 1 35 4  42 o 14 19.2109 5.58362 9.0943      9.28813  -6.78599    9.55566  5.6902     89.3505     5.87074     269.35      
1 1 1 35 4  43 o 13 42.5378 5.61964 30.8326     10.973   42.3844     12.1059  31.9325    143.826     6.9631      143.826     
1 1 1 35 4  44 o 10 29.1374 6.27852 24.9619     10.3716  8.93097     11.2368  12.0868    12.6404     13.1876     192.64      
1 1 1 35 4  45 f 0  22.1987 5.85391 -9.33479    9.74088  18.6311     11.0789  16.6136    252.372     0           0           
1 1 1 35 4  46 o 8  26.2482 6.47117 13.7814     10.4671  14.0038     10.4378  14.389     28.7317     5.01215     28.7317     
1 1 1 35 4  47 o 17 36.5396 6.36227 26.8011     11.7757  30.14       11.4028  27.1546    217.861     8.63999     217.861     
1 1 1 35 4  48 o 7  28.1011 6.56993 16.1388     10.7878  17.2229     10.738   8.34744    150.012     18.6501     330.012     
1 1 1 35 4  49 o 18 41.348  5.90711 44.4084     11.6608  27.5501     11.9516  24.9404    178.894     4.5232      358.894     
1 1 1 35 4  50 o 15 40.9538 6.20287 26.2921     12.7803  45.6917     12.1137  16.1646    232.463     22.1231     52.4628     
1 1 1 35 4  51 o 19 15.8192 5.32159 -9.58572    11.1256  -12.1457    11.9884  0.562389   65.1128     3.77071     245.113     
1 1 1 35 4  52 o 1  33.3045 6.95685 26.4427     12.5703  23.0314     12.2941  17.5345    282.652     6.80908     102.652     
1 1 1 35 4  53 o 19 25.2939 6.84341 7.13231     12.3956  16.2948     12.3414  13.4991    71.5605     1.89858     71.5605     
1 1 1 35 4  54 o 11 43.9574 6.57849 54.3016     14.1674  30.618      14.1293  34.7509    307.746     12.6962     307.746     
1 1 1 35 4  55 o 17 33.9184 6.99541 8.71575     12.9029  44.247      15.5147  21.7229    73.2258     1.34238     73.2258     
1 1 1 35 4  56 o 1  23.3963 6.85155 0.0518925   12.3235  15.849      14.5723  8.56612    116.593     2.93179     116.593     
1 1 1 35 4  57 o 7  23.9463 7.16088 8.50331     14.0929  9.399       15.5077  8.66796    69.3501     9.60672     249.35      
1 1 1 35 4  58 o 16 22.8467 6.82206 17.7214     14.2798  -12.6738    16.084   3.97115    114.243     0.9719      114.243     
1 1 1 35 4  59 o 13 24.6476 7.51753 5.17249     14.3953  17.8484     19.1777  9.82562    24.6841     3.61879     204.684     
1 1 1 35 4  60 o 2  21.7233 7.07983 -2.65101    16.5884  5.14845     19.0077  2.51799    65.5568     0.739323    245.557     
1 1 1 35 4  61 o 7  20.7289 7.04509 -11.7003    23.1824  -7.32341    19.687   2.94047    124.745     11.1024     304.745     
1 1 1 35 4  62 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 5  0  o 8  137.685 2.75275 338.319     18.9596  338.319     18.9596  100.151    7.59856e-06 7.43541     180         
1 1 1 35 5  1  o 12 120.719 2.95045 262.093     17.852   260.699     17.7932  82.3841    330.188     15.4301     150.187     
1 1 1 35 5  2  o 19 37.7019 5.11672 26.4953     8.59256  27.1467     10.019   10.4447    261.876     30.9528     81.8757     
1 1 1 35 5  3  o 9  79.4127 3.3422  118.813     12.456   108.754     13.8919  65.3258    304.149     14.6613     304.149     
1 1 1 35 5  4  o 7  21.4799 5.50158 12.6215     8.20243  -2.63846    8.93956  1.15997    246.113     16.314      66.113      
1 1 1 35 5  5  o 6  47.811  4.35251 43.4471     9.82438  40.8391     10.497   24.5228    338.412     18.3937     158.412     
1 1 1 35 5  6  o 2  73.103  3.6302  100.066     12.6545  93.5606     13.6991  69.6316    316.82      34.6034     316.82      
1 1 1 35 5  7  o 16 75.6738 3.3222  93.2729     11.8127  113.931     13.2695  64.6842    295.796     19.5578     295.796     
1 1 1 35 5  8  o 17 84.3189 3.36734 122.857     12.7979  133.862     15.5051  76.7431    299.418     30.5779     299.418     
1 1 1 35 5  9  o 18 42.3207 5.50178 33.588      11.5825  34.348      10.8819  30.191     168.494     5.15464     168.494     
1 1 1 35 5  10 o 8  48.235  4.60167 51.7094     9.55665  35.259      11.2678  33.4293    6.31207     0.23539     6.31201     
1 1 1 35 5  11 o 15 59.8199 3.77827 67.5911     10.3961  62.7903     11.8798  37.2367    46.1584     11.6468     226.158     
1 1 1 35 5  12 o 16 71.2088 3.25527 86.6614     11.1542  96.6474     11.9586  54.7377    335.51      6.23458     335.51      
1 1 1 35 5  13 o 17 99.0574 2.93757 176.487     14.3746  176.257     14.7234  80.2658    18.5171     14.4837     18.5171     
1 1 1 35 5  14 f 0  62.2732 3.56991 69.2911     10.6775  71.6442     11.4103  47.9344    97.6015     0           0           
1 1 1 35 5  15 o 11 83.4492 3.09578 123.806     12.7356  127.284     13.0675  48.5356    50.3172     25.6959     230.317     
1 1 1 35 5  16 o 4  52.6666 3.8362  51.2952     9.33932  50.2606     10.5564  38.614     273.657     3.4633      273.657     
1 1 1 35 5  17 o 10 86.2237 3.05056 133.204     11.9676  134.859     14.22    67.7312    307.967     9.33152     307.967     
1 1 1 35 5  18 o 17 71.9534 3.39959 89.4483     11.3897  98.4375     12.9884  60.951     349.891     18.3235     349.891     
1 1 1 35 5  19 o 3  42.7627 4.92043 31.8891     9.25154  37.1975     11.1233  25.0167    303.242     8.43504     123.242     
1 1 1 35 5  20 o 13 36.0789 5.40402 26.6029     8.41177  23.4167     10.4838  18.0126    140.283     11.5361     320.283     
1 1 1 35 5  21 o 7  18.1778 5.3535  -4.81212    7.18978  7.14637     9.55151  0.129415   73.8187     9.18131     253.819     
1 1 1 35 5  22 o 5  53.6879 4.11985 44.9916     9.45813  62.1802     12.4205  37.1195    190.187     1.40911     10.1871     
1 1 1 35 5  23 o 10 18.0175 5.45377 1.57157     8.10869  -0.844753   9.50244  0.276937   58.1469     12.422      58.1469     
1 1 1 35 5  24 o 6  67.1587 3.89413 95.5363     10.7968  70.7407     14.0896  52.3922    282.071     8.61972     282.071     
1 1 1 35 5  25 f 0  68.8117 3.59111 82.896      11.5504  90.0997     13.0415  48.8314    50.6092     0           0           
1 1 1 35 5  26 o 18 65.097  3.74311 72.2398     10.5159  83.308      13.654   53.6174    175.127     14.6805     175.127     
1 1 1 35 5  27 o 6  81.2543 3.40388 121.975     13.1325  118.361     14.4065  72.0218    126.714     27.1124     126.714     
1 1 1 35 5  28 o 7  80.7984 3.18663 121.774     11.9902  115.21      13.5994  68.514     57.7373     20.6762     57.7373     
1 1 1 35 5  29 f 0  64.858  3.59483 77.2267     10.6828  76.7902     12.4143  44.3633    44.7624     0           0           
1 1 1 35 5  30 o 7  45.4411 4.56211 31.7726     9.27136  46.7147     10.8736  29.8855    183.481     2.68194     3.48128     
1 1 1 35 5  31 o 11 25.8491 6.01014 14.6446     8.51878  9.97308     9.82006  4.07096    139.142     24.2241     319.142     
1 1 1 35 5  32 o 9  34.5543 5.83763 22.5708     9.31549  24.7157     10.6292  16.9007    245.575     11.8158     65.5747     
1 1 1 35 5  33 o 9  58.5672 3.87436 59.3151     10.3974  67.6914     12.0908  49.656     74.8667     17.3835     74.8667     
1 1 1 35 5  34 o 15 20.9118 5.75075 7.87777     8.01574  3.25208     9.63371  6.12772    342.074     5.73782     162.074     
1 1 1 35 5  35 o 16 22.3389 5.88178 10.7826     8.47799  4.20675     9.67035  8.22722    333.47      6.59187     153.47      
1 1 1 35 5  36 f 0  29.4647 6.03305 14.0084     8.7121   21.0053     10.232   20.7909    194.408     0           0           
1 1 1 35 5  37 o 13 16.6752 5.20195 -10.2749    8.39855  3.9992      9.41443  0.411536   62.5225     15.6347     242.523     
1 1 1 35 5  38 o 18 49.3671 4.62442 40.6725     10.6056  52.9296     11.6661  28.3914    77.8006     12.3546     257.801     
1 1 1 35 5  39 o 12 15.101  4.93339 -6.35404    7.80339  -4.12626    9.5489   0.662421   225.814     2.38726     45.8141     
1 1 1 35 5  40 o 1  76.4955 3.55429 104.383     13.0336  112.751     14.0708  56.1294    215.611     3.5236      215.611     
1 1 1 35 5  41 o 16 25.3505 6.35404 9.96623     9.38349  14.8732     10.8758  7.62534    72.6685     4.06413     72.6685     
1 1 1 35 5  42 o 2  28.1161 6.50413 14.1393     9.31164  18.7682     11.8023  10.4663    222.663     15.2014     42.6632     
1 1 1 35 5  43 f 0  54.2257 4.37948 53.7725     10.858   59.3921     12.5123  31.1709    314.934     0           0           
1 1 1 35 5  44 o 8  21.9977 6.08745 7.64814     8.90109  7.71116     10.6137  7.29814    68.9903     10.0181     248.99      
1 1 1 35 5  45 o 8  33.881  6.34213 22.6734     10.2708  26.5235     11.6097  26.2029    83.0525     14.2389     83.0525     
1 1 1 35 5  46 o 8  22.4047 6.18004 -2.05455    10.6508  15.022      11.009   6.40579    143.786     12.4786     323.786     
1 1 1 35 5  47 o 5  19.5377 5.94284 -0.605515   10.4443  4.82214     10.7175  2.63893    137.064     14.9652     317.064     
1 1 1 35 5  48 o 13 34.372  7.0574  18.9715     11.4899  34.9477     14.6041  23.8946    312.239     7.37099     312.239     
1 1 1 35 5  49 o 8  21.4291 6.20837 12.9734     11.2178  -7.48758    12.3425  6.30216    302.438     1.92065     122.438     
1 1 1 35 5  50 o 1  40.6764 6.47596 37.7772     12.1631  33.6811     13.6318  24.5024    45.5222     4.44626     225.522     
1 1 1 35 5  51 o 5  30.1875 7.10144 22.2988     11.9986  17.719      13.4314  13.9726    274.646     9.84982     94.646      
1 1 1 35 5  52 o 5  67.0021 5.47851 83.1317     18.4947  98.9987     17.2243  46.1771    89.4094     0.411963    89.4093     
1 1 1 35 5  53 o 17 37.9617 7.37446 40.4497     14.7086  26.4792     14.787   27.415     255.471     6.78087     255.471     
1 1 1 35 5  54 f 0  17.2674 5.72599 -11.0289    12.8526  -4.80475    12.3021  15.8607    17.2781     0           0           
1 1 1 35 5  55 o 7  16.6422 5.55105 -6.28602    11.8295  -10.6931    12.3696  0.784936   315.777     15.0447     135.777     
1 1 1 35 5  56 o 1  22.4828 6.87261 6.01684     13.1698  6.58502     15.2067  9.00238    4.8748      1.69858     184.875     
1 1 1 35 5  57 o 5  24.9083 7.37562 13.4944     15.2871  10.7851     15.6898  10.8401    328.817     2.94168     148.817     
1 1 1 35 5  58 o 9  20.4257 6.78377 -8.64928    16.6677  0.434366    18.5483  4.36038    137.156     8.13175     317.156     
1 1 1 35 5  59 o 15 40.024  7.95395 75.6445     20.4972  11.6145     22.3751  26.8625    206.884     5.55737     206.884     
1 1 1 35 5  60 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 5  61 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 6  0  f 0  84.2264 3.2059  127.752     13.4417  127.752     13.4417  68.1949    180         0           0           
1 1 1 35 6  1  o 14 56.0623 3.75191 54.1705     10.7884  60.6141     9.93177  29.2698    185.908     22.6605     5.90792     
1 1 1 35 6  2  o 19 51.8616 4.13884 55.0762     10.597   44.1457     10.434   46.7954    132.714     23.4478     132.714     
1 1 1 35 6  3  o 3  96.7259 3.1644  170.844     16.5235  166.475     13.9893  92.617     111.923     42.665      111.923     
1 1 1 35 6  4  o 18 65.5898 3.49389 71.7976     11.6687  84.5848     10.9903  37.3714    162.539     21.2705     342.539     
1 1 1 35 6  5  o 9  38.3699 5.19354 34.969      9.37851  21.5598     9.72905  25.2541    49.6957     0.868448    49.6958     
1 1 1 35 6  6  o 8  51.9929 4.05669 50.227      10.0312  49.1162     10.7304  39.9054    74.1273     6.92363     74.1273     
1 1 1 35 6  7  o 18 19.9032 5.54534 1.37187     7.66777  7.46816     8.80618  7.72173    109.308     38.391      109.308     
1 1 1 35 6  8  o 5  50.1227 3.88491 44.1102     9.30926  48.1027     9.89074  36.4376    278.909     2.65362     278.909     
1 1 1 35 6  9  o 16 71.3835 3.25169 91.1789     11.3301  93.2        11.8099  57.9977    86.443      12.1705     86.443      
1 1 1 35 6  10 o 14 55.9153 3.76562 54.0793     9.94719  60.3201     10.909   42.8944    197.238     6.38568     197.238     
1 1 1 35 6  11 o 13 40.4716 4.62416 25.7643     8.56856  36.1151     9.50195  7.45789    166.757     42.4228     346.757     
1 1 1 35 6  12 o 1  47.7306 4.2655  35.0431     9.70334  49.9974     9.99749  37.3457    90.4822     9.27551     90.4822     
1 1 1 35 6  13 o 9  129.485 2.73986 308.956     17.3971  293.483     18.0861  110.355    204.466     27.9419     204.466     
1 1 1 35 6  14 o 16 29.1778 5.70116 20.2346     8.64978  12.5215     8.90294  14.1881    170.072     3.81691     350.072     
1 1 1 35 6  15 o 12 67.9961 3.34837 77.8243     11.2128  90.2968     11.4279  53.9404    4.65146     9.4758      4.65146     
1 1 1 35 6  16 o 15 42.5745 4.72509 36.7932     9.90877  31.5483     9.57048  21.2209    224.51      16.9101     44.5101     
1 1 1 35 6  17 o 12 90.9169 3.05033 146.792     13.3894  151.865     14.3238  79.2995    186.073     25.2289     186.073     
1 1 1 35 6  18 o 15 57.1957 4.07904 56.1423     11.7466  64.6658     11.2048  23.0018    222.142     36.9744     42.1423     
1 1 1 35 6  19 o 6  46.558  4.70053 33.7406     9.55412  48.3964     11.7823  28.3835    135.842     8.41614     315.842     
1 1 1 35 6  20 o 15 88.725  3.26819 145.544     13.8391  140.004     15.0643  83.5186    284.014     37.7531     284.014     
1 1 1 35 6  21 o 15 38.8214 4.96938 24.9752     8.69435  32.7995     9.94717  17.3753    53.6215     18.7129     233.622     
1 1 1 35 6  22 o 17 28.2115 6.02482 15.2568     8.65197  15.5326     9.83189  2.22526    186.395     42.2946     186.395     
1 1 1 35 6  23 f 0  54.0192 4.04994 48.7085     9.6103   59.5736     12.0065  42.8901    169.476     0           0           
1 1 1 35 6  24 o 8  89.7453 3.04219 141.71      13.0516  149.973     14.232   71.0764    83.7315     11.0207     83.7315     
1 1 1 35 6  25 o 17 37.8249 5.17501 24.6572     8.74747  30.6483     10.1852  29.0169    238.077     18.1763     238.077     
1 1 1 35 6  26 o 8  84.671  3.3264  133.316     13.0231  127.602     14.9655  83.0909    9.29707     44.1296     9.29707     
1 1 1 35 6  27 o 18 45.3497 5.10259 40.7888     10.7016  37.8518     11.6401  33.8224    240.316     5.73286     240.316     
1 1 1 35 6  28 o 8  63.0006 3.96133 68.2212     10.5611  78.6909     14.1142  40.4435    205.92      9.58437     25.92       
1 1 1 35 6  29 o 7  42.6078 5.10779 34.742      9.28182  35.0094     11.6255  26.3758    314.094     5.88807     134.094     
1 1 1 35 6  30 o 12 26.3018 6.13576 7.4467      8.68508  18.8229     10.5969  6.21399    135.529     20.9994     315.529     
1 1 1 35 6  31 o 14 50.8722 4.47473 44.8313     10.0905  52.8522     12.2452  32.0958    263.319     7.65425     83.319      
1 1 1 35 6  32 o 10 35.4399 5.7682  32.5148     9.06887  17.3014     11.5092  14.5521    245.207     19.3294     65.2074     
1 1 1 35 6  33 o 13 40.1493 5.57271 41.1262     9.46769  23.0715     11.7866  34.0232    279.404     15.5769     279.404     
1 1 1 35 6  34 o 17 45.3675 5.04055 36.5208     10.0531  43.3322     12.1269  29.5423    31.8001     4.1922      211.8       
1 1 1 35 6  35 o 2  34.8021 5.98772 29.729      9.40451  19.1635     11.7436  12.9056    87.6265     21.868      267.627     
1 1 1 35 6  36 o 11 42.5762 5.38679 37.779      9.66617  33.8495     12.2144  22.131     354.43      15.048      174.43      
1 1 1 35 6  37 o 12 70.3475 3.69058 83.2087     11.5596  101.492     14.3035  49.8631    236.976     0.842194    56.976      
1 1 1 35 6  38 o 6  62.1907 4.16153 75.0308     11.2521  71.3399     14.0566  49.3059    326.813     10.6618     326.813     
1 1 1 35 6  39 o 13 23.4121 5.95607 14.3621     8.70688  3.35491     10.4442  7.14329    345.423     14.6291     165.423     
1 1 1 35 6  40 o 16 29.5358 6.22511 25.7665     9.92578  8.59288     12.0182  15.0686    265.949     7.82154     85.9486     
1 1 1 35 6  41 o 14 25.7966 6.47028 13.6417     9.78366  12.6743     11.2599  11.4621    133.222     8.51807     313.222     
1 1 1 35 6  42 o 8  70.7666 3.79967 93.7842     12.5684  95.0711     14.1313  54.5298    62.9959     9.22917     62.9959     
1 1 1 35 6  43 o 18 23.2173 6.41416 6.98066     10.7366  11.0194     10.9657  4.89713    154.724     1.70611     154.724     
1 1 1 35 6  44 o 10 24.0413 6.49474 9.89862     10.6628  11.1278     11.1304  8.41764    355.049     2.56989     355.049     
1 1 1 35 6  45 o 9  83.6821 3.71108 126.594     15.1151  137.567     15.856   69.4055    297.441     21.3251     297.441     
1 1 1 35 6  46 o 6  23.8098 6.78523 6.42947     12.5424  11.6932     12.5245  9.20696    201.624     0.124398    201.624     
1 1 1 35 6  47 f 0  42.8109 6.28679 35.7039     12.3893  42.7535     13.7238  16.1716    111.102     0           0           
1 1 1 35 6  48 o 6  25.5791 6.82084 9.55566     11.0945  16.2965     12.8346  10.0672    81.4682     9.96448     261.468     
1 1 1 35 6  49 o 17 33.936  7.33169 26.9366     12.9577  25.6387     14.3641  16.3355    100.943     11.3122     280.943     
1 1 1 35 6  50 o 4  47.8869 6.2166  49.3532     13.8671  47.777      14.8399  38.2683    246.292     12.6086     246.292     
1 1 1 35 6  51 o 3  30.7227 7.1179  12.6858     12.8342  29.6008     13.6132  14.9846    15.2388     9.04209     195.239     
1 1 1 35 6  52 o 16 31.9552 7.38781 21.0501     13.3185  26.8927     14.0122  22.5765    299.562     7.54078     299.562     
1 1 1 35 6  53 o 19 27.3214 7.34963 9.21612     12.8972  23.6208     15.392   10.8786    90.4486     6.42385     90.4486     
1 1 1 35 6  54 o 12 41.221  7.05313 16.9308     15.9181  66.453      16.8116  26.7013    319.523     0.242664    139.524     
1 1 1 35 6  55 o 13 47.6301 8.03808 57.4487     20.477   57.7208     17.4475  39.9081    155.692     19.5026     155.692     
1 1 1 35 6  56 o 4  50.6182 7.91743 67.6598     20.8805  62.7927     18.2196  45.3675    190.825     28.0332     190.825     
1 1 1 35 6  57 o 13 34.7949 8.59437 39.9049     19.8756  32.0191     17.0035  22.7391    86.7179     10.2823     86.7179     
1 1 1 35 6  58 o 14 23.7867 7.61519 14.1002     18.4069  -2.08585    22.0673  6.30117    187.32      1.67563     7.31977     
1 1 1 35 6  59 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 7  0  o 2  121.088 3.21685 263.268     19.4579  263.268     19.4579  117.424    360         51.5603     360         
1 1 1 35 7  1  o 1  55.5633 4.09848 47.378      10.4014  67.2675     12.0366  22.2599    88.0314     36.6944     268.031     
1 1 1 35 7  2  o 11 66.8249 3.60998 83.4833     11.6855  79.3398     12.2773  65.679     288.694     35.9336     288.694     
1 1 1 35 7  3  o 8  39.9803 4.84658 28.9744     8.65919  31.5202     10.0561  10.702     107.613     35.2559     287.613     
1 1 1 35 7  4  o 1  37.2696 4.93757 27.5243     8.42123  25.3148     9.30585  14.5158    287.191     22.5199     107.191     
1 1 1 35 7  5  o 19 24.953  5.69126 14.7683     7.8695   7.34845     8.94125  6.12826    267.306     16.3        87.306      
1 1 1 35 7  6  o 8  51.3212 3.73671 52.2518     9.26859  44.5353     9.58415  42.0487    231.203     12.1875     231.203     
1 1 1 35 7  7  o 13 43.782  4.17734 35.8365     8.90563  35.3995     8.95717  34.535     302.022     10.0584     302.022     
1 1 1 35 7  8  o 13 78.2467 2.98418 107.092     11.8633  114.119     11.4243  63.1064    91.0075     11.0696     91.0075     
1 1 1 35 7  9  o 11 75.0715 3.07447 115.697     11.6777  89.0523     11.2514  61.5642    215.662     13.0487     215.662     
1 1 1 35 7  10 o 18 30.1708 5.64996 22.3581     8.74388  12.9602     9.01031  13.6366    232.721     5.53865     232.721     
1 1 1 35 7  11 f 0  39.0517 5.07992 30.8897     9.00167  27.3694     10.0742  28.2797    77.5339     0           0           
1 1 1 35 7  12 f 0  27.5948 5.38603 22.7754     8.25776  5.11125     8.9053   35.0051    42.3171     0           0           
1 1 1 35 7  13 o 13 83.7996 3.00824 130.696     12.3609  123.231     12.796   86.5777    343.115     51.275      343.115     
1 1 1 35 7  14 o 3  52.8619 4.09958 46.6935     10.56    56.9572     10.7182  17.4317    119.83      42.0829     299.83      
1 1 1 35 7  15 o 5  21.2226 5.6482  9.14638     7.81322  3.15026     8.99708  4.27635    254.144     7.29586     74.1443     
1 1 1 35 7  16 o 13 64.3305 3.43618 68.3658     10.6071  82.9488     11.3641  60.6704    68.5614     29.5213     68.5614     
1 1 1 35 7  17 o 8  50.3553 4.3198  51.4665     10.1843  43.1917     10.9731  29.4289    272.71      13.1481     92.7103     
1 1 1 35 7  18 o 6  53.1116 4.31576 51.5997     11.7665  53.454      10.7277  37.838     41.7832     0.0194113   41.7897     
1 1 1 35 7  19 o 2  57.8815 3.89441 62.0505     10.5745  61.4887     11.7025  40.9483    270.877     1.36779     90.8771     
1 1 1 35 7  20 o 15 25.5547 5.9997  16.1613     8.6896   6.49469     10.2419  6.56104    179.597     18.0214     359.597     
1 1 1 35 7  21 o 10 19.1812 5.57767 3.69132     8.18903  2.31729     9.08408  2.40183    210.734     8.35243     30.7337     
1 1 1 35 7  22 o 16 34.1824 5.56455 18.1568     9.24042  27.9107     9.57248  24.4966    343.568     8.63361     343.568     
1 1 1 35 7  23 o 17 36.935  5.40289 23.6603     9.47508  29.5825     9.87888  22.1241    340.176     5.29431     160.176     
1 1 1 35 7  24 o 4  71.6303 3.62088 91.2677     11.8331  96.9526     13.9499  37.9097    338.563     28.8965     158.563     
1 1 1 35 7  25 o 12 75.2316 3.39076 110.32      12.8025  96.6434     12.5989  56.1448    324.392     2.76957     324.392     
1 1 1 35 7  26 o 17 55.6096 4.07776 56.394      10.8404  58.648      11.5563  49.7374    290.34      21.3909     290.34      
1 1 1 35 7  27 o 17 39.4996 5.40192 26.8549     9.41615  34.2702     11.2282  13.1202    36.157      29.2925     216.157     
1 1 1 35 7  28 o 3  67.3729 3.60999 80.714      11.9935  86.3772     12.1969  56.822     265.481     16.6808     265.481     
1 1 1 35 7  29 o 18 22.0107 5.87007 1.61605     8.27455  12.7857     10.0159  7.0845     62.1048     10.4051     242.105     
1 1 1 35 7  30 o 15 24.4933 5.63657 -1.08536    8.82223  20.512      9.62757  10.0205    18.1177     9.84863     198.118     
1 1 1 35 7  31 o 7  20.2753 5.78195 4.28706     8.57207  5.33214     9.51572  4.5316     114.609     0.103202    294.609     
1 1 1 35 7  32 o 15 27.9201 6.07992 13.7799     8.74692  17.5964     9.9591   13.6107    236.243     8.62942     56.243      
1 1 1 35 7  33 o 7  30.1903 6.03416 19.4942     9.03142  17.629      10.1085  2.61689    295.091     36.3167     115.091     
1 1 1 35 7  34 o 1  28.288  6.16124 12.4557     8.98003  20.3281     10.3901  16.8231    234.606     1.60661     54.6056     
1 1 1 35 7  35 o 3  24.1045 5.87509 16.3158     8.71472  3.06723     10.145   13.2814    19.9376     2.13621     19.9376     
1 1 1 35 7  36 o 6  27.0158 6.15213 11.1969     8.8527   18.6431     10.2529  0.141684   102.741     36.3107     282.741     
1 1 1 35 7  37 f 0  21.0737 5.98297 8.13801     8.91519  2.86473     10.7848  9.04892    34.65       0           0           
1 1 1 35 7  38 o 7  28.4009 6.36507 18.2494     9.16837  15.1253     11.4976  16.1062    140.837     3.25636     320.837     
1 1 1 35 7  39 o 2  27.2186 6.38498 16.1625     9.18344  14.3336     11.3549  15.8069    277.915     0.805405    97.9146     
1 1 1 35 7  40 o 17 34.9314 6.43091 31.6358     11.1021  20.8497     12.116   19.7332    105.228     6.99846     285.228     
1 1 1 35 7  41 o 14 49.7544 5.31048 51.0934     12.2684  48.5574     13.3103  39.7487    222.437     11.2428     222.437     
1 1 1 35 7  42 o 15 31.9627 7.29515 19.8464     11.7227  26.4722     14.89    22.514     210.273     9.81431     210.273     
1 1 1 35 7  43 o 10 26.4308 6.78791 6.38598     10.7905  21.9952     13.2106  13.1607    87.3928     3.58553     267.393     
1 1 1 35 7  44 o 10 30.6583 7.14105 18.5804     11.6027  23.7492     13.8302  13.1158    118.073     8.00937     118.073     
1 1 1 35 7  45 o 11 30.8434 7.25601 22.9496     12.0328  19.614      14.5842  14.3372    99.2288     10.1615     279.229     
1 1 1 35 7  46 o 10 32.9895 6.78176 37.2025     12.8705  8.97559     14.4899  18.5972    304.173     4.94059     124.173     
1 1 1 35 7  47 o 13 20.9594 6.54986 -3.24682    11.7178  6.68504     15.1799  1.78438    152         0.304235    152         
1 1 1 35 7  48 o 16 22.9063 6.76492 3.31857     12.0146  10.7688     13.9555  7.98668    62.8804     11.0045     242.88      
1 1 1 35 7  49 o 17 26.6824 7.32045 15.9015     13.6141  12.7741     14.4959  15.5028    351.704     6.82028     351.704     
1 1 1 35 7  50 o 12 23.0329 6.83613 4.25441     12.4441  10.8537     14.2427  10.9611    151.622     1.97297     331.622     
1 1 1 35 7  51 o 9  69.3975 4.95736 92.4738     15.9958  102.04      18.013   64.3215    247.998     33.6171     247.998     
1 1 1 35 7  52 o 13 28.5629 7.23328 31.168      14.7412  3.01569     14.9472  18.1745    204.098     7.83933     204.098     
1 1 1 35 7  53 f 0  49.5239 7.48528 63.5343     18.4157  55.262      17.6315  20.731     140.69      0           0           
1 1 1 35 7  54 o 14 20.6386 6.60674 9.97697     15.2738  -12.3011    15.3993  0.659983   334.479     25.0285     334.479     
1 1 1 35 7  55 o 2  23.2032 7.22414 19.4723     18.0075  -5.76784    15.5807  5.87312    16.2918     0.0820909   196.292     
1 1 1 35 7  56 o 12 19.5991 6.51552 5.41252     17.4438  -15.319     15.3759  2.43585    250.966     3.58474     70.966      
1 1 1 35 7  57 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 7  58 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 8  0  f 0  60.6605 3.34675 67.0963     10.0275  67.0963     10.0275  35.6572    180         0           0           
1 1 1 35 8  1  o 4  154.335 2.78773 440.758     22.1309  417.257     20.9604  116.466    289.95      0.204112    289.949     
1 1 1 35 8  2  o 4  25.915  5.8068  10.6069     8.86561  14.5372     8.22921  11.0725    162.616     2.9182      342.616     
1 1 1 35 8  3  o 3  88.8651 3.08819 132.758     13.9119  153.491     13.4063  86.1767    216.341     40.9871     216.341     
1 1 1 35 8  4  o 5  58.4601 3.64288 61.6245     10.8724  63.6302     10.2271  52.514     268.208     21.4313     268.208     
1 1 1 35 8  5  o 6  28.7793 5.80469 19.7625     8.84644  12.3216     9.04205  11.7707    104.995     4.57784     104.995     
1 1 1 35 8  6  o 3  74.4646 3.24633 102.258     11.8299  99.2015     12.2669  70.4244    92.1251     31.9721     92.1251     
1 1 1 35 8  7  o 10 62.2606 3.58818 66.7149     10.8728  75.279      11.3143  51.0979    333.888     11.7813     333.888     
1 1 1 35 8  8  o 1  75.7265 3.24338 114.708     11.6725  94.1191     12.6068  60.3289    296.172     8.92485     296.172     
1 1 1 35 8  9  o 15 82.2233 3.06337 124.485     11.9787  120.44      13.1249  52.4385    106.146     17.4252     286.146     
1 1 1 35 8  10 o 16 26.9218 5.79282 13.6355     8.00027  14.2657     9.03477  6.60878    327.815     21.2022     147.815     
1 1 1 35 8  11 o 14 44.0988 4.48846 36.5812     9.24135  36.5404     10.0055  38.0335    101.217     17.0384     101.217     
1 1 1 35 8  12 o 15 53.9517 3.77965 51.5446     9.85212  55.7478     10.319   38.0405    18.3343     1.67037     198.334     
1 1 1 35 8  13 o 6  47.9885 3.9771  39.9946     9.39811  45.5119     9.32095  45.0072    95.5533     25.4673     95.5533     
1 1 1 35 8  14 f 0  32.5869 5.26601 26.865      8.60732  14.8548     8.46178  36.896     276.863     0           0           
1 1 1 35 8  15 o 15 36.1026 5.19353 17.6003     8.75075  33.8038     9.48299  25.5257    104.505     4.24102     104.504     
1 1 1 35 8  16 f 0  88.6002 3.03873 141.957     13.3639  142.548     13.54    55.9393    259.183     0           0           
1 1 1 35 8  17 o 15 22.607  5.75616 11.9115     8.21786  3.955       9.13086  2.84135    52.8666     21.2231     232.867     
1 1 1 35 8  18 o 4  93.3729 3.17313 159.08      14.4517  157.638     15.1446  83.1454    209.194     28.4262     209.194     
1 1 1 35 8  19 o 12 30.1763 6.05923 16.6669     8.66312  19.4788     10.5263  17.9972    95.7129     0.178277    95.7129     
1 1 1 35 8  20 o 9  36.9821 5.65475 23.0431     9.60867  31.0236     10.7868  28.6871    113.748     10.5131     113.748     
1 1 1 35 8  21 o 14 36.3589 5.50741 26.4337     9.03765  25.4039     10.4186  20.469     208.618     8.59924     28.6179     
1 1 1 35 8  22 o 15 20.5166 5.54507 -3.02913    8.34201  11.863      9.01474  2.65739    155.129     17.7231     335.129     
1 1 1 35 8  23 o 10 38.7137 5.36459 23.9488     9.89932  34.9902     10.1445  31.9418    93.6716     13.4168     93.6716     
1 1 1 35 8  24 o 7  68.4364 3.61467 85.7785     12.1328  86.6353     12.4808  50.8226    133.925     1.84375     133.925     
1 1 1 35 8  25 o 11 39.7431 5.6021  23.1052     10.337   40.1599     11.2277  18.8378    129.537     18.2772     309.537     
1 1 1 35 8  26 o 2  21.6386 6.0263  8.75913     9.94945  3.74293     9.39841  8.11696    76.5374     6.18132     256.537     
1 1 1 35 8  27 o 8  45.404  5.16627 42.0911     10.8206  38.0942     11.7904  27.8921    182.128     8.75153     2.12832     
1 1 1 35 8  28 o 13 101.75  3.07296 194.73      15.6463  183.266     15.6097  79.566     124.164     9.50052     124.164     
1 1 1 35 8  29 o 6  31.1494 6.43696 10.8971     11.7402  28.1067     11.1282  9.95467    276.471     22.7417     96.4712     
1 1 1 35 8  30 o 4  23.4391 5.76216 -1.2168     8.8222   18.4545     9.90855  9.31251    196.982     10.0446     16.9817     
1 1 1 35 8  31 o 7  20.8138 5.86841 5.64384     8.49017  6.00903     9.93254  2.80262    123.473     20.1847     303.473     
1 1 1 35 8  32 o 8  35.0957 5.72506 17.7845     9.34111  33.3631     10.6979  30.3597    231.363     18.2006     231.363     
1 1 1 35 8  33 f 0  35.1354 6.04459 22.8609     10.0213  28.5944     11.0941  36.5564    173.723     0           0           
1 1 1 35 8  34 o 15 59.8164 3.96768 70.4919     11.1319  64.9048     12.2577  45.8918    35.4791     6.21486     35.4791     
1 1 1 35 8  35 f 0  39.3308 5.49185 32.6545     9.79117  30.2109     11.0461  12.7716    166.949     0           0           
1 1 1 35 8  36 o 12 28.8544 6.28039 18.567      9.34133  16.4851     10.7333  12.7219    237.583     12.3841     57.583      
1 1 1 35 8  37 o 6  62.2851 4.11957 70.8231     12.5816  77.5704     12.8239  55.1333    114.369     22.1761     114.369     
1 1 1 35 8  38 o 18 59.2525 4.78582 74.7401     13.8217  63.3398     13.9625  47.5234    246.486     11.4486     246.486     
1 1 1 35 8  39 o 13 35.6945 6.53188 23.8872     11.2063  31.7903     12.4228  27.2054    351.561     9.15607     351.561     
1 1 1 35 8  40 o 6  37.9298 6.53149 29.5845     11.569   33.1171     13.0322  31.1274    251.357     14.9088     251.357     
1 1 1 35 8  41 o 1  38.4615 6.40569 28.2075     11.5401  36.1203     12.7938  30.1518    53.5302     22.0763     53.5303     
1 1 1 35 8  42 o 5  31.3088 7.17599 19.9879     12.242   24.5253     13.505   19.9067    172.244     10.07       172.244     
1 1 1 35 8  43 o 19 22.789  6.61063 11.8531     11.6177  0.884631    13.532   5.94029    74.7815     1.09462     74.7815     
1 1 1 35 8  44 o 14 40.6122 6.86959 26.6325     14.5837  47.4854     13.7847  30.5457    345.045     7.72946     345.045     
1 1 1 35 8  45 f 0  22.7438 6.32089 -8.89474    11.8055  18.5328     12.3873  8.87518    95.7662     0           0           
1 1 1 35 8  46 o 14 32.4982 7.19682 19.0426     13.1837  29.1584     13.3242  25.2359    182.265     14.5149     182.265     
1 1 1 35 8  47 o 4  40.0679 7.35004 40.5481     13.7672  33.7924     16.3803  22.9516    234         7.99862     53.9999     
1 1 1 35 8  48 o 8  32.745  7.57042 19.1624     13.1253  32.74       15.7522  21.087     281.975     0.844168    281.975     
1 1 1 35 8  49 o 13 31.8558 8.43414 25.6088     19.9648  26.2265     16.6389  20.2849    53.7292     1.58037     53.7292     
1 1 1 35 8  50 o 18 22.2274 7.16941 -1.4989     15.1571  5.09364     19.8673  9.23856    61.0383     3.7264      241.038     
1 1 1 35 8  51 o 10 41.2215 8.36711 33.8972     17.0919  58.4223     19.973   27.7491    13.4739     2.04912     13.4739     
1 1 1 35 8  52 o 13 23.8407 7.39837 9.94637     15.9178  8.06775     18.1596  5.62545    274.192     1.3907      274.192     
1 1 1 35 8  53 o 3  24.3364 7.4957  15.8846     16.6293  4.66604     18.4392  8.65753    274.211     0.329017    274.211     
1 1 1 35 8  54 o 8  29.7434 8.49008 15.0247     19.7066  36.7924     20.6013  15.6811    1.79993     2.73075     1.79993     
1 1 1 35 8  55 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 8  56 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 9  0  o 19 15.2415 6.30922 5.30728     8.06709  5.30728     8.06709  2.54365    180         17.5076     180         
1 1 1 35 9  1  o 14 74.9217 3.15807 109.47      12.0083  94.7934     11.5778  57.6282    120.163     4.0758      120.163     
1 1 1 35 9  2  f 0  46.9527 4.26436 44.0136     10.3063  38.5158     9.30749  41.5948    0.897888    0           0           
1 1 1 35 9  3  o 15 80.085  3.00638 115.132     12.0073  117.345     12.0372  64.5545    110.435     10.0461     110.435     
1 1 1 35 9  4  o 11 21.1616 5.57019 8.15343     7.91508  5.67182     7.94333  0.108395   332.049     25.4891     332.049     
1 1 1 35 9  5  o 17 110.202 2.77855 205.382     15.639   233.37      14.8919  92.9119    284.473     20.4336     284.473     
1 1 1 35 9  6  o 14 69.8937 3.2821  89.4971     11.829   88.5287     11.0209  60.2767    242.079     17.7776     242.079     
1 1 1 35 9  7  o 1  23.8831 5.7318  8.26341     8.38969  12.2599     8.13995  8.60281    206.354     1.10947     26.3544     
1 1 1 35 9  8  o 13 67.5017 3.38269 76.6131     11.5577  90.0553     11.064   61.5306    48.4        24.4589     48.4        
1 1 1 35 9  9  o 12 77.9947 3.19159 103.034     12.4914  118.482     12.2843  66.6445    323.638     17.8792     323.638     
1 1 1 35 9  10 o 16 40.0582 5.11846 34.0071     9.50726  27.8936     10.1904  29.4024    112.246     4.12466     112.246     
1 1 1 35 9  11 o 16 23.8561 5.84194 7.32954     8.15934  13.0178     9.03434  8.1236     308.89      10.5099     128.89      
1 1 1 35 9  12 o 5  20.7485 5.73339 6.94957     8.17263  4.12747     9.22947  4.0993     223.376     2.80574     43.3762     
1 1 1 35 9  13 o 9  92.4066 3.02636 168.861     13.1928  141.495     14.5111  76.8515    300.331     16.1473     300.331     
1 1 1 35 9  14 o 17 50.1706 4.47973 59.3147     9.97355  36.5977     11.0518  33.4304    126.496     5.40468     306.496     
1 1 1 35 9  15 o 4  33.8695 5.69765 22.5279     9.35453  22.8923     9.70509  21.1819    131.724     2.46424     311.724     
1 1 1 35 9  16 o 13 91.4376 3.01891 156.04      13.0479  147.58      14.4515  71.1663    44.4377     6.30485     44.4377     
1 1 1 35 9  17 o 19 21.7472 5.7788  6.7983      8.22595  8.01028     8.85807  7.30037    236.257     6.62581     56.2565     
1 1 1 35 9  18 o 5  42.0705 5.13236 39.1428     9.8826   29.5419     10.744   16.9242    68.025      26.5512     248.025     
1 1 1 35 9  19 o 19 36.6784 5.92808 25.9872     9.82662  27.8038     11.4929  24.6413    213.031     0.610219    33.0304     
1 1 1 35 9  20 o 6  28.2354 6.06313 13.4642     8.63833  18.3109     10.0678  16.3812    110.25      2.2042      290.25      
1 1 1 35 9  21 o 10 43.5015 4.77353 33.7615     9.55869  38.9431     10.5896  35.6889    114.202     10.7177     114.202     
1 1 1 35 9  22 o 13 43.4997 4.77455 33.9049     9.62904  38.9265     10.5196  26.5852    317.904     8.95026     137.904     
1 1 1 35 9  23 o 19 26.3498 6.05553 15.7565     8.7456   10.9933     9.87818  7.37051    237.816     20.4743     57.8159     
1 1 1 35 9  24 o 7  50.457  4.33361 54.1174     10.0652  42.6571     11.0444  44.4381    320.567     17.1676     320.567     
1 1 1 35 9  25 o 5  45.2755 5.64537 44.0602     10.0175  37.4013     14.0177  42.5638    37.5907     23.2083     37.5907     
1 1 1 35 9  26 o 5  53.6707 4.47464 47.281      11.6747  63.1555     11.665   50.1616    213.391     24.1082     213.391     
1 1 1 35 9  27 o 9  93.8382 3.09454 158.071     13.9526  164.846     15.068   76.4138    351.41      14.5801     351.41      
1 1 1 35 9  28 o 7  40.9365 5.49902 35.661      10.7409  31.6541     10.9775  24.9435    302.527     7.86339     122.527     
1 1 1 35 9  29 o 6  33.7444 6.30736 18.2152     11.5077  29.5791     10.6963  21.5604    0.82784     2.46902     180.828     
1 1 1 35 9  30 o 4  18.4497 5.68161 -3.34404    9.22619  4.10352     10.6049  5.06873    356.053     8.32293     176.053     
1 1 1 35 9  31 o 11 22.7711 6.1078  12.134      9.48723  4.69711     10.2469  11.3975    87.0183     1.28059     267.018     
1 1 1 35 9  32 o 6  19.307  5.79265 4.65529     9.49734  0.382977    10.1529  5.99492    263.842     7.64476     83.8422     
1 1 1 35 9  33 o 18 53.4066 4.80396 66.044      12.9473  46.7505     11.9839  49.9899    232.391     25.192      232.391     
1 1 1 35 9  34 o 10 26.7079 6.46485 24.5412     11.8506  1.40438     11.7248  9.02156    305.566     16.8811     125.566     
1 1 1 35 9  35 o 18 53.5827 4.98916 57.0023     12.4746  57.046      13.6247  53.3787    21.176      33.0555     21.176      
1 1 1 35 9  36 o 3  52.8202 5.09219 56.2619     12.4961  55.2455     13.6938  35.9081    86.0896     2.94035     266.09      
1 1 1 35 9  37 o 15 49.4538 5.60017 52.834      13.4111  47.5868     13.3805  32.6545    240.652     4.03534     60.6523     
1 1 1 35 9  38 o 4  76.8298 4.13924 108.075     15.793   118.791     15.808   68.0627    39.1836     26.486      39.1836     
1 1 1 35 9  39 o 5  18.1135 5.83673 -3.01485    11.2099  -3.24067    12.1608  3.09813    59.7705     6.25032     239.77      
1 1 1 35 9  40 o 7  43.0434 6.38817 32.9601     13.1281  47.6618     13.6177  36.3278    358.99      16.2389     358.99      
1 1 1 35 9  41 f 0  22.3042 6.6804  13.4978     14.3796  -3.86912    12.2492  8.10161    19.631      0           0           
1 1 1 35 9  42 o 2  18.8755 6.06077 -5.26891    11.5821  0.439683    13.289   3.71229    168.597     12.4229     348.597     
1 1 1 35 9  43 o 5  22.1162 6.66068 9.02083     12.927   0.396074    13.4213  9.75213    342.318     3.86658     162.317     
1 1 1 35 9  44 f 0  21.9768 6.6733  9.36728     12.1465  -4.01964    15.6844  17.5775    256.715     0           0           
1 1 1 35 9  45 o 5  34.2838 7.9546  23.1116     16.025   34.3572     16.0654  24.7976    340.948     6.3813      340.948     
1 1 1 35 9  46 o 1  47.1621 7.51976 60.6887     17.5232  44.5604     17.3464  33.2137    52.0188     2.14102     52.0188     
1 1 1 35 9  47 o 19 49.5854 7.57446 58.2951     18.9293  58.7024     17.61    32.171     175.561     3.67186     355.561     
1 1 1 35 9  48 o 2  28.4522 6.83679 -15.2128    15.5128  39.1035     15.6596  16.9096    349.916     9.60935     349.916     
1 1 1 35 9  49 o 19 20.0247 6.47214 7.03311     15.0952  -12.0882    14.7849  6.04273    310.363     5.85264     130.363     
1 1 1 35 9  50 o 7  21.7806 6.93473 4.09736     15.7962  3.80073     16.0417  6.09683    133.96      0.534872    313.96      
1 1 1 35 9  51 f 0  22.8716 6.93308 -14.1918    15.9333  21.7608     15.9461  7.77688    40.4963     0           0           
1 1 1 35 9  52 o 2  24.4727 7.45947 14.5966     16.3717  10.501      16.9879  6.98628    27.7163     0.58782     27.7163     
1 1 1 35 9  53 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 9  54 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 10 0  o 16 12.0901 5.64348 -1.33596    8.82546  -1.33596    8.82546  8.55373    360         28.2193     360         
1 1 1 35 10 1  o 4  62.4117 3.44864 73.2812     10.6938  69.6091     10.7012  45.9521    283.53      0.285746    103.529     
1 1 1 35 10 2  o 5  114.288 2.73365 239.49      15.6079  232.458     15.6571  108.712    280.47      45.4914     280.47      
1 1 1 35 10 3  o 2  24.2217 5.81941 9.70892     8.34286  11.8905     8.55724  8.63105    306.176     11.6361     126.176     
1 1 1 35 10 4  o 13 45.2115 4.37007 34.9854     9.6834   42.2145     9.49003  39.6774    131.496     16.4343     131.496     
1 1 1 35 10 5  o 8  58.0678 3.68452 65.0308     10.8127  59.4524     10.4013  52.3035    89.2009     20.3183     89.2009     
1 1 1 35 10 6  o 2  18.2171 5.33558 -0.498992   8.10039  4.81461     8.06841  0.577321   278.945     21.0457     278.945     
1 1 1 35 10 7  o 13 67.3619 3.29903 83.0329     11.0881  82.9081     11.0478  47.0148    129.572     6.02668     309.572     
1 1 1 35 10 8  o 9  26.5337 5.78752 16.6563     8.66517  10.6298     8.48781  1.35913    32.8795     39.3304     32.8796     
1 1 1 35 10 9  o 15 79.2548 3.27185 125.142     13.5543  104.727     12.3255  49.9585    109.002     18.6904     289.002     
1 1 1 35 10 10 o 8  80.3227 3.10555 123.414     12.7385  111.715     12.1664  60.6984    280.932     1.46701     280.932     
1 1 1 35 10 11 o 6  36.2691 5.28901 21.4136     9.45449  30.3598     9.13122  13.3462    195.501     24.9676     15.5011     
1 1 1 35 10 12 o 2  67.9487 3.49086 72.8326     12.0376  97.6975     11.19    42.7879    121.975     15.4638     301.975     
1 1 1 35 10 13 o 15 18.8317 5.46613 -0.720632   8.4988   6.06561     8.4021   3.95735    115.002     3.20031     295.002     
1 1 1 35 10 14 o 9  48.636  4.2419  43.4633     10.3625  45.6155     9.84394  24.8203    283.542     21.539      103.542     
1 1 1 35 10 15 o 16 43.0532 4.99202 30.1549     9.95605  42.0039     10.7599  25.3352    71.9753     11.3038     251.975     
1 1 1 35 10 16 o 7  84.329  3.05762 135.671     12.6445  123.873     13.0655  64.7833    231.497     3.78968     231.497     
1 1 1 35 10 17 o 16 63.3146 3.79161 70.6451     11.5347  78.4616     12.3037  50.0034    301.774     6.75543     301.774     
1 1 1 35 10 18 o 18 41.0012 5.30269 30.2573     10.1814  36.0326     10.8068  39.8125    255.564     29.7093     255.564     
1 1 1 35 10 19 o 18 18.0329 5.43605 0.255622    8.23183  2.55109     9.0648   0.207628   314.361     21.0261     134.36      
1 1 1 35 10 20 o 12 50.4884 4.27933 46.6094     10.0711  50.1329     11.1514  48.5655    343.41      25.505      343.41      
1 1 1 35 10 21 o 12 18.5884 5.42906 -4.40146    8.211    8.06744     9.11321  2.57973    250.788     28.7576     250.788     
1 1 1 35 10 22 o 9  17.0963 5.36529 -6.0402     8.0937   2.89756     10.3035  3.53143    337.221     3.94003     157.221     
1 1 1 35 10 23 o 7  24.7543 6.16371 14.5816     8.74591  7.23594     11.1113  14.1521    338.36      0.430766    158.36      
1 1 1 35 10 24 o 3  24.4945 6.14919 6.61326     8.69223  16.1854     10.5822  12.9299    16.1535     3.77969     196.154     
1 1 1 35 10 25 o 19 38.2014 5.54902 31.5247     9.64935  27.6622     10.8535  34.5925    43.9705     18.5982     43.9705     
1 1 1 35 10 26 o 16 48.9165 5.35926 48.0156     11.6999  47.5344     13.6061  51.6022    353.208     37.2034     353.208     
1 1 1 35 10 27 o 8  21.1084 5.96618 5.80426     9.10482  6.84937     9.97687  0.300318   333.129     28.1896     333.129     
1 1 1 35 10 28 o 18 19.9013 5.73254 -1.25784    8.64767  9.65923     9.93601  4.1114     148.069     15.6503     328.069     
1 1 1 35 10 29 o 6  33.7826 5.95772 19.6305     9.50896  28.7436     10.7224  21.1444    198.87      3.63217     18.8696     
1 1 1 35 10 30 o 10 17.7507 5.66055 -5.74265    9.94483  0.98648     11.3826  2.57747    123.158     13.8798     303.158     
1 1 1 35 10 31 o 19 25.8777 6.68374 15.734      11.1017  10.8031     11.6957  14.9298    89.8085     5.60031     89.8085     
1 1 1 35 10 32 o 14 30.1945 5.96879 36.4238     11.9385  -3.30838    12.4332  19.5661    145.97      0.40591     145.969     
1 1 1 35 10 33 o 13 33.5549 7.12967 28.3631     13.4411  22.6724     12.5257  18.8364    117.588     7.18462     297.589     
1 1 1 35 10 34 o 6  48.1491 6.55706 56.5699     16.954   44.0189     13.5853  32.4799    220.086     2.68664     40.0859     
1 1 1 35 10 35 o 10 22.8324 6.37375 -12.7026    13.0256  18.9355     12.5208  5.87529    225.223     1.43183     225.223     
1 1 1 35 10 36 o 2  25.393  6.93899 -0.162916   14.4668  20.2008     13.0369  12.217     19.6483     3.88335     199.648     
1 1 1 35 10 37 o 4  21.4367 6.37629 13.6759     12.8703  -9.2687     12.4327  7.02125    126.117     7.65662     306.117     
1 1 1 35 10 38 o 3  84.1817 4.59973 143.894     18.5576  133.988     19.8307  66.7419    189.463     12.2539     189.463     
1 1 1 35 10 39 o 8  20.4321 6.10309 -15.0638    11.3327  14.1955     12.7428  6.39476    313.94      9.03592     133.94      
1 1 1 35 10 40 o 5  28.5054 6.67773 2.06308     12.3627  30.35       13.1683  19.6477    352.01      8.25856     352.01      
1 1 1 35 10 41 o 18 21.7861 6.75554 8.20512     12.1     -9.45767    18.4933  0.722495   111.283     0.285193    111.283     
1 1 1 35 10 42 o 15 38.7868 7.83897 24.3818     16.2529  49.2244     17.2167  32.47      322.586     14.9937     322.586     
1 1 1 35 10 43 o 12 24.8123 7.44786 9.25043     17.0114  10.074      15.2646  13.8845    80.0217     1.24926     80.0217     
1 1 1 35 10 44 o 14 61.1763 6.34298 98.1451     18.9176  66.0731     18.1926  49.0109    143.333     12.2993     143.333     
1 1 1 35 10 45 o 17 21.2534 6.76944 4.89582     15.6363  -2.16431    14.8032  8.9034     288.989     3.89717     108.989     
1 1 1 35 10 46 o 14 20.3257 6.61993 -4.16806    15.3478  0.642239    15.8478  5.04621    278.129     0.0346682   278.129     
1 1 1 35 10 47 o 6  18.1942 6.11033 -13.8356    14.8056  -3.68951    15.4424  3.79026    69.6876     4.40634     249.688     
1 1 1 35 10 48 o 9  28.3935 7.95003 22.8194     16.7033  20.2417     16.9245  14.9504    264.997     6.09756     264.997     
1 1 1 35 10 49 o 14 18.3986 6.18163 -5.29849    15.4799  -9.3023     15.5103  1.30579    111.259     1.58088     291.26      
1 1 1 35 10 50 o 6  24.2196 7.21899 25.4948     16.6509  -7.15003    16.3083  7.43027    97.6314     0.358978    97.6314     
1 1 1 35 10 51 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 10 52 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 11 0  o 4  20.8543 7.23326 12.151      8.97574  12.151      8.97574  8.99122    360         0.335075    180         
1 1 1 35 11 1  o 13 72.2198 3.29238 96.0901     12.0601  95.1911     11.6423  63.1861    96.1504     18.6146     96.1504     
1 1 1 35 11 2  o 10 20.5876 5.54169 10.2944     8.34418  1.10107     8.18692  2.2907     302.87      21.3048     122.87      
1 1 1 35 11 3  o 11 19.5607 5.42023 -0.892241   8.199    9.02524     8.11116  6.25334    54.8779     3.70884     234.878     
1 1 1 35 11 4  o 5  33.4619 5.60341 18.8291     9.0281   26.1461     9.56138  27.457     113.362     12.4548     113.362     
1 1 1 35 11 5  o 13 77.6214 3.16332 101.941     12.1773  118.776     12.2769  56.6176    164.99      3.33923     344.99      
1 1 1 35 11 6  o 14 55.7958 3.78828 53.4146     10.4391  62.6477     10.4196  49.4679    104.179     17.1847     104.179     
1 1 1 35 11 7  o 18 83.624  3.04428 128.233     12.6769  127.027     12.752   47.5732    314.411     30.9297     134.411     
1 1 1 35 11 8  o 18 20.4482 5.56759 10.1377     8.39848  0.30913     8.52868  4.99655    250.49      14.7406     70.49       
1 1 1 35 11 9  o 1  31.9323 5.6359  23.3643     9.10715  17.7447     8.95862  24.8708    337.762     8.442       337.762     
1 1 1 35 11 10 o 11 50.1715 4.06706 51.3313     10.0499  43.5868     9.97007  42.8795    51.4435     12.8433     51.4435     
1 1 1 35 11 11 o 17 33.0774 5.55609 17.1339     9.24899  27.0554     9.11829  21.4606    280.498     2.68738     100.498     
1 1 1 35 11 12 o 13 37.7194 5.34741 33.3607     9.64003  23.4441     9.84342  24.337     1.93411     4.90579     181.934     
1 1 1 35 11 13 o 13 15.7521 4.98398 0.154079    8.18519  -5.36639    8.1605   1.99906    301.854     4.2919      121.854     
1 1 1 35 11 14 o 18 63.901  3.86834 79.4787     11.7203  73.3202     12.7201  54.0669    245.333     13.6071     245.333     
1 1 1 35 11 15 o 5  16.9511 5.22692 2.62749     8.54589  -3.90935    8.43834  2.19674    358.806     13.4686     178.806     
1 1 1 35 11 16 o 19 114.486 2.8318  244.179     16.5892  233.757     15.8565  110.345    76.2692     48.8146     76.2692     
1 1 1 35 11 17 o 2  28.0082 6.34074 14.9175     10.9149  17.0187     9.36483  5.31175    95.4901     28.438      275.49      
1 1 1 35 11 18 o 19 46.7653 4.83965 47.4387     10.6423  38.0877     11.1566  49.0376    64.8609     34.3184     64.8609     
1 1 1 35 11 19 o 17 18.2974 5.54721 0.350056    8.51349  2.7564      9.66493  2.64753    116.524     16.193      296.524     
1 1 1 35 11 20 o 8  19.3007 5.41041 -4.48646    8.47582  10.4675     8.62846  6.39858    274.974     8.56039     94.9741     
1 1 1 35 11 21 o 19 31.5661 5.74703 15.6288     9.1922   25.8143     9.42937  14.588     168.454     14.8822     348.454     
1 1 1 35 11 22 o 7  29.7558 5.90324 14.0798     9.20799  22.894      9.45286  9.35555    110.907     22.8132     290.907     
1 1 1 35 11 23 o 11 27.5201 6.22525 13.9688     9.27178  17.6765     10.1628  0.97875    252.786     36.5466     72.7856     
1 1 1 35 11 24 o 4  27.2297 6.15333 17.8997     9.1925   12.7253     10.0789  5.28164    192.581     26.9564     12.5809     
1 1 1 35 11 25 o 19 27.298  6.38257 8.22184     9.20739  23.382      11.809   18.3691    338.612     4.99416     338.612     
1 1 1 35 11 26 o 6  29.1189 7.61217 21.1811     14.2034  14.8287     15.6181  18.5825    234.353     0.870168    234.353     
1 1 1 35 11 27 o 1  25.6459 6.94073 13.2254     11.215   11.8361     13.8922  11.5003    229.611     9.52776     49.6107     
1 1 1 35 11 28 o 6  29.0912 7.01499 22.2734     11.7276  13.828      13.5939  17.4113    351.598     2.37663     171.598     
1 1 1 35 11 29 o 12 26.6325 7.11298 13.0242     11.5184  15.9868     14.4421  4.22985    278.429     27.3619     98.4294     
1 1 1 35 11 30 f 0  40.9541 7.01406 43.9496     13.196   31.2824     15.8106  21.3612    50.2644     0           0           
1 1 1 35 11 31 o 13 21.2558 6.32316 -6.34707    11.254   13.0313     12.9074  2.98876    213.765     33.4824     213.765     
1 1 1 35 11 32 o 10 30.057  6.93205 26.0227     12.0221  13.5845     13.073   20.3296    275.235     9.11734     275.235     
1 1 1 35 11 33 o 7  20.4465 6.26783 1.61252     11.37    4.27063     12.3568  1.10886    231.878     0.0968771   51.8781     
1 1 1 35 11 34 o 6  22.6459 6.59347 5.51822     11.3558  9.82431     12.7774  8.83451    276.987     6.52572     96.9871     
1 1 1 35 11 35 o 3  38.5479 6.97084 32.5387     13.0741  34.8192     13.9636  26.5213    263.338     0.961294    263.338     
1 1 1 35 11 36 o 1  23.4603 6.75099 7.50071     12.0302  10.4507     12.9035  8.27748    69.2189     11.9505     249.219     
1 1 1 35 11 37 o 1  23.9963 7.02571 12.9791     13.8218  3.90614     14.2471  12.7567    340.313     1.77734     340.313     
1 1 1 35 11 38 f 0  51.0441 7.49422 74.6923     20.2778  46.6598     16.9956  35.2513    94.1258     0           0           
1 1 1 35 11 39 f 0  51.7397 7.62926 70.2594     20.6968  54.9509     17.6372  31.8932    149.099     0           0           
1 1 1 35 11 40 o 10 20.1417 6.62212 -11.923     18.8072  -0.89483    14.1793  8.02746    333.927     2.29746     153.927     
1 1 1 35 11 41 o 16 50.5441 7.83263 65.3193     20.8108  58.1101     17.7714  44.3657    108.735     19.4189     108.735     
1 1 1 35 11 42 o 7  25.9993 7.95569 16.5508     21.5322  8.62188     16.3774  14.5181    278.403     1.00988     98.4029     
1 1 1 35 11 43 o 2  20.0294 6.57264 -1.18824    15.7482  -5.6823     15.8978  7.19992    243.561     4.94243     63.5607     
1 1 1 35 11 44 o 14 22.0827 6.95416 11.1757     15.9169  -4.0227     15.8654  8.56745    341.022     0.356638    341.022     
1 1 1 35 11 45 o 19 27.1798 7.59643 27.8645     16.1485  6.26942     16.4929  14.6713    204.29      5.34169     204.29      
1 1 1 35 11 46 o 15 25.2932 7.49334 23.9039     16.9197  2.72452     16.4772  2.78469    129.3       1.13525     129.3       
1 1 1 35 11 47 o 11 45.966  8.27109 63.6884     19.3606  53.6402     18.9502  39.1722    143.157     19.9208     143.157     
1 1 1 35 11 48 o 4  24.1762 7.48329 5.38805     16.8233  18.3349     18.0022  3.06456    213.111     0.477393    213.111     
1 1 1 35 11 49 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 11 50 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 12 0  o 6  15.3348 6.42991 5.43058     8.56865  5.43058     8.56865  1.20438    8.66309e-06 22.4626     8.66307e-06 
1 1 1 35 12 1  o 2  91.6613 3.10191 146.453     14.1375  162.004     14.2534  78.5463    300.326     18.5805     300.326     
1 1 1 35 12 2  o 2  36.9972 5.29434 28.6649     9.43947  26.0224     9.51594  17.1141    310.324     19.4339     130.324     
1 1 1 35 12 3  o 10 21.5121 5.73687 10.5287     8.57446  3.97861     8.68614  10.1046    342.764     0.438257    342.764     
1 1 1 35 12 4  o 7  59.2857 3.64892 65.0578     10.7158  66.1354     10.7503  37.1452    337.85      14.4319     157.85      
1 1 1 35 12 5  o 19 51.7366 4.14759 59.3305     10.4248  42.8774     10.4119  48.3201    282.299     21.2301     282.299     
1 1 1 35 12 6  o 4  59.0434 3.71871 63.727      10.9009  66.7627     10.8691  45.4091    175.823     2.90085     175.823     
1 1 1 35 12 7  o 1  44.2708 4.55922 39.1506     9.71186  36.6625     9.90393  34.697     99.9216     5.18879     99.9216     
1 1 1 35 12 8  o 10 13.4026 4.4651  -10.6879    7.90922  -4.679      7.76126  2.67594    125.109     18.4578     125.109     
1 1 1 35 12 9  o 18 18.8463 5.44996 6.88225     8.3452   -0.476723   8.45125  5.72395    2.16396     0.991185    182.164     
1 1 1 35 12 10 o 9  18.6352 5.45527 5.73483     8.33618  0.0133812   8.59446  6.06448    196.425     6.98167     16.425      
1 1 1 35 12 11 o 9  28.6991 5.83179 23.0309     9.0877   10.4291     9.53192  6.06355    240.361     28.5234     60.3606     
1 1 1 35 12 12 o 5  76.1155 3.29272 108.232     12.4019  106.265     12.5939  82.6364    181.273     52.369      181.273     
1 1 1 35 12 13 o 9  72.0794 3.75797 92.4869     13.6583  102.681     13.2343  71.4289    106.45      35.7583     106.45      
1 1 1 35 12 14 o 11 60.69   3.80141 66.2257     11.5781  72.6716     11.2603  47.4514    84.5341     4.77149     84.5341     
1 1 1 35 12 15 o 9  31.258  5.92247 19.6481     9.58245  21.2199     9.36241  17.825     262.048     7.66945     82.0479     
1 1 1 35 12 16 o 5  37.7531 5.52465 31.3084     10.2972  27.0116     9.92535  28.6749    231.92      4.26385     231.92      
1 1 1 35 12 17 o 12 27.8576 6.09653 15.9887     9.59944  16.4835     9.16997  17.6787    282.412     0.772569    102.412     
1 1 1 35 12 18 o 10 33.2273 6.03962 17.9017     9.86039  29.166      10.6588  27.6964    59.2245     18.736      59.2245     
1 1 1 35 12 19 o 19 18.6003 5.54914 5.3037      9.20839  -0.115099   8.65798  5.67162    170.65      1.86533     350.65      
1 1 1 35 12 20 o 1  36.6738 5.58253 35.9343     10.2414  20.4796     9.84348  32.8932    323.77      17.3263     323.77      
1 1 1 35 12 21 o 11 34.7305 5.73779 31.9946     10.088   19.0288     9.80444  30.3051    274.505     16.0561     274.505     
1 1 1 35 12 22 o 1  38.9394 6.3359  37.0132     13.0444  28.5318     11.2129  20.6788    284.322     14.216      104.322     
1 1 1 35 12 23 o 11 39.3822 6.43517 30.8351     13.2796  36.3551     11.6926  28.2701    92.7883     1.3932      92.7883     
1 1 1 35 12 24 o 13 38.0529 6.16541 42.6804     12.2416  20.6726     11.3549  27.8748    314.17      3.03874     314.17      
1 1 1 35 12 25 o 16 23.4803 6.35804 1.01192     11.3938  16.2644     11.033   11.6505    50.7128     3.02345     230.713     
1 1 1 35 12 26 o 5  20.0009 6.14004 -4.58413    12.9466  6.29961     10.7968  5.78046    147.711     1.18471     327.711     
1 1 1 35 12 27 o 11 22.6267 6.37677 6.83993     11.3961  9.86374     10.4775  9.69442    224.023     0.580811    224.023     
1 1 1 35 12 28 o 10 21.1333 6.41486 2.18814     11.7898  6.02848     12.622   7.57646    166.7       2.53513     346.7       
1 1 1 35 12 29 o 2  15.9701 5.35229 -15.1609    11.361   -5.12876    11.7206  0.579688   200.499     1.72917     20.4987     
1 1 1 35 12 30 o 8  26.4514 7.24797 16.7992     12.0222  9.94274     16.4982  13.0359    245.518     4.81811     245.518     
1 1 1 35 12 31 o 13 16.8714 5.66043 -3.01152    10.8283  -28.9655    17.1556  1.70924    303.751     2.56854     123.751     
1 1 1 35 12 32 o 9  19.6339 6.21969 3.46199     11.2815  -7.11098    14.824   4.49254    11.3608     0.730873    191.361     
1 1 1 35 12 33 o 13 26.9088 7.32466 16.4444     12.2066  12.8613     16.2652  16.3141    340.501     6.6361      340.501     
1 1 1 35 12 34 o 19 21.9095 6.90704 -15.9697    14.9566  13.329      17.2259  7.08857    200.601     2.00155     200.601     
1 1 1 35 12 35 o 10 22.4214 7.05841 -6.31014    14.3802  11.0004     17.75    10.9684    69.1961     2.08838     69.1961     
1 1 1 35 12 36 o 10 23.102  7.16721 10.6523     15.0718  -5.1112     18.2083  6.80547    77.8598     3.04561     77.8598     
1 1 1 35 12 37 o 14 24.4154 7.58318 12.3501     15.3176  -4.85502    22.9895  13.7778    346.82      2.09818     346.82      
1 1 1 35 12 38 f 0  29.3502 7.87973 10.5495     15.7603  30.1371     17.3265  26.441     300.951     0           0           
1 1 1 35 12 39 o 17 26.4481 7.71381 13.5888     16.4471  15.8263     16.6656  16.439     325.583     5.93896     325.583     
1 1 1 35 12 40 o 4  25.6377 7.66932 19.53       16.075   1.11105     20.3086  14.7874    320.043     4.77683     320.043     
1 1 1 35 12 41 o 10 33.2982 9.11002 38.2125     24.721   30.2428     18.7548  23.0393    334.508     5.13494     334.508     
1 1 1 35 12 42 o 15 28.7166 8.56016 21.554      25.1489  23.4349     18.123   15.167     23.1147     7.31201     23.1147     
1 1 1 35 12 43 o 5  23.746  7.70075 12.809      24.1191  3.58045     16.9823  7.2568     317.53      1.45574     317.53      
1 1 1 35 12 44 o 11 25.6213 8.01445 4.75902     25.0428  20.45       18.2307  8.1282     236.523     2.50167     236.523     
1 1 1 35 12 45 o 5  30.707  9.01804 45.8324     26.2672  21.3825     19.1468  16.9224    18.7601     6.53397     18.7601     
1 1 1 35 12 46 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 12 47 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 13 0  o 3  47.9027 4.59696 44.4343     10.4621  44.4343     10.4621  53.3       180         33.2932     180         
1 1 1 35 13 1  o 5  32.2665 5.88937 21.2574     9.52347  22.3682     9.65454  24.0037    112.061     3.98271     112.061     
1 1 1 35 13 2  o 4  20.5093 5.72689 1.63045     9.18655  9.4723      8.76032  8.25999    114.818     1.03249     114.818     
1 1 1 35 13 3  f 0  22.9525 5.93616 11.2579     8.84255  8.08597     9.0692   31.919     134.24      0           0           
1 1 1 35 13 4  o 10 48.967  4.34751 49.0982     10.4871  43.6443     10.3513  53.3066    180.446     37.9303     180.446     
1 1 1 35 13 5  o 16 52.9528 4.0791  51.4079     10.6359  55.8368     10.6446  52.5136    74.2095     27.7583     74.2095     
1 1 1 35 13 6  o 13 17.2577 5.2701  -5.04718    8.57295  4.76224     8.6812   0.531434   183.2       22.3856     183.2       
1 1 1 35 13 7  o 18 26.5483 5.93169 20.4634     9.44124  8.12519     9.15187  15.3927    123.224     4.09619     303.224     
1 1 1 35 13 8  o 15 59.715  3.84978 66.8397     11.5173  68.3778     11.2637  66.5287    22.3795     46.375      22.3795     
1 1 1 35 13 9  o 4  23.1109 5.90348 15.9814     9.6317   2.64427     9.05466  5.01146    159.078     2.49734     159.078     
1 1 1 35 13 10 o 10 20.0899 5.76862 2.5681      9.5787   7.29678     8.8278   8.2734     31.7989     4.72051     211.799     
1 1 1 35 13 11 o 16 27.4026 5.9807  11.1869     9.19373  20.1652     9.35883  15.9524    97.262      4.43584     277.262     
1 1 1 35 13 12 o 19 21.8708 6.05339 7.65176     9.29667  8.02502     9.97738  3.50568    313.259     21.9107     133.259     
1 1 1 35 13 13 o 8  17.5837 5.36412 -0.769429   8.59313  3.04051     8.71869  4.14297    170.229     10.0246     350.229     
1 1 1 35 13 14 o 10 27.5577 6.12674 15.0328     9.19467  17.2278     9.68192  17.6849    309.056     0.0623363   129.055     
1 1 1 35 13 15 o 8  54.6901 4.56643 58.5803     12.7749  58.6252     11.7349  44.1107    357.114     7.66542     357.114     
1 1 1 35 13 16 o 19 19.757  5.74502 7.91573     9.33851  0.57453     9.34356  7.64026    171.112     4.33183     351.112     
1 1 1 35 13 17 o 3  46.7544 5.66316 31.1179     11.3348  61.7351     14.1217  43.961     339.736     21.6753     339.736     
1 1 1 35 13 18 o 6  35.6612 6.42355 22.6089     11.9505  33.1412     11.4231  31.6345    175.328     18.4365     175.328     
1 1 1 35 13 19 o 12 20.9808 6.13661 7.50904     11.0525  3.80433     9.99423  6.26415    114.245     12.6546     294.245     
1 1 1 35 13 20 o 3  50.2356 5.20696 49.542      13.1174  52.7246     12.2415  49.3036    102.638     27.4809     102.638     
1 1 1 35 13 21 o 1  36.7063 6.42981 29.1077     12.1872  30.0029     11.3612  28.0565    3.0492      6.08937     3.04919     
1 1 1 35 13 22 o 1  26.3136 6.73129 15.7641     11.7879  13.4553     11.0247  13.0848    61.6751     7.03745     241.675     
1 1 1 35 13 23 o 19 24.3911 6.47729 -0.530134   12.6098  19.0493     11.3397  6.49439    292.899     18.6986     112.899     
1 1 1 35 13 24 o 17 24.9031 6.73981 8.7321      12.8     14.8422     11.1863  12.7056    146.737     2.91056     326.737     
1 1 1 35 13 25 o 17 20.1526 6.19449 4.14723     12.4196  1.41694     10.8534  4.97977    262.615     11.8065     82.6148     
1 1 1 35 13 26 o 18 49.0318 6.212   43.9373     14.7109  59.7781     14.4836  35.1668    137.85      0.0696657   137.852     
1 1 1 35 13 27 o 7  25.7245 6.84489 11.0574     12.8096  15.7207     11.4856  9.62675    89.8569     13.8866     269.857     
1 1 1 35 13 28 o 16 19.6039 5.89064 -12.6153    11.762   10.7751     10.9179  6.58811    162.163     2.76833     342.163     
1 1 1 35 13 29 o 4  32.7285 7.47716 32.4242     15.5876  18.8835     12.584   18.1164    74.8994     8.20245     254.899     
1 1 1 35 13 30 o 1  18.6444 6.18415 -9.03908    15.1003  -6.65008    14.132   5.64203    270.189     7.51313     90.1886     
1 1 1 35 13 31 o 10 29.4965 7.36562 40.0366     17.5745  -10.8032    16.2582  21.0694    56.0428     12.3614     56.0428     
1 1 1 35 13 32 o 18 21.7554 6.93002 1.18153     16.0033  0.657668    15.8327  10.046     151.512     4.35262     331.512     
1 1 1 35 13 33 o 3  49.3936 8.03961 46.984      19.5656  73.174      19.9232  38.3791    157.127     6.81944     157.127     
1 1 1 35 13 34 o 6  24.9794 7.4896  -1.57843    17.5077  18.5723     16.6544  10.1619    248.82      5.3119      248.82      
1 1 1 35 13 35 f 0  23.313  7.30862 8.71186     17.0724  2.16699     16.9974  17.4658    231.157     0           0           
1 1 1 35 13 36 o 11 23.1576 7.27998 6.48888     17.0208  4.74859     16.8935  10.1553    122.625     7.47156     302.625     
1 1 1 35 13 37 o 5  23.9948 7.68862 9.1417      17.3616  0.57598     23.5127  12.7086    44.0131     0.60113     44.0131     
1 1 1 35 13 38 o 4  25.0988 7.84016 17.493      17.7359  -1.11062    23.4893  13.5146    271.261     0.298244    271.261     
1 1 1 35 13 39 o 1  26.7052 8.33512 17.8836     18.2205  14.2654     26.9839  14.8784    227.106     2.76        227.106     
1 1 1 35 13 40 o 17 26.2633 8.14629 22.2171     18.2189  4.61778     26.4741  13.3012    44.753      3.0336      44.753      
1 1 1 35 13 41 o 13 28.3212 8.25395 34.2911     18.7308  3.66049     24.7433  14.9125    176.554     3.08284     356.554     
1 1 1 35 13 42 f 0  30.2217 9.0069  20.0118     19.5037  45.8399     26.7691  19.3006    68.4335     0           0           
1 1 1 35 13 43 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 13 44 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 13 45 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 14 0  o 19 17.7768 7.03719 8.97611     9.40918  8.97611     9.40918  15.6176    2.23118e-05 58.3678     2.23118e-05 
1 1 1 35 14 1  o 18 43.1783 5.24583 31.2499     10.8275  45.132      10.8381  39.0385    237.652     16.4024     237.652     
1 1 1 35 14 2  o 11 46.788  4.8637  35.346      10.8788  52.6618     10.8059  40.9896    353.515     13.8958     353.515     
1 1 1 35 14 3  o 19 25.3313 5.97038 6.01694     9.58858  19.2808     9.4354   2.70723    114.444     41.4642     114.444     
1 1 1 35 14 4  o 11 29.765  5.99975 10.5893     9.81558  27.321      10.1932  11.6659    108.018     18.7106     288.018     
1 1 1 35 14 5  o 18 53.2954 4.51363 45.3279     11.4033  66.9534     11.8469  54.6751    315.99      31.9727     315.99      
1 1 1 35 14 6  o 5  39.1751 5.82172 32.4405     11.1534  32.2137     10.9779  31.2982    112.971     6.99947     112.971     
1 1 1 35 14 7  o 2  48.2579 4.86617 49.1502     11.5045  43.905      11.3394  36.1262    326.12      1.17722     326.12      
1 1 1 35 14 8  o 19 16.7708 5.31284 1.24077     9.28156  -5.0894     9.3666   2.23457    302.793     25.0603     302.793     
1 1 1 35 14 9  o 18 35.0429 6.27262 27.4712     11.4789  25.9934     10.5718  29.4102    255.026     11.8713     255.026     
1 1 1 35 14 10 o 6  37.3071 5.8922  40.0773     11.1969  20.1806     10.7106  26.2156    250.105     0.489411    70.1049     
1 1 1 35 14 11 o 7  15.7288 5.19092 -6.47765    9.45328  -6.01628    10.6438  1.55342    62.3355     2.73667     242.335     
1 1 1 35 14 12 o 15 56.365  4.84238 59.4641     13.4452  67.2067     13.2724  54.7243    250.044     27.0882     250.044     
1 1 1 35 14 13 o 13 23.5483 6.57263 11.0678     12.1574  8.73975     10.7185  10.9944    205.151     6.30271     25.1508     
1 1 1 35 14 14 o 6  21.0239 6.35887 2.70667     13.2849  5.46927     10.697   3.59925    131.692     0.625726    131.692     
1 1 1 35 14 15 o 15 31.9203 6.99689 24.9961     12.9524  21.6971     11.7485  24.6689    171.458     13.5515     171.458     
1 1 1 35 14 16 o 17 28.878  6.90753 15.4504     12.4011  21.6177     11.7032  15.2438    11.9626     9.13647     11.9626     
1 1 1 35 14 17 o 4  23.4225 6.66984 14.0083     12.0677  2.87953     12.8274  10.9754    114.129     4.39977     294.129     
1 1 1 35 14 18 o 11 20.8645 6.26402 6.72837     12.0615  2.76961     10.7387  6.83066    341.565     0.91206     161.565     
1 1 1 35 14 19 o 9  21.1223 6.30314 6.85862     12.0621  3.78369     10.7823  7.84484    213.733     4.97975     33.7335     
1 1 1 35 14 20 o 8  23.1955 6.57454 12.182      12.3001  6.47932     11.0144  10.71      357.236     3.01239     177.236     
1 1 1 35 14 21 o 4  25.2865 6.89072 10.5374     12.6187  14.9134     12.2179  11.3727    139.442     8.81385     319.442     
1 1 1 35 14 22 o 8  46.6551 6.08605 38.7087     14.0401  55.0297     13.0638  32.9225    338.496     1.45964     158.496     
1 1 1 35 14 23 o 10 22.8782 6.47508 2.05573     12.269   13.6214     11.2588  10.55      159.542     5.27586     339.542     
1 1 1 35 14 24 o 14 18.6357 5.81273 8.3496      11.8737  -12.2615    10.5877  5.91475    167.353     4.75361     347.353     
1 1 1 35 14 25 o 4  20.8215 6.50521 3.14242     15.5363  1.7666      10.9833  8.97198    158.449     1.27678     338.449     
1 1 1 35 14 26 o 3  38.1232 8.25843 34.9919     18.7329  38.1002     16.1285  21.3198    349.05      11.1628     169.05      
1 1 1 35 14 27 o 14 27.4269 7.94868 26.2261     21.5273  7.73968     12.9052  14.0407    140.797     7.94329     320.797     
1 1 1 35 14 28 o 10 41.2389 8.41759 52.1827     21.6726  35.8033     15.1161  30.0184    355.491     2.2293      355.491     
1 1 1 35 14 29 o 1  31.0162 7.83112 12.8807     21.4059  29.1687     13.5943  23.0818    290.093     6.77048     290.093     
1 1 1 35 14 30 o 2  24.6917 7.45071 17.2398     19.652   5.21524     12.4397  12.815     137.5       5.78957     137.5       
1 1 1 35 14 31 o 5  28.6189 7.7985  9.65711     21.2681  24.4914     13.8969  11.7976    254.59      15.0496     74.59       
1 1 1 35 14 32 o 2  17.4699 5.91513 -18.1402    18.115   -6.44159    11.7793  4.66391    250.823     2.07508     70.8229     
1 1 1 35 14 33 o 14 23.6461 7.35073 2.08688     17.2624  12.4425     16.8108  10.9306    311.522     4.22842     311.522     
1 1 1 35 14 34 o 17 30.5415 8.34028 29.1071     18.6304  22.6255     17.6375  21.5224    106.809     6.17155     106.809     
1 1 1 35 14 35 o 12 25.9013 7.75763 23.2594     18.1378  5.4039      17.6432  13.1678    327.682     4.8425      147.682     
1 1 1 35 14 36 o 8  20.6907 6.79252 -5.77844    16.851   4.12331     17.111   7.1709     322.393     5.80047     142.393     
1 1 1 35 14 37 o 7  36.4666 8.99063 48.4123     20.5951  37.4892     20.0636  27.2346    90.3388     8.67634     90.3388     
1 1 1 35 14 38 o 9  30.3027 8.5326  28.0148     19.4172  30.3954     19.4951  17.7271    118.056     0.858717    298.056     
1 1 1 35 14 39 o 19 20.7177 6.83587 -6.31176    17.9967  5.71849     17.3123  0.757873   50.5491     0.172186    230.549     
1 1 1 35 14 40 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 14 41 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 14 42 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 15 0  o 4  36.5119 7.49735 31.4361     11.9046  31.4361     11.9046  38.0841    180         21.6886     180         
1 1 1 35 15 1  o 8  44.0224 5.88752 53.1639     12.4993  30.3534     12.3249  35.2675    156.578     7.001       156.578     
1 1 1 35 15 2  o 2  32.7225 6.65586 23.8897     11.4859  24.4677     11.5123  21.5919    233.581     1.63634     53.5808     
1 1 1 35 15 3  o 5  19.1451 5.82    6.69708     10.3641  -2.886      10.2767  0.507355   266.715     25.2868     266.715     
1 1 1 35 15 4  o 15 31.6202 6.54233 22.9421     10.9175  21.9218     11.1411  18.6241    328.43      6.26047     148.43      
1 1 1 35 15 5  o 14 53.1129 4.91077 58.468      12.6413  55.0838     12.8498  41.5714    114.013     4.5104      114.013     
1 1 1 35 15 6  o 18 31.989  5.88846 36.847      11.1945  7.90941     10.4568  7.48099    344.879     5.68059     344.879     
1 1 1 35 15 7  o 6  27.76   6.38364 6.79252     10.9021  25.7728     11.3061  18.7476    302.84      6.31911     302.84      
1 1 1 35 15 8  o 19 25.1431 6.55179 9.18038     10.8746  16.636      11.2051  10.8045    297.48      10.7101     117.48      
1 1 1 35 15 9  o 18 34.8484 6.75628 22.6583     13.0377  32.5586     11.8121  15.2258    126.87      19.3023     306.87      
1 1 1 35 15 10 o 15 32.3187 7.51182 22.4521     13.9989  27.4992     14.2428  24.5669    138.135     9.58489     138.135     
1 1 1 35 15 11 o 10 27.2702 6.88698 17.0896     12.5859  15.7608     11.2108  16.7813    134.653     1.25595     134.653     
1 1 1 35 15 12 o 12 66.4005 4.88691 86.8296     17.1341  90.1211     14.6603  65.8995    55.9035     33.6047     55.9035     
1 1 1 35 15 13 o 13 26.6492 7.03065 24.3609     14.3461  5.58352     11.929   16.3469    111.93      3.64741     111.93      
1 1 1 35 15 14 o 19 26.178  6.99601 13.3419     12.7107  15.6003     12.4547  10.836     202.256     12.72       22.2561     
1 1 1 35 15 15 o 16 65.0632 4.78392 78.6814     15.479   90.6661     15.1315  61.8455    17.1539     27.3185     17.1539     
1 1 1 35 15 16 o 12 22.4646 6.55595 -2.05169    12.5928  14.2097     12.6256  10.8713    4.3035      0.982868    184.303     
1 1 1 35 15 17 o 18 38.531  6.80233 35.3416     13.5154  32.1617     12.6771  32.3251    276.393     11.5906     276.393     
1 1 1 35 15 18 o 1  35.8526 6.78794 39.5965     13.4588  19.8892     12.3029  27.3553    141.094     5.29307     141.094     
1 1 1 35 15 19 o 18 26.7904 7.18273 26.5132     15.6713  3.73229     12.0983  17.9318    129.658     5.35464     129.658     
1 1 1 35 15 20 o 2  22.3577 6.59353 -4.3715     15.149   12.541      11.6042  3.08996    224.901     23.7702     44.9007     
1 1 1 35 15 21 o 10 22.6169 6.78453 -2.60445    16.4771  11.1893     12.0121  11.9693    322.305     2.98629     322.305     
1 1 1 35 15 22 o 17 30.2824 7.85443 31.5985     17.7368  13.11       13.9453  23.3079    330.489     9.0867      330.489     
1 1 1 35 15 23 o 7  64.9443 7.85879 70.9365     26.748   128.331     17.7447  40.6902    309.662     15.1199     129.662     
1 1 1 35 15 24 o 18 26.9998 7.39356 7.67905     17.533   20.7615     13.0993  12.2007    168.97      11.9712     348.97      
1 1 1 35 15 25 o 19 22.2042 6.90694 0.948305    17.7365  6.80182     12.6469  11.5049    312.125     1.8835      132.125     
1 1 1 35 15 26 o 15 30.7734 7.9286  37.16       18.6954  12.0131     13.855   13.7561    132.585     15.0679     312.585     
1 1 1 35 15 27 f 0  38.3055 8.1543  46.5892     18.8793  31.1914     15.0779  27.2556    14.9127     0           0           
1 1 1 35 15 28 o 4  22.9948 6.98372 -7.78339    19.2834  14.0607     13.1183  7.62161    208.479     14.4925     28.4792     
1 1 1 35 15 29 o 19 26.0222 7.47388 8.82087     18.7533  18.6455     13.5137  16.0711    42.6437     0.947732    42.6437     
1 1 1 35 15 30 o 1  24.9605 7.48623 20.4004     19.4443  7.34805     12.6956  13.2001    276.347     3.72521     96.3473     
1 1 1 35 15 31 o 1  22.3709 6.9939  6.67612     18.309   6.81836     12.7784  9.27503    95.4809     1.7232      95.4809     
1 1 1 35 15 32 o 12 27.1653 7.40473 -5.33079    22.7169  28.4476     13.9454  16.2826    14.0711     0.417069    14.0711     
1 1 1 35 15 33 o 12 19.598  6.53832 -10.2696    21.719   0.168361    12.8002  3.63754    55.397      0.906852    235.397     
1 1 1 35 15 34 o 18 21.8179 7.09493 10.6562     21.7299  1.40905     13.1209  7.61178    185.364     1.53338     5.36396     
1 1 1 35 15 35 o 3  44.4332 9.6285  71.746      26.8972  63.5244     20.7524  37.9953    129.77      18.1923     129.77      
1 1 1 35 15 36 o 15 24.8611 7.7938  6.62274     22.8253  19.698      17.6701  10.9258    264.441     1.82431     84.4412     
1 1 1 35 15 37 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 15 38 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 15 39 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 16 0  o 7  40.2686 7.20431 36.6956     12.571   36.6956     12.571   46.8569    180         34.5502     180         
1 1 1 35 16 1  o 2  60.0391 4.86041 75.6433     14.3358  69.4849     14.353   65.6698    12.7198     43.4817     12.7198     
1 1 1 35 16 2  o 13 86.8326 4.0669  137.993     16.634   154.16      18.5722  78.7142    96.8044     25.4448     96.8044     
1 1 1 35 16 3  o 19 71.0279 4.53874 108.979     15.0973  90.8169     16.4886  67.2753    338.479     27.6246     338.479     
1 1 1 35 16 4  o 8  65.7677 5.10444 90.7001     17.3475  85.2823     15.7347  66.1749    359.651     34.2554     359.651     
1 1 1 35 16 5  o 7  56.7761 5.54903 72.5007     15.4873  61.9862     15.1696  42.3134    271.315     0.361484    91.3145     
1 1 1 35 16 6  o 7  61.1773 5.32157 78.5561     16.1395  75.4666     15.8039  47.822     151.611     3.77065     151.611     
1 1 1 35 16 7  o 7  90.2548 4.19116 160.482     19.2074  156.396     18.4955  95.1308    154.612     53.6208     154.612     
1 1 1 35 16 8  o 7  23.2065 6.79184 9.59171     13.5909  7.73124     12.1747  8.53153    277.382     13.0293     97.3824     
1 1 1 35 16 9  o 18 53.001  5.88806 64.7662     15.662   54.687      14.5778  57.7427    355.534     39.8409     355.534     
1 1 1 35 16 10 f 0  23.3124 6.6906  16.445      13.1837  -0.40218    12.4375  17.3889    33.7768     0           0           
1 1 1 35 16 11 o 18 28.5091 7.27147 11.0169     14.7333  24.445      13.2418  19.0019    273.45      0.749993    273.45      
1 1 1 35 16 12 o 9  30.4146 7.85792 24.912      17.532   20.0096     13.6933  16.3605    3.17207     9.37927     183.172     
1 1 1 35 16 13 o 12 59.5564 5.9661  81.5581     17.8027  69.5969     16.7884  53.896     296.32      19.1851     296.32      
1 1 1 35 16 14 o 13 36.2724 8.16487 37.0855     19.0422  30.1778     14.4703  21.8382    254.498     8.10775     74.4981     
1 1 1 35 16 15 o 15 86.1749 5.34346 154.631     25.1162  150.602     20.1618  86.563     196.339     43.1584     196.339     
1 1 1 35 16 16 o 18 24.548  7.57391 3.47531     20.2403  11.1182     15.6826  15.1961    205.292     3.91338     205.292     
1 1 1 35 16 17 o 12 62.6453 7.20007 98.7657     24.7871  82.107      18.6802  61.7146    55.2994     30.9819     55.2994     
1 1 1 35 16 18 o 6  27.6374 8.04439 15.965      21.3918  17.2123     15.191   19.4461    31.4425     8.39271     31.4425     
1 1 1 35 16 19 o 1  39.0054 8.4796  37.9314     21.8777  43.1194     15.9887  32.7309    2.09554     11.5347     2.09554     
1 1 1 35 16 20 o 18 36.9199 8.48904 53.486      21.2874  22.8284     15.4964  20.8075    38.7685     11.0015     218.768     
1 1 1 35 16 21 o 7  46.2939 8.21107 52.7167     21.3846  57.8891     17.116   38.0024    163.304     9.48283     163.304     
1 1 1 35 16 22 o 13 23.9962 7.33546 12.9458     18.1083  6.43747     14.0637  11.7872    104.128     5.33051     104.128     
1 1 1 35 16 23 o 8  45.1892 7.77645 75.116      20.8154  32.4807     15.0669  44.9615    105.99      27.7777     105.99      
1 1 1 35 16 24 o 17 21.2467 6.76825 1.12578     18.2566  4.15788     12.4461  9.89753    313.827     3.85623     133.827     
1 1 1 35 16 25 o 14 30.2362 8.47654 41.5505     22.8008  13.1242     15.525   18.6748    131.403     2.39912     311.403     
1 1 1 35 16 26 o 14 24.6643 7.39634 23.8945     18.4322  2.5653      13.4151  12.6678    300.292     4.73638     300.292     
1 1 1 35 16 27 o 14 26.7493 7.41655 1.62451     19.778   26.4846     14.1402  16.5769    131.587     1.89951     131.587     
1 1 1 35 16 28 o 11 25.9539 7.53563 38.5598     20.1255  -5.16772    13.1741  7.95518    161.397     4.07167     161.397     
1 1 1 35 16 29 o 8  31.6316 7.92343 21.6064     20.3422  35.0081     14.55    15.3851    254.196     11.9026     74.1959     
1 1 1 35 16 30 o 18 22.5893 7.08368 0.597963    19.7084  12.7441     14.0611  5.65274    29.066      0.994774    29.066      
1 1 1 35 16 31 o 16 17.6843 5.90679 -28.8034    18.9684  2.5315      12.0822  2.84042    253.881     6.55052     73.8809     
1 1 1 35 16 32 o 12 21.6566 6.95477 9.26269     19.1435  4.26961     13.5104  7.07668    212.326     3.58601     32.3257     
1 1 1 35 16 33 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 16 34 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 16 35 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 17 0  o 6  98.4899 5.49435 189.412     26.7192  189.412     26.7192  95.5691    1.16632e-05 38.9979     1.16632e-05 
1 1 1 35 17 1  o 16 23.3212 7.24616 -3.26451    16.5131  13.1537     16.9117  13.8718    313.085     1.93132     313.085     
1 1 1 35 17 2  o 18 73.1198 5.79061 113.855     22.6     112.757     18.7441  82.7554    270.471     55.9947     270.471     
1 1 1 35 17 3  o 1  23.9587 7.16629 13.2748     16.6393  6.08673     12.8869  13.004     152.854     4.50632     332.854     
1 1 1 35 17 4  o 12 87.8314 5.28213 174.785     24.9062  144.379     21.1949  83.0628    169.877     32.2279     169.877     
1 1 1 35 17 5  o 10 24.8258 7.1113  10.7944     14.1817  13.152      13.4052  15.3876    299.924     0.205387    119.925     
1 1 1 35 17 6  o 5  32.1936 7.82615 28.2962     16.2875  24.1709     14.2432  9.28292    319.337     28.1744     139.337     
1 1 1 35 17 7  o 8  26.3865 7.57213 20.6408     17.7843  9.94572     13.3691  17.1617    235.59      8.79458     235.59      
1 1 1 35 17 8  o 18 23.5797 7.03077 -2.97381    18.0166  14.5238     12.9737  13.618     311.971     5.13042     311.971     
1 1 1 35 17 9  o 3  22.0056 7.13836 -1.84431    20.1821  1.85364     15.7666  11.7451    2.03586     0.746651    182.036     
1 1 1 35 17 10 o 9  20.6753 6.60496 1.77547     16.6708  0.735246    12.3643  9.97233    316.582     0.751875    316.582     
1 1 1 35 17 11 o 2  25.899  8.69313 7.05835     54.5757  7.09657     13.4346  15.8663    63.2768     5.83727     63.2768     
1 1 1 35 17 12 o 7  31.1922 8.08741 15.5847     20.3075  32.5601     15.7671  20.401     169.97      1.98752     349.97      
1 1 1 35 17 13 o 4  35.6478 8.50022 30.39       21.9621  39.4398     16.2444  25.1598    104.902     0.294059    104.902     
1 1 1 35 17 14 o 15 35.0821 8.6723  41.7973     21.174   29.0793     16.3745  28.2274    105.022     8.98116     105.022     
1 1 1 35 17 15 o 3  20.9417 6.93719 -41.3094    31.3367  4.92631     13.1353  2.15582    128.98      0.805994    128.98      
1 1 1 35 17 16 o 5  20.481  6.71463 2.83856     18.9533  -3.99374    13.2415  9.66125    48.4855     1.01094     228.485     
1 1 1 35 17 17 o 7  31.1729 8.19153 47.5581     21.1822  7.93248     14.9215  12.4891    307.179     9.24674     307.179     
1 1 1 35 17 18 o 9  34.8599 8.07572 18.6558     21.93    45.7968     16.3141  30.6042    272.576     18.6558     272.576     
1 1 1 35 17 19 o 17 22.3983 7.13081 3.50781     20.2164  6.59327     13.9463  11.4006    182.389     1.559       2.38937     
1 1 1 35 17 20 o 17 48.7799 8.74189 78.9968     24.5111  56.74       18.3291  41.5683    204.286     13.1256     204.286     
1 1 1 35 17 21 o 8  20.3634 6.69078 -8.09852    20.1873  3.28036     13.8907  6.84708    283.95      0.0799665   103.95      
1 1 1 35 17 22 o 11 38.5077 9.56694 54.9951     23.4476  48.1136     22.3232  25.7918    135.602     1.81397     315.602     
1 1 1 35 17 23 f 0  21.3521 6.92365 -6.07026    20.7529  7.99485     14.6124  15.0215    264.018     0           0           
1 1 1 35 17 24 o 18 23.3035 7.30537 26.9029     20.1036  -5.80563    13.8555  9.92876    303.104     6.99893     123.104     
1 1 1 35 17 25 o 6  28.3988 8.26029 45.2294     22.5727  6.21263     16.3203  16.7214    288.518     0.769891    108.518     
1 1 1 35 17 26 o 1  22.461  7.26111 14.4493     21.2165  2.77713     14.7672  7.46155    349.751     0.0667358   349.751     
1 1 1 35 17 27 o 16 16.138  5.58978 -23.829     18.5894  -10.0404    12.3969  1.13081    46.1726     5.6482      226.173     
1 1 1 35 17 28 o 18 18.5166 6.32603 -3.31111    20.9444  -8.86459    13.2016  2.39329    40.2291     2.91903     220.229     
1 1 1 35 17 29 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 17 30 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 17 31 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 18 0  o 3  43.0193 13.6673 71.3787     31.4904  71.3787     31.4904  47.1712    180         37.4858     180         
1 1 1 35 18 1  o 5  25.5972 8.12973 4.12396     27.0069  15.8121     18.6166  16.2326    233.784     6.0098      233.784     
1 1 1 35 18 2  o 4  29.8677 8.78872 18.2115     29.1324  29.611      18.5644  22.3119    91.181      11.6084     91.181      
1 1 1 35 18 3  o 15 30.2787 8.65384 8.11419     28.1033  36.2336     19.1946  23.4155    99.4835     11.006      99.4835     
1 1 1 35 18 4  o 7  28.9964 8.85616 26.9609     28.3823  21.4886     19.3976  13.8609    344.114     12.2892     164.114     
1 1 1 35 18 5  o 7  30.5471 8.88079 58.6821     27.5396  -0.663629   18.2042  6.47464    50.9224     4.66471     50.9224     
1 1 1 35 18 6  o 10 26.8821 8.39568 -5.66434    34.8512  23.1831     18.2716  9.7441     172.294     5.88207     172.294     
1 1 1 35 18 7  o 4  26.348  8.76232 20.3466     37.2565  7.62515     21.998   16.6403    41.0469     3.5633      41.0469     
1 1 1 35 18 8  f 0  40.2489 12.1882 334.453     113.821  61.4464     26.3234  27.4675    125.399     0           0           
1 1 1 35 18 9  o 18 22.3304 7.50328 -2.87961    32.7581  1.77124     13.9631  10.9106    183.669     3.58112     3.66863     
1 1 1 35 18 10 o 12 28.7334 9.20778 63.8092     37.3183  4.5299      15.7794  19.4832    120.743     5.40942     120.743     
1 1 1 35 18 11 o 9  18.7013 6.30314 0.754338    18.6369  -11.1184    12.6571  5.0511     75.1849     0.820534    255.185     
1 1 1 35 18 12 o 17 22.5289 7.21807 4.16857     21.0693  7.30171     14.6485  8.61569    347.181     10.9802     167.181     
1 1 1 35 18 13 o 4  20.1714 6.59872 -20.1474    20.6781  7.40882     14.176   7.01072    101.677     0.29442     281.677     
1 1 1 35 18 14 o 13 17.391  5.96351 -2.80251    18.2133  -15.3221    11.9986  3.98676    62.4644     3.80513     242.464     
1 1 1 35 18 15 o 12 25.213  7.9125  28.1303     21.4512  -1.41124    19.6888  12.5519    340.655     4.43741     340.655     
1 1 1 35 18 16 o 9  25.8779 7.84744 17.9937     21.3406  17.2961     15.6696  14.4306    265.339     1.93393     85.3386     
1 1 1 35 18 17 o 5  19.3329 6.48141 -3.15828    19.8341  -3.33314    13.5688  5.42145    342.29      9.06997     162.29      
1 1 1 35 18 18 o 4  19.7464 6.56251 8.99999     18.698   -9.46998    13.4547  6.20929    42.4121     4.51399     222.412     
1 1 1 35 18 19 o 12 22.0782 7.15091 11.8204     20.5813  2.99812     14.6801  8.81673    86.4551     1.78847     266.455     
1 1 1 35 18 20 o 15 25.6416 7.54599 -0.795008   21.7631  27.154      15.6761  13.5406    37.9634     1.95529     217.963     
1 1 1 35 18 21 o 13 21.4451 6.98149 2.59846     21.2013  6.57813     14.2267  3.29366    272.898     0.0304736   272.898     
1 1 1 35 18 22 o 3  22.4045 7.20249 11.6218     20.927   6.71168     14.3826  7.35306    293.959     0.624128    113.959     
1 1 1 35 18 23 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 18 24 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 18 25 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 18 26 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 19 0  o 7  20.997  10.2451 10.7476     36.1059  10.7476     36.1059  7.44315    180         0.0954428   2.22988e-05 
1 1 1 35 19 1  o 14 32.486  10.38   69.5533     40.3583  47.5227     31.8539  22.1435    18.6572     3.4092      18.6571     
1 1 1 35 19 2  o 14 25.0622 8.78913 8.26614     35.7324  -2.84161    50.8266  7.37035    281.972     2.73759     281.972     
1 1 1 35 19 3  o 9  24.9446 8.77904 -23.5241    35.8446  35.3969     46.1156  10.5249    346.971     2.84658     346.971     
1 1 1 35 19 4  o 17 29.5692 14.4795 0           0        56.3989     51.0461  12.7538    170.002     0.524305    350.002     
1 1 1 35 19 5  o 1  23.9323 11.8005 -0.953825   35.838   0           0        6.9123     159.935     2.411       339.935     
1 1 1 35 19 6  o 10 25.2756 8.87193 2.02211     38.1856  15.5273     47.6518  11.9478    272.525     2.37118     272.525     
1 1 1 35 19 7  o 17 29.1831 10.3871 140.627     157.839  70.7311     53.1686  17.1794    162.181     4.47731     162.181     
1 1 1 35 19 8  o 12 24.3635 8.61952 -23.7665    34.3571  31.5537     48.0683  11.4221    279.052     3.30975     99.0515     
1 1 1 35 19 9  o 3  26.0819 8.6892  16.4205     39.0025  22.0075     23.9791  13.5516    359.191     3.11509     179.191     
1 1 1 35 19 10 o 4  25.414  8.38784 -9.17148    38.5511  26.3919     22.9144  12.9676    248.048     2.23725     68.0476     
1 1 1 35 19 11 o 11 23.116  7.89972 8.7245      36.688   3.2881      19.8268  9.18788    296.178     7.42432     116.178     
1 1 1 35 19 12 o 8  22.6465 7.86684 35.9723     34.5201  -17.8699    18.1536  4.18668    167.849     0.531484    167.849     
1 1 1 35 19 13 o 1  22.834  7.65618 2.33534     37.8464  8.2003      14.982   1.95473    349.288     0.362344    349.288     
1 1 1 35 19 14 f 0  21.6826 7.62782 30.0602     37.826   -10.469     14.1695  0.626007   162.866     0           0           
1 1 1 35 19 15 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 19 16 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 19 17 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 19 18 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 19 19 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 19 20 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 0  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 1  x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 2  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 3  x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 4  x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 5  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 6  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 7  x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 8  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 9  x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 35 20 10 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 0  0  o 9  37.1545 8.72919 31.6793     14.4629  31.6793     14.4629  6.36694    180         40.5768     180         
1 1 1 36 0  1  o 4  76.4487 3.49168 105.359     13.2475  105.359     13.2475  31.8449    60          51.1375     240         
1 1 1 36 0  2  f 0  136.214 3.00054 330.933     20.4373  330.933     20.4373  121.448    120         0           0           
1 1 1 36 0  3  o 18 52.2736 4.3646  50.7653     11.0154  50.7653     11.0154  31.2403    180         16.5949     180         
1 1 1 36 0  4  o 12 19.4402 7.10066 10.0025     8.88708  10.0025     8.88708  2.41039    59.9999     7.09733     59.9999     
1 1 1 36 0  5  o 3  74.7813 3.28874 100.677     12.2144  100.677     12.2144  76.1964    300         42.8821     300         
1 1 1 36 0  6  o 12 156.107 2.89006 434.209     22.5744  434.209     22.5744  108.942    180         16.3713     8.65257e-06 
1 1 1 36 0  7  o 4  8.45245 4.23529 -9.60008    7.47035  -9.60008    7.47035  36.2485    240         76.1608     240         
1 1 1 36 0  8  o 9  112.488 2.76929 225.76      15.5682  225.76      15.5682  55.2381    300         58.1941     120         
1 1 1 36 0  9  o 18 89.5567 2.82532 143.451     12.6226  143.451     12.6226  55.3272    180         23.5673     8.65137e-06 
1 1 1 36 0  10 o 19 92.6462 2.83631 153.478     13.1123  153.478     13.1123  78.9371    240         19.1075     240         
1 1 1 36 0  11 o 9  60.289  3.53719 66.0757     10.5118  66.0757     10.5118  31.2012    120         22.566      120         
1 1 1 36 0  12 o 2  25.5053 6.91774 15.904      8.35419  15.904      8.35419  3.44023    180         24.0486     180         
1 1 1 36 0  13 o 12 48.7233 4.03186 44.0591     9.49239  44.0591     9.49239  8.09186    60.0001     4.8028      60.0001     
1 1 1 36 0  14 o 6  19.2043 6.84359 9.81826     8.13487  9.81826     8.13487  6.78735    120         21.5508     120         
1 1 1 36 0  15 o 19 16.865  6.64963 7.05052     8.36057  7.05052     8.36057  2.82477    180         7.96263     180         
1 1 1 36 0  16 o 15 131.613 2.88534 309.067     18.9893  309.067     18.9893  92.8935    240         10.5151     60          
1 1 1 36 0  17 o 14 38.3894 6.03581 30.0384     10.1477  30.0384     10.1477  15.2887    120         4.95021     120         
1 1 1 36 0  18 o 12 32.707  7.14516 24.0518     10.2491  24.0518     10.2491  1.26169    5.06635e-11 44.1179     180         
1 1 1 36 0  19 o 16 41.9804 5.73864 34.9492     10.7739  34.9492     10.7739  22.9148    240         15.391      60          
1 1 1 36 0  20 f 0  45.3957 6.08149 40.8129     12.3897  40.8129     12.3897  17.9227    300         0           0           
1 1 1 36 0  21 o 5  50.2683 5.86759 49.0206     13.572   49.0206     13.572   26.1809    1.59014e-06 22.2075     180         
1 1 1 36 0  22 o 3  52.8125 3.99789 51.5393     10.2754  51.5393     10.2754  40.9217    60          3.64132     60          
1 1 1 36 0  23 o 12 61.3563 3.61696 68.6066     10.9373  68.6066     10.9373  32.5283    120         25.7693     300         
1 1 1 36 0  24 o 2  11.1217 5.26172 -2.7059     8.1165   -2.7059     8.1165   19.0867    8.65149e-06 47.2025     8.65149e-06 
1 1 1 36 0  25 o 15 12.8517 5.89519 -0.211959   9.03146  -0.211959   9.03146  1.83373    240         5.38109     240         
1 1 1 36 0  26 o 16 22.8489 7.67805 14.0668     10.0125  14.0668     10.0125  4.70559    300         40.4203     300         
1 1 1 36 0  27 o 14 9.30037 4.59196 -7.43005    7.8341   -7.43005    7.8341   19.8261    180         46.137      180         
1 1 1 36 0  28 o 1  161.849 2.80222 467.742     22.6979  467.742     22.6979  127.376    60          16.8496     60          
1 1 1 36 0  29 o 8  121.57  2.96271 264.616     18.0012  264.616     18.0012  86.716     120         4.98303     300         
1 1 1 36 0  30 o 19 19.1906 7.10046 9.93412     8.96763  9.93412     8.96763  0.891726   180         20.5809     180         
1 1 1 36 0  31 o 18 73.6797 3.25443 98.1762     11.9079  98.1762     11.9079  85.9398    60          64.2279     60          
1 1 1 36 0  32 o 3  53.9485 3.93612 53.8757     10.3595  53.8757     10.3595  45.5007    120         12.2578     120         
1 1 1 36 0  33 o 16 48.4173 4.31619 44.1301     10.0212  44.1301     10.0212  32.4523    3.26152e-06 5.64868     180         
1 1 1 36 0  34 o 2  14.2212 6.18504 3.24091     8.54968  3.24091     8.54968  8.03595    240         28.6465     240         
1 1 1 36 0  35 o 5  29.7129 7.02004 20.7092     9.31665  20.7092     9.31665  17.2935    300         5.30468     120         
1 1 1 36 0  36 o 2  90.9764 3.0612  149.011     13.8843  149.011     13.8843  82.3684    180         32.8889     180         
1 1 1 36 0  37 o 9  38.3283 5.86365 30.1046     9.87706  30.1046     9.87706  12.7334    240         9.81803     240         
1 1 1 36 0  38 o 11 58.1514 3.91601 62.4602     11.1596  62.4602     11.1596  61.2531    300         38.6927     300         
1 1 1 36 0  39 o 16 70.1423 3.68248 89.8703     12.7766  89.8703     12.7766  66.8338    0           32.6441     0           
1 1 1 36 0  40 f 0  33.6062 6.9555  25.3516     10.1736  25.3516     10.1736  21.3549    60          0           0           
1 1 1 36 0  41 o 1  118.536 2.85991 252.236     16.944   252.236     16.944   100.261    300         30.5514     300         
1 1 1 36 0  42 o 11 11.2264 5.36801 -3.70572    8.87747  -3.70572    8.87747  2.72901    180         9.61086     180         
1 1 1 36 0  43 f 0  79.1594 3.34252 113.855     13.1505  113.855     13.1505  43.7692    240         0           0           
1 1 1 36 0  44 o 2  32.1359 7.22756 24.1439     10.2447  24.1439     10.2447  21.027     120         3.3526      300         
1 1 1 36 0  45 o 9  21.6303 7.56947 13.2477     9.86565  13.2477     9.86565  6.12328    180         16.7764     8.66172e-06 
1 1 1 36 0  46 o 19 83.4168 3.35092 126.699     13.9038  126.699     13.9038  50.9324    60          16.3184     240         
1 1 1 36 0  47 o 5  18.0556 7.43093 8.3957      11.0849  8.3957      11.0849  3.43359    300         14.5925     120         
1 1 1 36 0  48 o 9  54.5845 4.98343 57.5356     13.0076  57.5356     13.0076  58.0092    1.27312e-06 39.1227     1.27312e-06 
1 1 1 36 0  49 o 12 125.502 3.1285  285.287     19.621   285.287     19.621   101.12     240         25.8267     240         
1 1 1 36 0  50 o 7  44.9382 6.8235  42.8709     13.4898  42.8709     13.4898  44.0699    120         25.4018     120         
1 1 1 36 0  51 o 13 33.6452 7.51284 27.0012     11.1322  27.0012     11.1322  15.7906    180         15.3866     8.66192e-06 
1 1 1 36 0  52 o 16 19.82   7.65172 11.4346     10.8128  11.4346     10.8128  5.17108    240         2.588       60          
1 1 1 36 0  53 o 9  39.8598 6.70716 34.5233     11.6274  34.5233     11.6274  20.9193    300         13.5482     120         
1 1 1 36 0  54 o 9  31.5243 8.23289 25.7797     12.0477  25.7797     12.0477  19.1835    1.60015e-09 4.50631     180         
1 1 1 36 0  55 o 17 15.7006 6.91184 4.51966     10.9966  4.51966     10.9966  1.04559    240         8.50018     60          
1 1 1 36 0  56 o 17 10.3193 5.1367  -10.3828    10.4102  -10.3828    10.4102  1.0847     300         3.84868     300         
1 1 1 36 0  57 o 9  54.5482 5.69461 59.3545     14.5725  59.3545     14.5725  50.8025    1.85975e-06 26.7062     1.85975e-06 
1 1 1 36 0  58 o 19 41.7351 6.84735 37.9562     12.4572  37.9562     12.4572  43.8392    60          33.6984     60          
1 1 1 36 0  59 o 5  17.4777 7.60567 7.06438     12.9456  7.06438     12.9456  3.13021    300         1.87472     120         
1 1 1 36 0  60 o 8  33.8286 9.61957 32.9027     15.8694  32.9027     15.8694  26.4189    180         7.84379     180         
1 1 1 36 0  61 o 14 24.2895 9.11094 19.6241     14.9248  19.6241     14.9248  9.72119    60          11.4268     240         
1 1 1 36 0  62 o 18 13.0612 6.40312 -7.78999    14.5248  -7.78999    14.5248  0.707896   120         3.79389     120         
1 1 1 36 0  63 o 1  14.3528 7.08017 -9.88328    18.5081  -9.88328    18.5081  5.1901     360         22.8344     360         
1 1 1 36 0  64 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 0  65 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 1  0  o 5  66.4987 3.52723 80.1094     11.5989  80.1094     11.5989  66.726     180         39.3643     180         
1 1 1 36 1  1  o 12 85.0818 3.17441 126.613     13.6777  133.061     13.2761  37.4165    305.858     48.4543     125.858     
1 1 1 36 1  2  o 2  53.9742 4.11729 51.8239     10.5465  54.2137     11.3728  36.1321    295.716     5.97407     295.716     
1 1 1 36 1  3  o 15 25.3694 5.9689  9.35264     8.88248  13.0678     8.9721   4.28326    88.5377     25.9268     88.5377     
1 1 1 36 1  4  o 10 39.6873 5.03959 27.9225     9.70907  30.874      9.58616  13.0561    241.802     0.571232    241.802     
1 1 1 36 1  5  f 0  34.6077 5.67997 24.5978     9.43945  20.8082     9.91181  19.7142    70.0193     0           0           
1 1 1 36 1  6  o 12 184.347 3.10033 598.85      29.3581  616.569     27.8796  144.834    326.897     15.5597     326.897     
1 1 1 36 1  7  o 14 44.2905 5.13548 42.5158     10.7284  30.8892     11.0506  12.9759    140.693     5.93242     140.693     
1 1 1 36 1  8  o 4  89.5243 3.19336 145.372     13.3923  142.182     15.0927  59.2642    120.371     10.75       300.371     
1 1 1 36 1  9  o 12 76.8691 3.2028  114.624     12.2915  97.9277     12.2193  28.0144    327.185     55.1483     147.185     
1 1 1 36 1  10 o 12 113.042 2.83557 227.268     16.015   229.776     16.0609  74.606     84.5139     16.7146     264.514     
1 1 1 36 1  11 o 2  13.8173 4.57299 -6.6834     7.92604  -8.64699    7.91062  2.6797     323.255     6.70312     323.255     
1 1 1 36 1  12 o 15 33.1864 5.58597 24.6708     9.26482  17.2766     9.15965  2.92996    117.259     34.3205     297.259     
1 1 1 36 1  13 o 17 36.0048 5.98428 27.3949     10.1632  22.0437     11.1356  14.3092    57.8114     11.7772     237.811     
1 1 1 36 1  14 o 4  88.446  3.36405 143.448     14.9071  137.961     14.8022  82.4819    216.78      38.9177     216.78      
1 1 1 36 1  15 o 9  91.9189 3.48609 157.239     15.3018  147.107     16.6072  73.9722    57.267      14.8037     57.267      
1 1 1 36 1  16 o 7  17.1985 5.34636 -0.803526   8.9205   -3.14921    8.91465  3.14089    207.626     12.7941     207.626     
1 1 1 36 1  17 o 7  38.9158 5.68123 25.7501     10.5843  31.9153     10.8499  18.901     118.191     11.1583     118.191     
1 1 1 36 1  18 o 13 73.841  3.49008 103.385     12.7434  93.5929     12.9024  63.3096    177.658     21.2593     177.658     
1 1 1 36 1  19 o 15 17.7954 5.34363 3.1392      8.70144  -2.58946    8.09435  0.991421   37.3413     7.85774     37.3413     
1 1 1 36 1  20 o 13 71.4895 3.63069 95.8195     12.4239  89.296      13.3484  69.921     159.689     40.0364     159.689     
1 1 1 36 1  21 o 11 61.0832 3.77795 66.6112     11.2905  69.0848     11.6072  37.9977    217.122     10.8544     37.1217     
1 1 1 36 1  22 o 17 42.8719 4.8842  30.1257     9.75111  38.9333     10.4861  29.5409    320.352     3.19027     320.352     
1 1 1 36 1  23 o 3  79.6236 3.1363  113.046     12.2487  115.448     12.6813  58.693     222.47      2.58826     222.47      
1 1 1 36 1  24 o 17 115.595 2.73348 243.445     15.7659  235.839     15.8547  108.726    249.444     49.2861     249.444     
1 1 1 36 1  25 o 16 24.3011 5.85223 12.3426     8.47569  8.16115     8.76022  5.06324    11.923      14.0324     191.923     
1 1 1 36 1  26 f 0  33.68   6.16599 23.9244     10.0101  20.1557     11.0604  45.4816    228.597     0           0           
1 1 1 36 1  27 o 13 44.2424 4.64394 39.8279     10.0357  33.5123     9.88217  37.0997    107.976     22.5207     107.976     
1 1 1 36 1  28 o 5  57.9048 3.68637 58.5655     10.5849  64.0018     10.5604  45.1607    207.072     9.85307     207.072     
1 1 1 36 1  29 o 19 80.9477 3.11383 117.954     12.635   118.924     12.5323  64.8864    340.463     13.947      340.463     
1 1 1 36 1  30 o 15 103.733 2.92121 184.809     14.6854  203.293     15.6301  75.2555    329.2       0.377609    329.201     
1 1 1 36 1  31 f 0  62.6818 3.63707 75.066      11.135   68.585      11.4724  30.1578    285.731     0           0           
1 1 1 36 1  32 o 13 109.318 2.83872 210.036     15.5157  220.682     15.5276  99.0138    296.179     40.6952     296.179     
1 1 1 36 1  33 o 18 17.4644 5.20789 -12.5171    9.27772  6.49594     8.3929   5.6553     147.707     28.9279     147.707     
1 1 1 36 1  34 o 8  20.4626 5.73807 5.26403     8.85538  4.64134     8.6658   1.47302    115.236     16.835      295.236     
1 1 1 36 1  35 o 9  18.6551 5.51872 3.55066     8.59357  0.183378    8.79315  0.784069   331.888     12.9674     151.888     
1 1 1 36 1  36 o 10 47.4535 4.79338 36.5378     11.1532  48.9835     10.6801  19.6744    298.857     26.4346     118.857     
1 1 1 36 1  37 o 19 66.6516 3.54101 86.9685     11.7637  75.8434     11.6771  55.4392    159.61      17.8218     159.61      
1 1 1 36 1  38 o 7  78.9079 3.36288 109.325     13.4775  117.872     12.9514  60.2147    91.781      8.74646     91.781      
1 1 1 36 1  39 o 6  18.9614 5.66588 4.40254     8.96448  -2.12846    9.92511  3.17962    126.097     8.21735     306.097     
1 1 1 36 1  40 o 3  33.0668 6.09557 19.8245     10.4669  24.0383     10.0211  21.4572    161.063     1.9244      161.063     
1 1 1 36 1  41 o 3  108.476 2.98582 214.379     16.1329  213.199     16.2671  93.9831    112.078     33.8126     112.078     
1 1 1 36 1  42 o 5  63.6816 3.93873 76.2754     12.6989  74.7745     12.1861  46.9751    278.73      5.04068     278.73      
1 1 1 36 1  43 o 3  90.5358 3.34224 140.148     15.2203  161.222     14.9149  77.4635    54.1058     27.3699     54.1058     
1 1 1 36 1  44 o 5  48.178  5.04921 47.9714     12.429   42.5281     11.2254  31.6981    255.45      2.42756     75.4496     
1 1 1 36 1  45 o 3  95.5041 3.26243 167.253     15.8771  168.408     15.2491  75.4701    24.6506     16.5749     24.6506     
1 1 1 36 1  46 o 8  56.6477 4.40774 56.9013     12.4812  65.9641     12.001   30.4528    207.321     17.5442     27.321      
1 1 1 36 1  47 o 10 63.1371 4.17117 75.0885     13.3466  76.4732     12.724   33.9543    67.4147     19.7227     247.415     
1 1 1 36 1  48 o 17 29.6627 6.30844 30.1889     11.9469  6.14078     10.5588  15.9738    317.827     4.44134     137.827     
1 1 1 36 1  49 o 4  61.2646 5.0804  77.9424     17.0822  70.3098     13.3758  52.9524    336.039     23.0061     336.039     
1 1 1 36 1  50 o 6  84.2826 4.05328 137.232     17.1883  132.524     16.8484  67.2812    332.575     18.262      332.575     
1 1 1 36 1  51 o 18 52.7018 5.59564 46.6547     14.3823  66.7925     13.6199  24.9056    16.0695     21.5781     196.07      
1 1 1 36 1  52 o 3  35.7791 6.93004 24.3002     13.094   32.5288     12.7474  21.6819    109.489     0.791923    289.489     
1 1 1 36 1  53 o 18 19.1654 5.98047 3.53527     10.8029  -4.70226    12.1365  3.03132    47.645      2.43473     227.645     
1 1 1 36 1  54 o 4  23.718  6.67495 14.1551     12.9458  4.19539     11.1314  6.34292    210.889     14.704      30.8891     
1 1 1 36 1  55 o 3  16.8454 5.53713 -8.20459    10.6694  -4.51814    11.8359  1.35126    201.921     13.3452     21.9206     
1 1 1 36 1  56 o 13 21.4417 6.38838 6.72672     11.8138  3.20177     11.6701  4.7442     136.08      14.9761     316.08      
1 1 1 36 1  57 o 17 71.0936 4.58062 84.4453     15.3994  114.882     16.7284  51.5676    159.095     7.21895     159.095     
1 1 1 36 1  58 o 7  50.7042 6.24281 67.4595     14.9745  44.0327     15.1508  33.318     347.561     0.143209    167.56      
1 1 1 36 1  59 o 8  39.2456 7.99355 31.4767     16.8087  46.1221     16.944   29.1875    4.025       10.9891     4.025       
1 1 1 36 1  60 o 14 21.4286 6.74408 -5.69171    14.9339  9.48456     14.99    6.04935    133.516     1.79437     313.516     
1 1 1 36 1  61 o 7  28.5985 7.76944 26.7457     15.9774  13.7959     16.1477  8.19436    136.332     4.00373     136.332     
1 1 1 36 1  62 o 13 19.8578 6.69203 -12.7012    18.1525  -3.9434     18.7149  1.67265    196.69      2.07529     16.6899     
1 1 1 36 1  63 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 1  64 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 2  0  o 16 22.8806 7.44776 13.844      9.36701  13.844      9.36701  0.224675   180         8.12028     180         
1 1 1 36 2  1  o 17 87.6308 3.34989 142.976     14.7113  133.253     14.5913  56.8589    94.2542     14.0929     274.254     
1 1 1 36 2  2  o 7  21.2212 5.92078 8.29016     9.52768  0.491553    9.49943  0.670033   148.29      4.86597     148.29      
1 1 1 36 2  3  o 19 37.3696 5.38132 23.4856     9.65695  29.3631     9.81607  9.59746    40.2481     28.4975     220.248     
1 1 1 36 2  4  o 6  44.0412 5.20528 35.0642     10.893   37.42       11.2746  17.2952    10.8478     24.2405     190.848     
1 1 1 36 2  5  o 11 80.0733 3.55095 119.549     15.1254  111.699     13.2152  53.4743    66.3064     9.06971     246.306     
1 1 1 36 2  6  f 0  77.5581 3.67623 109.998     13.867   107.241     14.5254  31.6451    192.105     0           0           
1 1 1 36 2  7  o 4  119.632 3.3774  248.653     20.2114  265.822     20.1854  87.3801    282.567     2.25165     102.567     
1 1 1 36 2  8  o 14 23.5883 6.24117 8.20222     9.88505  7.94881     9.99844  0.736831   328.137     15.0786     148.137     
1 1 1 36 2  9  o 2  82.6185 3.71944 125.319     15.2546  121.315     15.3792  45.2664    178.807     30.406      358.807     
1 1 1 36 2  10 o 16 56.3907 4.79792 63.3393     13.8227  54.0297     12.7479  25.3096    218.272     29.7316     38.2724     
1 1 1 36 2  11 o 13 19.3887 5.88342 1.90604     10.8305  -1.86984    9.69629  2.39679    287.103     17.5835     287.103     
1 1 1 36 2  12 f 0  26.1803 6.37869 15.9665     10.1472  6.3871      10.881   28.5569    36.2193     0           0           
1 1 1 36 2  13 o 3  85.9703 3.60035 132.821     14.9028  134.083     15.966   76.6267    216.236     28.4761     216.236     
1 1 1 36 2  14 o 10 127.355 3.05727 283.12      18.8421  299.059     20.129   104.281    115.488     20.0658     115.488     
1 1 1 36 2  15 o 8  55.5658 4.03105 53.7558     10.5436  59.0757     11.5944  50.4203    267.299     26.0166     267.299     
1 1 1 36 2  16 o 19 93.7419 2.93375 162.137     14.0313  153.431     13.4667  86.9546    3.03086     37.53       3.03086     
1 1 1 36 2  17 o 9  81.0793 3.0733  125.078     12.6902  111.678     12.1863  51.5945    236.455     15.1653     56.4547     
1 1 1 36 2  18 o 13 88.4128 3.03065 138.317     13.4825  142.868     13.2865  59.3915    35.5389     10.569      215.539     
1 1 1 36 2  19 f 0  90.6715 3.13177 148.844     15.0319  147.252     13.2945  53.3674    103.096     0           0           
1 1 1 36 2  20 f 0  56.3626 3.95464 60.5052     11.4805  55.7563     10.5699  22.3743    331.702     0           0           
1 1 1 36 2  21 o 11 31.3159 5.6676  25.969      9.18446  11.7269     9.4184   11.3168    40.9202     4.62729     40.9202     
1 1 1 36 2  22 f 0  67.5294 3.50759 97.19       12.3077  69.5113     11.1687  58.4088    68.9484     0           0           
1 1 1 36 2  23 o 18 65.4711 3.45175 80.913      11.5128  74.791      10.9763  48.4548    340.43      3.57414     340.43      
1 1 1 36 2  24 o 7  88.9186 3.14302 141.012     13.6742  144.51      14.2474  83.1117    76.1586     38.13       76.1586     
1 1 1 36 2  25 o 11 25.8346 6.09509 13.3484     9.77615  11.0397     8.73859  5.90934    225.438     45.21       225.438     
1 1 1 36 2  26 o 11 30.5613 6.19605 23.1245     10.5903  13.294      9.716    15.9317    250.201     1.37043     70.2011     
1 1 1 36 2  27 o 6  63.5644 3.88683 78.795      12.5309  69.5211     11.9787  56.7976    290.992     24.8291     290.991     
1 1 1 36 2  28 o 8  87.7957 3.13681 135.673     13.8566  143.272     13.6411  75.424     159.22      24.4453     159.22      
1 1 1 36 2  29 o 2  39.2789 5.20913 27.3206     10.002   31.8792     9.72197  27.8515    198.435     5.50084     198.435     
1 1 1 36 2  30 o 4  55.3047 4.15366 58.5751     11.8884  54.6877     10.7832  52.3571    28.6481     30.6179     28.6481     
1 1 1 36 2  31 o 12 71.9443 3.44354 99.0041     12.5268  89.7588     12.1501  55.5146    156.006     8.58367     156.006     
1 1 1 36 2  32 o 16 104.478 2.96134 194.428     15.8057  200.046     15.1204  92.3232    118.909     34.0563     118.909     
1 1 1 36 2  33 o 14 80.0995 3.27134 113.252     13.2694  120.027     12.8557  60.5713    182.842     6.60855     182.842     
1 1 1 36 2  34 o 9  50.2836 4.50696 42.3409     10.8364  52.777      11.2887  32.2565    142.289     5.0811      322.289     
1 1 1 36 2  35 o 1  22.0372 5.89857 12.477      9.38584  -1.088      9.8892   4.82507    209.65      36.9886     209.65      
1 1 1 36 2  36 o 13 74.5786 3.44658 103.22      13.0739  100.138     12.5479  70.3488    303.574     35.846      303.574     
1 1 1 36 2  37 o 17 33.2726 6.14663 24.0043     10.7117  20.4045     10.0286  19.0607    195.411     4.34899     15.4115     
1 1 1 36 2  38 o 11 32.3208 6.20911 18.9759     10.2998  23.1023     10.3941  19.7631    158.019     1.04763     338.019     
1 1 1 36 2  39 o 3  67.2262 3.75946 80.8847     12.7153  86.3585     12.3815  33.5029    159.547     28.4746     339.547     
1 1 1 36 2  40 o 14 19.4199 5.77699 1.46707     9.55033  3.46335     9.58232  4.79932    171.85      2.22691     351.85      
1 1 1 36 2  41 o 1  37.107  6.00024 25.7124     10.9295  30.2124     10.9252  21.5484    278.431     6.36835     98.431      
1 1 1 36 2  42 o 12 40.6006 5.87748 34.8636     11.8975  31.8346     11.2187  25.1726    350.719     4.36528     170.719     
1 1 1 36 2  43 o 9  63.9226 4.05411 77.4295     12.7612  76.4943     12.9347  49.4079    262.206     9.60421     262.206     
1 1 1 36 2  44 o 14 21.2111 6.10003 4.20764     10.1318  6.84679     10.2489  8.2498     59.8611     2.10251     239.861     
1 1 1 36 2  45 o 16 97.1945 3.35145 165.258     16.1764  184.636     16.3413  77.3127    222.654     17.6849     222.654     
1 1 1 36 2  46 o 3  52.8559 4.74765 53.8217     12.2767  55.1649     12.3063  42.2533    357.073     12.6774     357.073     
1 1 1 36 2  47 o 1  28.6249 6.64804 15.573      11.0235  19.0245     11.09    14.8577    234.067     4.97004     54.0671     
1 1 1 36 2  48 o 10 57.9547 4.66187 63.5245     13.168   67.387      13.4269  44.728     151.003     10.4834     151.003     
1 1 1 36 2  49 o 6  65.3187 4.19334 85.985      13.187   77.5756     13.8703  56.1769    129.327     23.4124     129.327     
1 1 1 36 2  50 o 4  36.5477 6.63671 35.9894     12.7112  22.7175     12.0942  25.7837    161.656     7.00656     161.656     
1 1 1 36 2  51 o 2  43.596  6.13242 40.3651     13.389   39.7809     12.4572  24.9747    193.066     7.54243     13.066      
1 1 1 36 2  52 o 15 20.4189 6.08775 -8.16485    11.9087  10.3944     11.1751  4.50667    343.599     11.8834     163.599     
1 1 1 36 2  53 o 10 48.321  6.10154 44.9586     13.7478  52.965      14.7211  39.0957    131.065     14.9782     131.065     
1 1 1 36 2  54 o 7  43.7669 6.75983 44.0567     12.6056  39.4661     16.2065  31.174     254.171     5.19987     254.171     
1 1 1 36 2  55 o 15 17.066  5.68368 -6.97593    11.355   -10.7595    13.7788  2.13669    213.582     1.54943     33.582      
1 1 1 36 2  56 o 16 21.525  6.64677 5.73997     12.4249  0.0618449   15.0412  2.9623     127.284     0.813692    127.284     
1 1 1 36 2  57 o 19 35.1659 7.38212 27.904      13.6847  31.1381     14.2323  25.866     97.8413     9.92466     97.8413     
1 1 1 36 2  58 o 6  32.5859 8.00836 19.6102     15.9786  34.5984     16.7789  20.1621    131.693     2.35988     131.693     
1 1 1 36 2  59 o 11 27.404  7.59259 9.23635     15.0861  25.5153     16.1486  10.5707    354.134     10.228      174.134     
1 1 1 36 2  60 o 17 19.2737 6.48718 -9.84558    16.5346  -7.01099    17.8056  0.85712    149.436     21.3173     149.436     
1 1 1 36 2  61 f 0  18.41   6.37515 -35.2149    22.9523  -11.4055    17.9221  2.92104    144.76      0           0           
1 1 1 36 2  62 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 3  0  o 19 28.7289 7.05643 19.4516     9.17076  19.4516     9.17076  14.1897    180         6.68966     8.65222e-06 
1 1 1 36 3  1  o 4  58.2707 3.95252 62.7267     10.9224  60.953      11.8379  49.8337    293.275     18.2397     293.275     
1 1 1 36 3  2  o 16 39.5221 5.25043 30.7193     9.12943  28.162      10.8164  11.1971    271.015     32.3397     91.0148     
1 1 1 36 3  3  o 3  124.535 3.05428 285.121     18.9946  271.498     19.0603  90.8032    227.615     4.1378      47.6152     
1 1 1 36 3  4  o 18 34.8923 6.11104 22.1373     11.2821  24.618      10.0251  16.867     229.052     10.4185     49.0524     
1 1 1 36 3  5  o 3  28.4594 5.97038 17.5464     9.26015  12.9208     9.11031  9.05773    223.658     0.29836     223.658     
1 1 1 36 3  6  o 9  41.632  5.34419 23.0068     10.8755  43.6088     10.1372  17.3976    92.609      22.6819     272.609     
1 1 1 36 3  7  o 9  41.9156 5.6305  32.1045     11.6992  34.5834     11.0697  8.42792    51.7106     42.1456     231.711     
1 1 1 36 3  8  o 2  19.634  5.95078 -3.54301    11.16    2.8967      10.0825  0.176295   69.5631     2.17833     249.563     
1 1 1 36 3  9  o 5  68.352  3.9122  87.9455     14.1621  82.0374     12.3976  40.9084    283.82      17.7468     103.82      
1 1 1 36 3  10 o 15 21.2246 5.84539 -1.91363    9.99355  9.86731     9.05846  1.00842    56.0754     2.81428     236.075     
1 1 1 36 3  11 o 4  18.0703 5.41124 6.81805     9.63477  -12.0165    9.00517  0.745285   51.7384     8.94915     51.7384     
1 1 1 36 3  12 o 9  93.949  3.14869 147.832     15.1314  170.312     14.2987  82.3262    329.739     26.8548     329.739     
1 1 1 36 3  13 o 9  89.3606 3.269   157.967     14.5094  130.658     14.5587  52.2031    35.6599     27.4411     215.66      
1 1 1 36 3  14 o 6  107.82  3.06767 210.892     16.5924  207.328     16.4908  88.5182    249.733     17.8536     249.733     
1 1 1 36 3  15 o 16 67.5007 3.67102 81.577      12.2625  84.0256     12.3824  67.0967    69.0131     39.8348     69.0131     
1 1 1 36 3  16 o 19 89.7208 3.26851 149.157     14.6203  141.5       14.6634  73.1354    124.149     14.9589     124.149     
1 1 1 36 3  17 o 19 84.1648 3.25036 130.829     13.1979  125.064     14.0743  75.4068    333.237     28.6454     333.237     
1 1 1 36 3  18 o 3  70.9865 3.51579 86.3091     12.1038  96.7693     12.7497  70.9168    241.587     41.8092     241.587     
1 1 1 36 3  19 o 10 29.5787 6.20942 24.3965     10.753   8.58532     10.1337  7.19426    204.066     23.0651     24.0656     
1 1 1 36 3  20 o 18 60.9831 4.19042 67.8495     11.2417  68.9938     13.8937  50.3672    160.674     14.6539     160.674     
1 1 1 36 3  21 f 0  23.5697 6.07555 6.50945     9.11779  11.3026     9.64999  36.1211    277.299     0           0           
1 1 1 36 3  22 o 11 60.7454 4.20083 69.0986     11.885   66.948      13.2829  26.9031    222.07      33.8526     42.07       
1 1 1 36 3  23 o 17 56.1019 3.87004 56.4646     10.4117  59.1456     11.0735  38.0659    156.29      3.30242     336.29      
1 1 1 36 3  24 o 18 97.5111 3.108   179.908     14.9842  163.994     15.2715  71.646     284.099     0.728977    284.099     
1 1 1 36 3  25 o 3  38.5163 5.22899 23.7874     9.5485   33.4658     9.87399  11.5919    203.556     29.9097     23.5557     
1 1 1 36 3  26 o 18 48.9147 4.77187 47.1506     11.217   42.8861     11.5083  26.3845    17.1158     15.8952     197.116     
1 1 1 36 3  27 o 4  30.3544 6.1989  18.9829     9.35388  17.0227     10.6449  17.0212    355.497     1.50853     355.497     
1 1 1 36 3  28 o 19 27.6941 6.13675 13.6215     9.30981  15.8363     9.65161  11.5849    301.216     8.75503     121.216     
1 1 1 36 3  29 o 19 143.989 2.81214 373.133     19.767   374.275     20.7667  120.704    62.2083     30.7701     62.2083     
1 1 1 36 3  30 o 1  26.9323 6.09488 10.4901     9.2089   17.0059     9.62866  7.91301    323.095     17.0355     143.095     
1 1 1 36 3  31 o 19 35.5147 5.63641 32.8369     9.63364  17.0111     10.2823  20.446     7.88342     5.24252     187.883     
1 1 1 36 3  32 o 13 60.3064 3.86525 61.1719     11.2969  73.2716     11.7712  46.1147    2.31884     7.27425     2.31884     
1 1 1 36 3  33 o 16 64.007  3.92017 78.1106     11.6965  73.2552     13.0884  50.4662    32.1539     10.4492     32.1539     
1 1 1 36 3  34 o 12 60.7443 3.91645 60.4422     11.4968  76.5563     11.9975  60.8922    24.6149     38.5417     24.6149     
1 1 1 36 3  35 o 3  29.5835 6.23939 16.5544     9.69875  18.281      10.2017  13.8596    353.281     9.65631     173.281     
1 1 1 36 3  36 o 17 32.3651 6.02325 25.6958     9.84029  16.3281     10.3308  10.8692    191.01      21.6298     11.01       
1 1 1 36 3  37 o 10 62.4564 3.90019 62.7145     11.7472  82.987      12.28    43.4854    283.447     1.52418     103.447     
1 1 1 36 3  38 o 12 31.8585 6.21769 24.485      10.2092  16.8177     10.5829  18.0908    127.839     4.99847     307.839     
1 1 1 36 3  39 f 0  73.2302 3.61523 103.171     12.8792  95.4445     13.4382  43.5049    78.7405     0           0           
1 1 1 36 3  40 o 3  31.6887 6.44795 23.6338     10.479   17.923      11.3465  21.2137    129.25      2.96172     129.25      
1 1 1 36 3  41 o 16 24.1831 6.46249 11.546      11.2823  8.84372     10.1543  6.22984    111.708     2.86167     111.708     
1 1 1 36 3  42 o 16 40.6332 5.73142 34.5347     11.099   32.5328     11.4183  23.6513    210.623     7.88299     30.6233     
1 1 1 36 3  43 o 4  36.9658 6.01106 34.5801     10.8249  22.4601     11.2022  25.9586    23.8551     3.66577     23.8551     
1 1 1 36 3  44 o 2  34.6784 6.43017 21.8321     11.7006  29.4904     11.1541  19.6608    34.5456     6.01825     214.546     
1 1 1 36 3  45 o 17 62.0906 4.2718  86.3465     12.5905  62.2144     13.1606  44.6045    104.918     2.91823     104.918     
1 1 1 36 3  46 o 10 50.8222 4.97531 45.8649     12.0381  56.5921     12.5474  34.3681    139.926     0.671808    319.926     
1 1 1 36 3  47 o 10 21.5761 6.15002 0.113921    10.4311  11.4869     10.7876  2.25242    103.069     20.7424     283.069     
1 1 1 36 3  48 o 1  35.9384 6.15752 40.9419     11.608   14.972      11.8956  17.9076    0.941245    10.9239     180.941     
1 1 1 36 3  49 o 9  34.9066 6.54668 22.661      11.4318  30.7294     11.9934  20.0663    296.228     3.78598     116.228     
1 1 1 36 3  50 o 13 25.7748 6.71006 10.2679     11.2028  16.1978     11.7714  9.07761    47.4743     12.2613     227.474     
1 1 1 36 3  51 o 6  95.5901 3.92211 168.524     17.1829  178.418     20.1637  66.8197    315.428     0.831351    315.428     
1 1 1 36 3  52 o 4  21.2441 6.38719 -5.86182    12.6402  10.487      12.3932  1.50446    311.588     29.0973     311.588     
1 1 1 36 3  53 o 7  39.4654 6.98601 49.3241     14.8058  21.8338     14.1563  30.817     315.538     11.7677     315.538     
1 1 1 36 3  54 o 15 26.9747 7.1668  23.5661     14.0937  4.62814     13.8825  15.6004    148.689     1.39759     148.689     
1 1 1 36 3  55 o 16 28.2901 7.0868  5.60924     14.4133  27.0399     13.3452  17.094     227.004     2.10231     227.004     
1 1 1 36 3  56 o 1  32.5953 7.38201 9.88618     13.4453  41.9849     16.4205  22.6856    268.157     7.87028     268.157     
1 1 1 36 3  57 o 19 37.5141 8.85061 44.3923     19.4462  35.0952     20.002   24.0639    280.965     2.29185     280.965     
1 1 1 36 3  58 o 19 20.8682 6.81648 7.6117      16.6137  -17.2096    18.4872  4.72717    121.615     2.40854     301.615     
1 1 1 36 3  59 o 11 27.3801 8.1506  23.0136     17.9307  12.8758     21.2572  9.30362    74.0829     2.90061     74.0829     
1 1 1 36 3  60 o 7  25.5823 8.43    -5.68323    26.9051  21.6489     26.8332  8.15263    202.346     1.17318     22.3459     
1 1 1 36 3  61 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 4  0  o 13 60.9613 3.78933 68.0166     11.3616  68.0166     11.3616  63.136     180         34.3068     180         
1 1 1 36 4  1  o 2  68.9513 3.51619 80.2401     12.0478  92.2849     12.0379  56.4565    127.9       13.0539     127.9       
1 1 1 36 4  2  o 9  52.0191 4.25159 53.3824     11.4385  46.3341     10.33    43.4527    55.1487     15.2371     55.1487     
1 1 1 36 4  3  o 15 34.4474 5.80916 12.9343     10.3483  33.2295     10.3337  9.18632    162.488     5.33234     162.488     
1 1 1 36 4  4  o 16 54.5705 4.41476 58.5425     12.9795  51.3885     10.728   38.1216    225.618     1.30158     45.6181     
1 1 1 36 4  5  o 2  18.5794 5.5509  4.05221     9.4109   -2.43888    8.57106  0.894477   206.816     13.7604     206.816     
1 1 1 36 4  6  o 8  72.4931 3.40875 99.4542     12.3482  90.867      12.2618  51.7055    119.34      2.62559     299.34      
1 1 1 36 4  7  o 16 27.5642 6.08499 19.5709     9.44911  7.56803     10.2517  10.7984    157.621     6.23254     337.621     
1 1 1 36 4  8  o 6  68.8154 3.66985 90.2081     11.7821  82.0204     13.195   74.6219    39.3202     55.1462     39.3202     
1 1 1 36 4  9  o 13 95.5101 3.02276 164.619     14.0186  163.799     14.8298  74.4055    39.3376     7.50886     39.3376     
1 1 1 36 4  10 o 14 26.2084 5.77895 16.6707     8.5375   8.4209      8.80801  2.90603    256.339     26.4358     76.3387     
1 1 1 36 4  11 f 0  110.537 2.8859  223.491     15.4527  215.79      16.4273  86.6213    157.255     0           0           
1 1 1 36 4  12 o 4  98.7921 2.89131 167.68      14.0728  183.587     14.4877  88.2556    55.748      30.879      55.748      
1 1 1 36 4  13 o 14 75.4712 3.29206 94.3104     12.6651  112.228     11.9596  63.1994    144.608     16.6423     144.608     
1 1 1 36 4  14 o 14 28.2369 5.95751 15.1082     9.31503  15.3695     8.82801  12.6733    151.303     2.60261     331.303     
1 1 1 36 4  15 o 12 28.1207 6.00245 17.1299     9.52033  13.1136     8.86794  11.271     325.298     9.37683     145.298     
1 1 1 36 4  16 o 15 64.1212 3.69194 69.7638     12.1983  80.492      11.1551  33.2712    285.997     26.8319     105.997     
1 1 1 36 4  17 o 16 51.7361 4.25336 49.4403     10.9464  49.6561     10.6954  39.7829    189.993     7.34593     189.993     
1 1 1 36 4  18 o 17 49.6625 4.6171  42.9521     11.6517  49.287      10.5858  26.3672    297.265     17.7623     117.265     
1 1 1 36 4  19 o 1  69.2798 3.70763 87.2164     13.1532  88.1519     12.3815  48.4526    127.406     3.60759     307.406     
1 1 1 36 4  20 f 0  23.1134 6.29629 4.83804     9.23491  10.401      11.4067  26.227     205.576     0           0           
1 1 1 36 4  21 o 11 27.1332 6.23165 11.1191     9.36651  16.5714     10.1557  11.3415    176.757     6.76143     356.757     
1 1 1 36 4  22 o 13 21.2076 5.94474 7.71329     8.56317  1.59259     10.7482  0.74899    133.051     25.2852     133.051     
1 1 1 36 4  23 o 14 39.643  5.76077 35.6969     10.8649  25.774      11.2506  22.436     347.775     8.78929     167.775     
1 1 1 36 4  24 o 9  78.7461 3.54765 121.855     13.2069  104.704     14.4423  67.0278    109.166     20.1217     109.166     
1 1 1 36 4  25 o 10 47.7074 4.86098 48.6049     10.5323  37.7525     11.6581  19.0781    42.7145     29.5475     222.715     
1 1 1 36 4  26 o 8  91.7363 3.37401 150.91      15.2735  155.301     15.6432  88.606     57.5419     44.397      57.5419     
1 1 1 36 4  27 o 13 35.3855 5.93998 22.252      9.7684   27.3185     11.006   13.117     187.478     9.19338     187.478     
1 1 1 36 4  28 o 15 90.7001 3.48757 158.831     13.9796  141.5       17.1709  65.4636    220.656     1.10378     40.6567     
1 1 1 36 4  29 o 19 88.8758 3.44511 151.779     14.479   136.631     15.9321  65.2256    219.871     1.36215     219.871     
1 1 1 36 4  30 o 14 34.1895 6.05996 23.7789     9.63607  22.7401     11.1252  14.5815    68.5014     16.5019     248.501     
1 1 1 36 4  31 o 5  53.7857 4.60024 55.4246     11.6905  53.5854     12.5578  37.4234    288.801     0.959487    108.801     
1 1 1 36 4  32 o 11 30.4041 6.20003 15.4421     9.73602  21.5216     10.3243  19.9914    177.188     6.38681     177.188     
1 1 1 36 4  33 o 16 81.4554 3.34161 126.724     13.1963  116.035     13.9002  70.7926    250.374     24.5133     250.374     
1 1 1 36 4  34 o 12 18.2519 5.37602 8.72032     9.25682  -13.3548    9.45561  3.6542     240.478     3.87008     60.4782     
1 1 1 36 4  35 o 1  20.9462 5.90714 -0.0329493  9.58478  9.58223     9.72944  3.90443    147.98      0.382184    147.98      
1 1 1 36 4  36 o 9  31.3522 6.04964 29.0911     10.4045  10.4552     10.5832  18.4684    20.0356     3.58984     200.036     
1 1 1 36 4  37 o 14 30.8023 6.29945 22.263      10.1868  16.6884     10.5511  8.31404    213.662     24.8479     33.6617     
1 1 1 36 4  38 o 18 51.1578 4.65268 48.0878     11.4824  52.6725     11.8137  38.0771    258.009     4.78495     258.009     
1 1 1 36 4  39 o 11 31.59   6.30037 24.593      10.2538  16.9236     10.9038  22.287     285.901     5.38329     285.901     
1 1 1 36 4  40 f 0  38.1962 6.04184 37.8297     10.9718  22.9285     11.8355  26.4631    347.387     0           0           
1 1 1 36 4  41 o 4  25.9239 6.65126 10.5725     11.9669  15.0903     10.6218  13.3163    43.7091     3.8159      223.709     
1 1 1 36 4  42 o 12 33.3541 6.03184 35.7141     10.7375  10.6359     11.7043  22.6352    349.628     2.75184     349.628     
1 1 1 36 4  43 o 3  20.5997 5.96284 9.60662     9.9453   -1.71839    10.5782  7.18719    227.973     2.22817     47.9731     
1 1 1 36 4  44 o 4  24.667  6.20846 0.31759     10.5325  20.2406     10.9768  11.3975    289.667     3.54191     289.667     
1 1 1 36 4  45 o 10 50.1322 5.29145 59.4068     12.4622  42.2037     12.8546  42.2466    318.74      17.1963     318.74      
1 1 1 36 4  46 o 19 24.823  6.44817 17.6396     11.1045  4.99737     10.9393  9.21344    274.284     10.17       94.2844     
1 1 1 36 4  47 o 12 17.9813 5.75312 -9.80087    10.7575  2.84188     11.857   2.06526    330.715     3.72352     150.715     
1 1 1 36 4  48 o 13 30.1017 6.91157 17.0166     11.3618  23.1213     12.5757  16.6757    245.047     2.67696     65.0473     
1 1 1 36 4  49 o 4  36.8272 6.54434 40.2671     12.1406  19.2901     13.2681  23.0778    12.6692     1.37833     192.669     
1 1 1 36 4  50 o 10 24.9334 6.89986 11.5384     12.1629  11.1884     12.8868  7.81486    358.665     14.698      178.665     
1 1 1 36 4  51 o 1  65.0084 5.04838 84.7177     15.7934  83.8774     16.5376  53.3839    151.544     17.7395     151.544     
1 1 1 36 4  52 o 9  35.2096 7.14928 32.3678     13.3266  24.6314     13.4681  27.5175    309.895     18.8973     309.895     
1 1 1 36 4  53 o 12 26.098  7.18563 16.5005     12.7636  10.4641     14.7865  9.42598    100.316     13.0029     280.316     
1 1 1 36 4  54 o 9  21.4268 6.62678 10.9653     14.0728  -7.70706    14.2472  5.73349    58.1985     1.22552     58.1985     
1 1 1 36 4  55 o 18 23.6469 7.22867 11.2955     16.8481  5.17088     14.4871  9.84187    231.897     4.61546     51.8967     
1 1 1 36 4  56 o 8  24.2342 7.06251 27.1272     16.8619  -14.0242    14.6521  10.1776    109.256     0.106056    109.256     
1 1 1 36 4  57 o 19 20.8052 6.66297 -22.2806    18.6966  11.1794     14.8213  4.38885    194.86      2.5171      14.8604     
1 1 1 36 4  58 o 18 20.1351 6.70448 4.03336     17.749   -15.9541    17.7788  2.89254    228.322     3.4187      48.3221     
1 1 1 36 4  59 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 4  60 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 5  0  o 14 33.3171 7.71609 25.8608     11.419   25.8608     11.419   23.1146    360         10.5029     360         
1 1 1 36 5  1  o 3  27.0283 6.24979 6.37216     9.7299   19.8501     10.7042  6.09036    78.7196     20.8866     258.72      
1 1 1 36 5  2  f 0  56.488  4.2711  55.0641     11.1674  62.8067     12.652   57.536     42.6284     0           0           
1 1 1 36 5  3  o 5  50.7717 5.37641 58.2725     11.5828  39.9571     13.9214  42.3202    320.693     14.6395     320.693     
1 1 1 36 5  4  o 10 86.622  3.38188 146.366     13.4549  125.818     15.4783  70.8059    10.6921     13.605      10.6921     
1 1 1 36 5  5  o 12 57.8101 3.81312 57.1143     10.881   65.3624     10.9147  36.5735    170.773     10.5753     350.773     
1 1 1 36 5  6  o 9  17.702  5.20527 6.6281      8.26955  -8.30519    8.44091  0.300265   222.594     9.08059     222.594     
1 1 1 36 5  7  o 17 33.1727 5.45216 20.6871     8.69793  21.8359     9.08548  20.9295    54.2775     4.32653     54.2775     
1 1 1 36 5  8  o 14 99.8707 2.84603 178.94      14.1286  180.106     14.3013  82.1648    148.981     16.0008     148.981     
1 1 1 36 5  9  o 14 62.537  3.48349 72.6431     10.791   69.7713     10.8616  55.7857    317.646     22.2089     317.646     
1 1 1 36 5  10 o 1  24.9835 5.76905 13.3247     7.89151  9.22613     8.97427  8.4839     274.415     6.77577     94.4153     
1 1 1 36 5  11 o 18 43.8422 4.52055 39.5556     9.23446  32.5455     9.87251  15.4422    311.099     31.5769     131.099     
1 1 1 36 5  12 o 7  118.406 2.78678 248.47      16.1702  256.071     16.8564  93.5522    212.371     10.6062     212.371     
1 1 1 36 5  13 o 5  40.783  4.76335 31.2742     8.97403  31.5783     9.80212  32.5924    355.865     13.0772     355.865     
1 1 1 36 5  14 o 19 19.8871 5.56066 1.84984     7.61781  7.28028     8.92395  1.39907    238.406     14.3679     58.4064     
1 1 1 36 5  15 o 13 91.3889 2.94837 153.099     12.8837  148.451     14.0048  50.9283    210.416     33.7201     30.4157     
1 1 1 36 5  16 o 11 107.407 2.93215 209.628     15.1019  206.653     16.3661  61.0304    79.4339     37.742      259.434     
1 1 1 36 5  17 o 18 123.05  2.80123 277.857     16.9345  267.657     17.5458  107.169    35.0389     31.6441     35.0389     
1 1 1 36 5  18 o 14 29.9618 5.81377 21.146      8.8901   13.7809     9.4062   16.7657    103.368     0.23544     283.368     
1 1 1 36 5  19 o 3  46.0105 4.7259  38.1222     10.7494  41.7473     10.3594  21.1989    337.745     22.98       157.745     
1 1 1 36 5  20 o 19 28.2644 5.80123 20.5872     8.85657  9.95793     9.25611  14.0888    5.20127     3.10175     5.20126     
1 1 1 36 5  21 o 17 17.0518 5.20487 2.50712     7.95635  -3.98085    8.63343  2.50466    61.8576     20.188      61.8576     
1 1 1 36 5  22 o 10 29.9198 5.9216  14.6423     9.07407  20.5744     9.51345  14.3727    214.79      6.47783     214.79      
1 1 1 36 5  23 o 9  27.7481 6.07252 17.3104     8.84934  12.018      10.1     8.84178    12.0405     17.2495     192.041     
1 1 1 36 5  24 f 0  81.7596 3.30967 120.02      13.9703  123.333     13.0011  55.95      242.432     0           0           
1 1 1 36 5  25 o 14 112.886 2.88211 228.664     16.1727  231.964     16.3831  95.0102    240.995     24.0288     240.995     
1 1 1 36 5  26 o 3  70.8915 3.62858 89.2844     12.3814  95.1515     13.2294  64.7027    263.21      27.7316     263.21      
1 1 1 36 5  27 o 8  39.1819 5.10736 24.4935     9.21497  35.2136     10.0834  26.0301    350.44      0.870067    170.44      
1 1 1 36 5  28 o 16 16.4974 5.23593 -0.0529565  8.80436  -7.61541    9.55078  0.214781   348.414     11.5677     168.414     
1 1 1 36 5  29 o 8  26.4879 6.03406 13.163      8.38728  13.8774     9.84043  6.16174    236.754     21.9744     56.7544     
1 1 1 36 5  30 o 19 18.665  5.35882 8.43697     7.98269  -9.99761    10.1221  3.97783    26.7413     6.93449     206.741     
1 1 1 36 5  31 o 19 73.3385 3.46762 92.3357     11.6589  105.573     13.6931  63.5986    63.4694     21.5985     63.4694     
1 1 1 36 5  32 o 18 39.527  5.55423 29.2428     9.8946   32.7158     11.339   30.1852    46.0085     7.0602      46.0085     
1 1 1 36 5  33 o 5  41.9931 5.39015 43.4827     9.60141  26.6126     11.6243  38.1094    17.3303     20.9991     17.3303     
1 1 1 36 5  34 o 1  41.4246 5.34923 33.4294     9.61592  34.3685     11.7097  16.1204    162.712     26.0055     342.712     
1 1 1 36 5  35 o 6  25.5128 6.2759  9.35191     8.85815  15.9145     10.8818  14.796     91.5323     2.13248     91.5323     
1 1 1 36 5  36 o 17 23.9411 6.17858 13.837      8.65309  3.9103      12.0978  11.2203    179.945     5.52319     359.945     
1 1 1 36 5  37 o 14 20.3023 5.80355 -2.35473    8.34913  11.2439     10.6573  6.55731    49.3932     9.00029     229.393     
1 1 1 36 5  38 o 9  47.6465 5.00208 45.4579     10.4235  43.8516     12.5371  32.9529    171.446     0.474563    351.446     
1 1 1 36 5  39 o 17 18.7385 5.6519  4.22915     8.36926  -1.24908    10.7461  2.24693    146.047     0.419089    326.047     
1 1 1 36 5  40 o 12 69.9937 3.81074 89.2564     12.1043  95.6154     14.375   55.9094    52.4475     12.6251     52.4475     
1 1 1 36 5  41 o 4  40.4652 5.84437 39.2856     11.5231  28.9235     11.3851  33.7055    281.906     14.5915     281.906     
1 1 1 36 5  42 o 7  37.5683 6.22867 29.8344     11.5403  30.2215     11.504   30.4018    203.786     22.0522     203.786     
1 1 1 36 5  43 o 12 42.3997 5.84367 26.6736     11.9144  49.3536     11.9093  36.2385    150.739     17.7204     150.739     
1 1 1 36 5  44 o 15 33.7471 6.73419 29.457      11.5789  20.7194     12.6576  21.9978    207.285     1.96757     207.285     
1 1 1 36 5  45 o 6  54.0425 5.16665 49.4097     12.8448  68.6499     14.3081  38.2697    151.972     2.40759     151.972     
1 1 1 36 5  46 f 0  28.701  7.14593 10.0451     13.4217  24.6732     13.2891  25.2838    340.976     0           0           
1 1 1 36 5  47 o 1  39.6188 7.00461 32.0725     13.1591  38.3278     14.6024  30.6485    308.228     10.7709     308.228     
1 1 1 36 5  48 o 17 34.5368 7.2236  22.6602     14.1896  31.4706     13.0715  18.2285    128.973     8.52778     308.973     
1 1 1 36 5  49 o 11 32.2749 7.08243 16.7822     12.8533  30.2346     13.1961  24.3756    229.529     11.2878     229.529     
1 1 1 36 5  50 o 13 19.3765 6.09201 -7.80137    11.9535  5.61639     12.4225  5.12043    194.685     10.3069     14.6847     
1 1 1 36 5  51 o 2  25.3498 7.1334  11.0948     12.7928  13.8524     14.3612  13.8586    77.7208     4.59004     77.7208     
1 1 1 36 5  52 o 13 69.8148 5.23748 86.9698     16.6428  113.705     19.4689  56.2148    248.41      16.5681     248.41      
1 1 1 36 5  53 o 16 49.0209 6.81961 28.303      16.5114  87.3966     16.6121  44.2149    100.907     25.2798     100.907     
1 1 1 36 5  54 o 10 28.6518 7.46066 33.3066     16.0301  3.92899     15.2808  14.4111    129.653     4.68355     309.653     
1 1 1 36 5  55 f 0  26.0307 7.57258 8.14677     18.3179  20.2303     14.9742  15.4149    56.399      0           0           
1 1 1 36 5  56 o 18 22.9945 7.174   19.3247     17.9908  -5.89623    15.1592  6.43363    294.705     1.33728     114.705     
1 1 1 36 5  57 o 14 27.0936 8.21771 26.2489     19.4841  8.60852     22.2596  7.41138    217.274     1.94296     217.274     
1 1 1 36 5  58 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 6  0  f 0  103.729 2.85758 193.003     14.8032  193.003     14.8032  39.5077    180         0           0           
1 1 1 36 6  1  o 3  53.1668 4.03875 49.1007     10.2331  55.3826     10.953   19.0006    288.321     39.7976     108.321     
1 1 1 36 6  2  o 18 70.7627 3.48034 85.4034     11.4127  97.2108     13.1292  49.8522    209.668     4.58483     29.6678     
1 1 1 36 6  3  o 1  55.1782 3.98822 53.8913     10.5966  58.4145     11.1519  46.1519    228.534     13.7779     228.534     
1 1 1 36 6  4  f 0  61.0217 3.73428 62.686      10.6523  74.0095     11.9748  43.7199    259.893     0           0           
1 1 1 36 6  5  o 13 63.6619 3.67273 74.8919     10.7543  73.4031     12.3861  44.4333    262.442     4.26592     82.4425     
1 1 1 36 6  6  o 10 20.3671 5.24632 12.4619     7.61256  -8.32961    9.47335  3.04183    16.0678     5.97624     196.068     
1 1 1 36 6  7  o 6  57.2229 3.91389 55.1689     10.323   65.6104     11.8622  30.4128    124.494     22.7852     304.494     
1 1 1 36 6  8  o 16 80.9342 3.15322 115.372     11.6906  122.059     13.7504  69.2505    322.452     19.1483     322.452     
1 1 1 36 6  9  o 1  25.443  5.83599 11.7611     7.92166  12.4091     9.10297  8.86709    146.87      0.0583455   326.87      
1 1 1 36 6  10 o 13 56.9918 3.85999 57.7198     10.167   61.8552     11.6008  35.3841    69.1169     12.0834     249.117     
1 1 1 36 6  11 o 7  67.5338 3.36329 85.3505     10.9396  80.7787     11.6383  65.825     352.171     34.5303     352.171     
1 1 1 36 6  12 o 11 71.8145 3.24585 102.629     11.314   85.1833     11.7875  66.2283    318.671     27.9859     318.671     
1 1 1 36 6  13 o 1  36.9431 5.40449 31.8041     8.8613   21.2686     10.4286  14.8713    93.5845     21.4788     273.585     
1 1 1 36 6  14 o 6  37.8542 5.08774 28.7011     8.92386  26.3506     9.64513  12.7893    13.1869     27.5316     193.187     
1 1 1 36 6  15 o 5  55.2639 3.82451 50.7792     10.0901  62.0595     10.7954  51.067     125.76      24.6038     125.76      
1 1 1 36 6  16 o 14 34.4012 5.54706 15.0497     8.86877  32.2306     10.2332  13.2902    290.576     20.4032     110.576     
1 1 1 36 6  17 o 18 29.5255 5.95362 17.6727     8.96229  16.5395     9.53932  13.7946    1.30573     9.38157     181.306     
1 1 1 36 6  18 o 5  19.4069 5.51777 5.87477     7.90052  1.42766     8.77229  1.11804    201.008     23.3688     201.008     
1 1 1 36 6  19 o 13 30.99   6.06068 12.4347     9.1034   26.0119     10.8599  19.6068    35.457      5.59803     35.457      
1 1 1 36 6  20 o 18 36.5078 5.26961 16.6659     8.9288   36.4332     9.85596  17.6099    78.3472     14.8519     258.347     
1 1 1 36 6  21 o 14 28.3692 5.955   8.7728      9.08567  22.4878     9.9423   15.411     237.766     1.50809     57.7655     
1 1 1 36 6  22 o 9  53.9204 4.05413 48.8563     10.5021  59.4466     11.0266  39.0074    178.527     0.958118    178.527     
1 1 1 36 6  23 o 1  33.4042 5.80259 13.3893     9.30373  31.7339     10.6806  23.7965    88.9501     7.02274     88.9501     
1 1 1 36 6  24 o 13 28.2667 6.13204 19.4462     9.2602   11.2725     10.3641  12.7242    83.4065     10.1838     263.407     
1 1 1 36 6  25 f 0  83.0228 3.21458 121.86      13.0877  129.48      13.5605  79.9952    116.133     0           0           
1 1 1 36 6  26 o 5  76.6599 3.59887 107.682     13.8178  108.394     13.6764  67.8675    113.879     24.3118     113.879     
1 1 1 36 6  27 f 0  20.906  5.97996 3.77311     10.1764  5.91327     9.31508  4.52252    304.159     0           0           
1 1 1 36 6  28 o 10 117.007 2.97652 251.29      17.8804  246.542     16.9643  113.489    68.5514     55.1826     68.5514     
1 1 1 36 6  29 o 14 31.5189 5.96322 10.9304     9.47428  29.7788     10.8046  21.07      175.285     1.52469     175.285     
1 1 1 36 6  30 o 15 53.986  4.12097 54.0661     10.3445  55.6092     11.5719  40.1196    313.174     3.11257     313.174     
1 1 1 36 6  31 o 17 29.8786 6.1982  15.4608     9.80272  21.0699     10.1009  21.5903    62.1129     10.2176     62.1129     
1 1 1 36 6  32 o 11 30.1667 6.11438 17.9801     9.04713  19.4668     10.403   2.13999    39.2286     37.4316     219.229     
1 1 1 36 6  33 o 9  63.8486 3.8223  84.0879     11.3528  68.9213     12.5722  54.9125    200.942     18.4484     200.942     
1 1 1 36 6  34 o 8  26.8407 6.34485 18.9894     9.91074  8.87547     11.086   9.39527    304.145     16.3985     124.145     
1 1 1 36 6  35 o 7  27.9031 6.09977 20.8989     9.11326  9.95814     10.8248  17.1836    230.308     0.000256189 230.741     
1 1 1 36 6  36 o 5  18.4364 5.57504 0.957687    8.39098  2.89194     9.86442  3.64525    245.678     1.15221     65.6781     
1 1 1 36 6  37 o 10 69.6199 3.68695 98.3917     12.1204  83.935      13.2081  52.8665    67.537      6.09322     67.537      
1 1 1 36 6  38 o 13 20.4091 5.87174 10.7278     9.98243  -3.70464    10.1945  6.98748    308.314     6.99585     128.314     
1 1 1 36 6  39 o 11 27.6794 6.73216 13.0217     11.9588  18.8137     10.9914  16.3792    179.278     0.148255    179.278     
1 1 1 36 6  40 o 18 46.9526 5.92963 46.7271     12.0223  44.8183     14.663   45.4582    259.811     30.3933     259.811     
1 1 1 36 6  41 o 9  30.9567 6.83112 28.1243     11.2714  11.6431     14.6571  17.6145    13.0957     3.62746     193.096     
1 1 1 36 6  42 o 1  29.3482 6.9631  11.2616     11.2407  26.8422     13.5904  16.7925    270.281     8.25569     270.281     
1 1 1 36 6  43 o 11 27.9471 7.18729 22.5528     12.5402  7.67        15.5657  15.3968    145.674     4.43411     145.674     
1 1 1 36 6  44 o 3  45.0179 6.58746 44.1733     13.3978  43.847      15.3186  32.9954    8.74767     5.65245     8.74767     
1 1 1 36 6  45 o 16 24.5337 7.13704 4.50684     14.5356  13.6894     14.1678  11.9034    59.6087     1.29921     239.609     
1 1 1 36 6  46 o 6  33.849  7.12005 33.6679     12.8611  17.5465     14.6509  13.7563    144.25      17.4439     324.25      
1 1 1 36 6  47 o 16 26.214  7.0431  18.5102     12.4395  7.1602      14.2369  15.4865    238.189     6.49061     238.189     
1 1 1 36 6  48 o 8  27.249  7.07995 22.5903     12.7381  6.04229     14.663   8.42798    274.715     18.0623     94.7151     
1 1 1 36 6  49 o 1  29.3322 7.45249 25.1147     13.0173  11.6969     17.0507  16.8504    209.595     2.29225     29.5947     
1 1 1 36 6  50 o 19 35.4834 8.14353 30.1985     15.5344  34.1632     17.5995  20.9786    51.1307     3.81918     231.131     
1 1 1 36 6  51 o 5  31.3591 8.24067 27.6741     16.04    22.8842     19.139   21.4123    36.9527     10.4892     36.9527     
1 1 1 36 6  52 o 17 26.8511 7.71755 18.9146     16.5712  14.2168     16.009   7.77691    92.4501     17.3902     272.45      
1 1 1 36 6  53 f 0  36.9982 8.26774 40.6506     17.1937  35.1734     17.2353  19.5061    285.342     0           0           
1 1 1 36 6  54 o 2  19.5993 6.42578 5.94481     15.2057  -15.3137    16.0541  2.62681    161.702     2.29482     341.702     
1 1 1 36 6  55 o 5  21.8066 7.0368  -4.01454    18.3553  8.76168     16.5304  4.99185    289.947     3.24367     109.947     
1 1 1 36 6  56 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 7  0  o 18 45.6983 4.46106 39.7665     9.66239  39.7665     9.66239  44.3915    3.42395e-05 19.7896     3.42395e-05 
1 1 1 36 7  1  o 19 29.0199 5.57386 13.6859     8.3407   19.2151     8.42818  11.6378    130.146     14.0615     310.146     
1 1 1 36 7  2  o 17 39.5891 4.77348 35.6557     9.14282  24.4341     8.96788  18.5348    53.233      18.81       233.233     
1 1 1 36 7  3  o 5  125.911 2.70377 280.067     17.3976  291.103     16.6551  107.99     15.8699     26.678      15.8699     
1 1 1 36 7  4  o 3  119.776 2.77368 241.526     17.2128  276.36      15.8543  83.0462    90.5496     14.1545     270.55      
1 1 1 36 7  5  o 13 53.1464 3.89912 51.8579     10.5768  52.5114     9.86867  35.7272    49.5163     5.54353     229.516     
1 1 1 36 7  6  o 14 43.3077 4.69719 40.3356     9.61968  30.9306     9.9265   39.5947    304.349     25.227      304.349     
1 1 1 36 7  7  o 7  30.1311 5.95568 12.9796     8.98913  22.9418     10.0195  7.76103    223.57      25.0679     43.5696     
1 1 1 36 7  8  o 3  34.5089 5.78779 24.3964     9.10989  22.4421     10.6394  12.3699    175.885     22.9606     355.885     
1 1 1 36 7  9  o 7  71.3504 3.41211 88.9174     11.0428  96.9812     13.189   49.5167    328.074     6.4756      148.074     
1 1 1 36 7  10 o 8  34.1949 5.73878 20.7014     8.74136  25.4794     10.6487  14.7906    236.919     17.1422     56.9194     
1 1 1 36 7  11 o 11 47.4765 4.71837 41.145      9.41241  44.0574     12.2712  38.6377    209.402     10.8973     209.402     
1 1 1 36 7  12 o 6  93.6411 3.34271 174.098     13.8404  145.684     16.8671  58.8469    197.982     22.1626     17.9819     
1 1 1 36 7  13 o 3  67.358  3.55462 78.4551     10.8615  87.8907     12.9563  47.646     257.223     3.7694      77.2231     
1 1 1 36 7  14 o 7  21.565  5.89007 6.10061     7.99224  7.09044     10.061   0.799515   313.545     24.0713     133.545     
1 1 1 36 7  15 o 11 105.35  2.87539 203.078     14.5696  198.314     15.6958  103.656    250.651     50.9197     250.651     
1 1 1 36 7  16 o 2  23.0619 5.85474 4.25573     8.43372  13.3135     9.30046  5.31375    110.465     16.3285     290.465     
1 1 1 36 7  17 o 9  23.7519 5.86895 6.42577     8.21896  13.5272     9.25241  6.85048    116.534     14.1875     296.534     
1 1 1 36 7  18 o 11 42.7782 4.72449 35.0764     9.26319  34.6044     10.2896  25.868     280.39      8.66251     100.39      
1 1 1 36 7  19 o 11 19.1304 5.48685 8.06318     7.95096  -7.13799    10.3974  3.56468    115.247     8.82563     295.247     
1 1 1 36 7  20 o 7  42.1256 5.17465 37.9521     10.2239  30.8235     10.7215  31.0857    317.064     3.78627     317.064     
1 1 1 36 7  21 o 15 34.8694 5.61091 26.4532     9.02217  21.6559     10.1924  22.5674    36.7478     1.63041     216.748     
1 1 1 36 7  22 o 7  21.8203 5.89616 7.83449     8.27544  6.34541     9.77336  3.5979     315.831     0.400385    315.831     
1 1 1 36 7  23 o 14 23.4526 5.98218 10.6567     8.41341  8.29062     9.72695  3.92745    167.088     22.2366     347.088     
1 1 1 36 7  24 o 15 33.3949 5.81933 27.5582     9.49264  17.3018     10.1951  20.3283    225.779     4.37583     45.7792     
1 1 1 36 7  25 o 7  28.0635 6.08361 12.1652     9.02417  19.3873     9.91477  16.3745    10.2398     2.70519     190.24      
1 1 1 36 7  26 o 10 23.0299 6.1674  8.2366      9.0508   9.13879     10.494   8.19221    208.724     11.6827     28.7243     
1 1 1 36 7  27 o 12 39.6213 5.5389  34.1796     10.5451  28.5022     10.6564  37.2948    279.306     25.7949     279.306     
1 1 1 36 7  28 o 15 58.2143 4.08945 59.2063     11.609   68.6622     11.8974  49.2273    309.397     14.779      309.397     
1 1 1 36 7  29 o 1  21.7819 6.2196  9.91008     10.7931  1.3009      10.6413  8.76666    263.38      6.83826     83.3801     
1 1 1 36 7  30 o 6  55.2521 4.36582 58.4669     11.6612  58.1603     12.0953  53.9657    174.057     30.0923     174.057     
1 1 1 36 7  31 o 9  28.4852 6.32471 14.1685     9.84552  19.4856     10.383   18.6586    341.308     2.04501     341.308     
1 1 1 36 7  32 o 14 54.0185 4.41373 59.2478     11.4873  53.018      11.8917  44.423     64.2038     12.0105     64.2038     
1 1 1 36 7  33 o 1  59.5602 4.22517 74.108      12.3378  61.7601     12.4257  40.547     55.7947     4.58426     235.795     
1 1 1 36 7  34 o 18 65.8203 3.841   78.6585     11.6374  85.138      13.4584  58.6919    180.55      23.1973     180.55      
1 1 1 36 7  35 o 3  25.6518 6.18339 20.4634     10.3387  4.20618     10.4026  13.3437    249.451     4.3727      69.4505     
1 1 1 36 7  36 o 19 18.9084 5.87021 -1.1168     10.1528  2.28438     11.2348  4.91463    225.213     2.26724     45.2126     
1 1 1 36 7  37 o 16 80.1798 3.85256 120.535     14.7058  123.029     16.0466  69.1698    259.167     23.2364     259.167     
1 1 1 36 7  38 o 18 62.9514 4.42205 73.395      13.1269  80.4819     14.4115  53.468     62.4641     17.9924     62.4641     
1 1 1 36 7  39 o 5  29.9607 7.10524 12.444      12.1718  27.412      13.7313  18.6252    117.073     1.61126     117.073     
1 1 1 36 7  40 o 15 60.5597 4.85608 67.1478     14.234   78.4578     14.6661  59.696     333.586     36.2103     333.586     
1 1 1 36 7  41 o 15 28.9566 6.89375 24.8989     12.0506  10.6469     13.0202  16.6512    20.0333     7.59032     20.0333     
1 1 1 36 7  42 o 6  42.1632 6.54558 47.2686     13.5828  30.8863     13.498   38.4874    305.441     26.5924     305.441     
1 1 1 36 7  43 o 8  20.2015 6.16816 -5.82426    11.6345  8.53734     12.04    6.56592    262.037     1.97337     82.0375     
1 1 1 36 7  44 o 17 54.5576 5.55647 71.6858     14.3836  50.9209     14.6059  36.2062    175.477     3.76204     355.477     
1 1 1 36 7  45 o 19 30.9983 7.38182 26.6039     13.5089  17.0473     14.2572  13.7027    273.337     13.2593     93.3367     
1 1 1 36 7  46 o 1  25.8892 7.25186 7.93836     13.0023  18.315      15.1485  14.9461    352.51      5.87958     352.51      
1 1 1 36 7  47 o 16 34.5561 7.9928  34.9578     16.3076  24.5706     15.9536  20.1129    42.5735     4.76082     222.574     
1 1 1 36 7  48 o 12 21.0887 6.67422 -9.4101     14.9912  8.73853     15.0056  5.61215    186.869     1.23294     186.869     
1 1 1 36 7  49 o 7  22.6572 7.02614 2.15534     15.3046  8.92068     15.4262  10.115     324.873     1.93266     144.873     
1 1 1 36 7  50 o 9  23.6999 7.25105 9.54877     16.0365  8.33648     15.6049  9.33048    290.03      7.3004      110.03      
1 1 1 36 7  51 o 19 29.4078 7.80086 32.3246     16.1763  11.0393     17.2859  13.7458    155.131     8.00733     335.131     
1 1 1 36 7  52 o 14 28.2827 8.18914 13.7592     16.8103  30.4953     20.2903  14.5446    321.562     3.31179     321.562     
1 1 1 36 7  53 o 18 23.9442 7.48727 16.1359     16.3277  -0.459886   21.2094  2.34288    50.4528     0.271768    50.4528     
1 1 1 36 7  54 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 7  55 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 8  0  o 17 21.6701 7.01446 12.6712     8.30393  12.6712     8.30393  3.61636    180         0.502746    360         
1 1 1 36 8  1  o 17 67.9105 3.31827 77.8957     11.0694  90.6901     11.344   59.6322    95.633      19.4014     95.633      
1 1 1 36 8  2  o 6  48.9115 4.07951 44.3237     9.99307  44.7984     9.61328  34.9313    265.427     0.516414    85.4272     
1 1 1 36 8  3  o 19 70.3534 3.19888 83.8464     11.2003  96.6463     11.1881  66.9958    216.395     30.7956     216.395     
1 1 1 36 8  4  o 17 77.2401 3.03162 110.832     11.6538  105.786     11.7168  53.7076    277.96      7.8015      97.9604     
1 1 1 36 8  5  o 2  69.6315 3.21881 94.5167     11.2039  82.3851     11.1002  75.4632    116.158     50.6041     116.158     
1 1 1 36 8  6  o 4  36.7043 5.02711 21.5732     8.90368  30.7666     8.87382  16.4338    12.1848     18.7188     192.185     
1 1 1 36 8  7  o 18 43.5527 4.53799 31.817      9.73412  40.1622     9.29448  15.142     81.6101     32.9262     261.61      
1 1 1 36 8  8  o 8  18.71   5.45465 4.03942     8.50256  1.61796     8.06943  2.33856    163.874     4.34833     343.874     
1 1 1 36 8  9  o 14 66.2545 3.39294 79.6499     11.3862  80.9997     10.9833  43.5934    177.331     10.9158     357.331     
1 1 1 36 8  10 o 2  40.79   5.09953 35.3302     10.8229  29.0281     9.28413  23.1499    117.622     11.4743     297.622     
1 1 1 36 8  11 o 7  45.466  4.42549 44.8828     10.1671  33.5052     9.38526  35.6661    42.858      7.18465     42.858      
1 1 1 36 8  12 o 10 35.6651 5.69019 28.5749     9.37649  21.7709     10.5508  28.8691    67.1164     14.8779     67.1164     
1 1 1 36 8  13 o 6  89.1915 3.22666 153.9       12.9798  136.298     15.4398  66.3173    110.494     0.53226     290.494     
1 1 1 36 8  14 o 4  33.1136 5.98651 22.2283     8.81538  21.5647     11.2113  24.4105    51.1374     13.8486     51.1374     
1 1 1 36 8  15 o 2  91.1303 3.25044 154.15      13.8478  148.911     15.6444  84.9731    50.7027     34.5418     50.7027     
1 1 1 36 8  16 o 16 59.4665 4.24977 67.7605     11.2758  64.6356     13.492   48.2858    197.22      9.8643      197.22      
1 1 1 36 8  17 o 6  30.9731 6.16414 19.6589     8.77425  18.8145     11.3116  18.6655    247.063     3.23399     67.0633     
1 1 1 36 8  18 f 0  59.7671 4.10212 61.0674     11.293   72.7241     12.991   38.284     56.5652     0           0           
1 1 1 36 8  19 o 18 29.3888 6.38228 19.5325     9.49988  14.7796     11.488   17.4416    267.011     3.00259     87.0114     
1 1 1 36 8  20 o 3  22.1188 5.9167  4.07545     8.32236  11.3904     9.8769   5.47925    297.915     16.6724     117.915     
1 1 1 36 8  21 o 13 41.4574 5.00285 30.3959     9.45418  36.6726     10.6009  31.617     339.572     4.98555     339.572     
1 1 1 36 8  22 o 2  23.4267 5.95208 6.28881     8.44395  13.2925     9.59117  7.99753    271.54      3.19031     271.54      
1 1 1 36 8  23 o 15 26.5639 6.10758 15.0796     8.76525  12.7092     10.0033  15.0733    302.3       2.98663     122.3       
1 1 1 36 8  24 o 5  20.2156 5.76379 6.18199     8.33821  3.3869      9.79311  7.76243    33.126      2.80745     213.126     
1 1 1 36 8  25 o 19 66.6528 3.93279 93.9967     11.8892  73.278      13.6106  51.4753    236.949     5.3704      236.949     
1 1 1 36 8  26 o 1  31.7159 6.26056 18.816      9.54251  23.3455     11.1311  24.8329    2.94697     10.4964     2.94697     
1 1 1 36 8  27 o 16 30.7254 5.96074 25.1857     9.29681  13.5448     10.4279  23.1409    242.818     14.4254     242.818     
1 1 1 36 8  28 o 17 25.1029 6.28776 10.1807     9.68994  14.2738     10.1838  14.9484    5.03089     4.96716     5.03089     
1 1 1 36 8  29 o 16 50.8403 4.80529 44.163      11.7542  57.3085     11.9295  37.2434    100.177     1.63925     100.177     
1 1 1 36 8  30 o 16 22.3061 6.05987 11.6487     8.93435  2.84708     11.0984  10.4745    32.5591     3.38561     212.559     
1 1 1 36 8  31 o 16 37.7637 5.89902 30.1228     10.5612  29.4011     11.1709  25.968     250.278     0.100244    250.279     
1 1 1 36 8  32 f 0  20.0545 6.04501 7.88153     11.6127  -2.51362    10.1216  19.7962    241.222     0           0           
1 1 1 36 8  33 o 18 43.3053 6.59147 37.1409     14.6358  43.8393     13.1327  29.9997    12.5676     0.228614    192.567     
1 1 1 36 8  34 o 2  23.2754 6.65506 8.8616      12.4702  8.11459     11.5712  7.65052    246.023     12.9496     66.0226     
1 1 1 36 8  35 o 19 19.2099 6.00235 7.13589     12.3252  -10.673     11.3899  4.90947    122.195     8.76477     302.195     
1 1 1 36 8  36 o 2  26.6579 7.26491 22.2878     15.7327  6.45796     12.1157  11.2786    338.268     10.3677     158.268     
1 1 1 36 8  37 o 18 59.7721 5.29963 65.226      15.9923  79.4464     14.5937  50.377     18.7371     16.5718     18.7371     
1 1 1 36 8  38 o 12 63.7007 4.93806 87.762      16.35    74.2586     14.6744  63.6392    218.733     38.8142     218.733     
1 1 1 36 8  39 o 3  20.1519 6.20854 6.89078     11.7038  -5.27477    12.6619  6.00494    253.422     4.76495     73.4225     
1 1 1 36 8  40 o 1  59.8235 5.59088 90.4115     14.758   57.4399     16.3743  46.9785    144.094     9.72959     144.094     
1 1 1 36 8  41 o 13 18.7225 6.0215  0.632005    11.6873  -7.8555     13.4796  5.28197    199.094     6.21843     19.0944     
1 1 1 36 8  42 o 18 19.7133 6.29035 0.994298    12.3163  -4.4819     14.2738  7.03472    9.63476     5.34548     189.635     
1 1 1 36 8  43 o 10 31.1176 7.84898 25.2165     15.1677  20.3172     15.9273  21.7175    267.635     13.3682     267.635     
1 1 1 36 8  44 o 8  29.9322 7.74123 6.22668     17.1955  31.8234     16.1405  21.1016    59.1745     7.98291     59.1745     
1 1 1 36 8  45 o 6  34.1194 8.0441  24.7106     16.1546  34.032      16.4107  25.6927    95.6503     9.26252     95.6503     
1 1 1 36 8  46 o 15 41.5077 7.82188 54.3542     17.1889  32.0788     16.9962  32.32      248.535     9.87227     248.535     
1 1 1 36 8  47 o 12 34.3292 8.27242 32.9067     16.7369  30.3193     17.4393  17.5616    23.5489     9.71229     203.549     
1 1 1 36 8  48 o 4  34.6001 8.15553 41.8218     17.0567  23.2312     17.6807  20.113     108.74      3.99713     288.74      
1 1 1 36 8  49 o 2  28.3948 7.74362 8.04914     16.3989  31.8988     16.8682  15.4842    187.505     1.08383     7.50508     
1 1 1 36 8  50 o 7  27.5574 7.89264 22.2701     16.909   17.8756     17.0746  11.3907    163.453     4.40125     163.453     
1 1 1 36 8  51 o 2  19.9595 6.55965 -8.50904    15.779   4.72364     16.1684  1.28818    352.961     0.934154    172.96      
1 1 1 36 8  52 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 8  53 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 9  0  o 12 12.4734 5.68773 0.494068    8.2411   0.494068    8.2411   0.320103   0.00108424  1.6388      0.00108424  
1 1 1 36 9  1  o 10 24.5301 5.88521 7.82391     9.36647  13.8481     8.33716  10.4573    240.548     8.55119     60.5482     
1 1 1 36 9  2  o 12 99.1222 3.11728 192.201     14.1636  165.903     16.391   89.6566    124.863     30.2968     124.863     
1 1 1 36 9  3  f 0  61.9918 3.53359 69.4317     10.8333  72.0482     10.9348  39.4366    331.481     0           0           
1 1 1 36 9  4  o 1  87.2867 2.95442 132.978     12.9433  143.921     12.8059  75.6432    33.0279     20.4578     33.0279     
1 1 1 36 9  5  o 7  25.8852 6.0059  12.3795     8.56538  13.3506     9.42959  13.8663    171.185     3.83493     171.185     
1 1 1 36 9  6  o 8  23.1694 5.75432 7.18865     8.25845  11.828      8.45943  8.98789    124.736     9.23439     304.736     
1 1 1 36 9  7  o 8  46.0039 4.29509 43.1729     9.62976  36.7924     9.62676  33.8102    320.348     1.29615     320.348     
1 1 1 36 9  8  o 16 61.4807 3.52391 61.1775     10.6011  78.6173     10.8046  56.5677    200.615     23.0106     200.615     
1 1 1 36 9  9  o 4  28.0263 5.68427 20.1067     8.57759  10.8197     8.73909  0.763752   292.402     37.81       112.402     
1 1 1 36 9  10 o 7  29.3039 5.53629 7.23895     9.52746  25.9211     8.76711  20.8725    43.782      8.5174      43.782      
1 1 1 36 9  11 o 4  23.4979 5.91636 11.6117     9.0157   8.07654     8.60159  11.288     272.384     1.54981     272.384     
1 1 1 36 9  12 o 16 60.0878 3.73458 72.4493     11.4755  61.7525     10.7758  42.943     350.171     2.99284     170.171     
1 1 1 36 9  13 o 5  55.8854 4.04637 58.6949     11.007   58.3356     11.3334  43.4178    276.019     4.80569     276.019     
1 1 1 36 9  14 o 3  25.9252 5.92394 5.19494     8.93644  20.1234     9.83596  16.0193    310.267     2.13863     310.267     
1 1 1 36 9  15 o 17 76.6954 3.31311 101.27      12.8674  115.122     12.3948  69.8483    269.523     25.7893     269.523     
1 1 1 36 9  16 o 2  40.2506 5.43343 26.3889     10.4737  38.3237     10.5762  37.8578    53.6318     21.9434     53.6318     
1 1 1 36 9  17 o 2  84.6313 3.27536 129.915     13.4723  133.346     14.2022  84.7273    97.3962     43.8805     97.3962     
1 1 1 36 9  18 o 11 92.8917 3.58301 171.772     15.5399  148.046     17.393   78.3049    282.553     17.9391     282.553     
1 1 1 36 9  19 o 15 19.7868 5.86174 2.88688     8.32588  3.92192     11.159   1.15354    231.026     27.8315     231.026     
1 1 1 36 9  20 o 18 39.5333 5.69158 35.3106     9.55913  27.9058     12.0779  32.1884    154.771     9.55501     154.771     
1 1 1 36 9  21 o 7  26.404  6.27707 16.0002     8.81731  10.9361     11.4098  17.2546    201.3       4.65578     201.3       
1 1 1 36 9  22 f 0  24.3163 6.15325 2.84312     9.02112  18.542      11.0727  33.2471    154.6       0           0           
1 1 1 36 9  23 o 5  55.1475 4.43612 56.6581     10.6502  60.2882     13.3068  48.5236    84.0078     17.2403     84.0078     
1 1 1 36 9  24 o 6  56.8084 4.33815 61.6838     10.8658  62.0924     13.2681  51.8842    177.437     21.6639     177.437     
1 1 1 36 9  25 o 7  29.4448 6.46254 16.0985     9.54684  20.8229     11.5257  20.5719    15.1376     4.09356     15.1376     
1 1 1 36 9  26 o 5  34.3485 6.20976 21.8111     9.75985  28.5158     11.7319  26.7548    140.84      8.0649      140.84      
1 1 1 36 9  27 o 18 32.8957 6.22859 18.1121     10.4371  28.2826     10.8266  12.4232    164.665     21.0539     344.665     
1 1 1 36 9  28 o 18 20.1017 5.98712 1.22243     10.3474  6.04649     10.3619  7.60894    68.1939     2.80431     248.194     
1 1 1 36 9  29 o 5  19.5396 5.94731 5.66629     10.1755  -2.87915    11.4706  5.34572    266.13      10.8022     86.13       
1 1 1 36 9  30 o 8  17.4808 5.66793 -2.20777    10.4923  -6.93539    12.1623  1.88668    149.398     1.14045     329.398     
1 1 1 36 9  31 o 8  21.4771 6.24061 12.5948     11.5704  -4.1831     11.4267  6.80435    4.43256     11.2834     184.433     
1 1 1 36 9  32 o 2  18.0712 5.76497 -8.76572    11.1065  2.6259      11.4701  3.19573    87.4848     11.3643     267.485     
1 1 1 36 9  33 o 17 25.1069 6.84979 6.11524     12.2223  17.1533     12.7815  12.7373    355.262     2.85238     355.262     
1 1 1 36 9  34 o 11 29.5678 7.02072 12.9105     12.0739  25.9966     13.1415  13.8788    83.4206     10.4477     263.421     
1 1 1 36 9  35 o 14 33.8189 7.12002 29.4003     12.573   22.9214     13.6922  23.368     256.312     4.0784      256.312     
1 1 1 36 9  36 o 19 38.4364 7.17643 33.5314     14.2803  34.203      13.779   22.6697    238.604     6.87108     58.6036     
1 1 1 36 9  37 o 4  35.6327 7.5352  33.0962     14.5333  26.7598     14.6182  24.2696    117.72      1.89296     117.72      
1 1 1 36 9  38 f 0  38.678  7.49097 42.7769     15.0183  27.4086     15.6583  22.9643    353.755     0           0           
1 1 1 36 9  39 o 15 24.648  7.15243 8.57429     13.7983  11.7418     14.487   6.70191    146.88      18.1622     326.88      
1 1 1 36 9  40 o 11 20.6816 6.71879 -5.92745    17.9786  -1.01682    14.0284  8.20136    220.576     5.57554     40.576      
1 1 1 36 9  41 o 1  26.8004 7.51815 -3.26041    18.7766  23.9759     15.2648  9.48678    310.279     5.79279     310.279     
1 1 1 36 9  42 o 16 61.0651 7.27456 83.7405     23.8665  86.4112     18.2779  54.3054    80.9228     23.2449     80.9228     
1 1 1 36 9  43 o 2  25.1291 7.48946 11.6164     16.5943  10.809      15.6114  9.17334    184.864     13.1475     4.86389     
1 1 1 36 9  44 o 2  45.1264 7.84833 51.5814     17.432   49.5606     17.8293  38.3329    8.58672     16.4497     8.58672     
1 1 1 36 9  45 o 1  23.5452 7.20415 3.44488     15.6445  12.9091     15.8961  10.3575    177.037     5.4115      357.037     
1 1 1 36 9  46 o 15 24.4193 7.399   15.1596     16.1461  6.85533     16.5155  10.7308    232.447     2.30117     232.447     
1 1 1 36 9  47 o 19 33.3797 8.42488 33.1847     17.5998  32.2417     18.0121  23.1952    278.078     10.9476     278.078     
1 1 1 36 9  48 o 1  20.5277 6.7116  1.20614     15.8535  -0.872842   16.6741  0.675926   271.068     0.192683    91.0679     
1 1 1 36 9  49 o 6  17.1947 5.8821  -20.2854    15.7627  -6.6601     15.4659  1.03358    155.775     8.30762     335.775     
1 1 1 36 9  50 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 9  51 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 10 0  o 9  59.2138 4.0287  65.335      11.6844  65.335      11.6844  78.9929    180         70.0251     180         
1 1 1 36 10 1  o 4  40.0389 4.96543 32.5799     9.82083  29.9908     9.3813   24.7022    7.2462      8.48179     187.246     
1 1 1 36 10 2  o 7  29.9906 5.72105 23.4095     9.09613  12.972      8.95296  18.6038    83.2879     3.22583     263.288     
1 1 1 36 10 3  o 12 54.0428 4.06668 60.1926     11.0073  49.917      10.6278  37.1244    118.216     5.87425     298.216     
1 1 1 36 10 4  o 15 45.4918 4.41458 40.1163     9.80504  38.8789     9.79093  25.326     264.212     16.2878     84.2121     
1 1 1 36 10 5  o 11 75.0285 3.2812  104.807     12.0606  102.191     12.4811  58.1213    306.832     3.57539     306.832     
1 1 1 36 10 6  o 11 85.7471 3.02654 136.534     12.8991  132.257     13.0244  72.3853    268.157     15.7065     268.157     
1 1 1 36 10 7  o 8  28.0342 5.90594 13.1132     8.95888  18.5943     9.04864  19.2436    171.031     3.61296     171.031     
1 1 1 36 10 8  o 2  72.636  3.40013 101.427     12.0662  93.3887     12.504   54.3496    42.6201     0.213651    222.619     
1 1 1 36 10 9  o 4  20.9286 5.69849 3.27253     8.62239  9.37519     8.57474  8.86451    214.666     0.352591    34.6662     
1 1 1 36 10 10 o 8  56.6466 3.82083 63.1345     10.6858  57.0813     10.7161  46.9947    180.631     10.4144     180.631     
1 1 1 36 10 11 o 13 37.2911 5.27368 24.1464     9.52896  31.3961     9.4788   28.4117    34.81       4.56868     34.81       
1 1 1 36 10 12 f 0  51.9873 4.05422 54.526      10.3007  47.7662     10.4146  43.5467    241.516     0           0           
1 1 1 36 10 13 o 3  26.3994 6.06418 15.7152     9.14614  12.1697     9.32862  4.67317    316.015     46.8542     316.015     
1 1 1 36 10 14 o 12 106.401 2.95553 207.037     15.232   207.298     16.2088  91.9913    83.3774     23.7868     83.3774     
1 1 1 36 10 15 o 16 16.9928 5.21478 -2.39601    8.25322  2.48175     8.3733   2.51766    282.093     1.44738     102.093     
1 1 1 36 10 16 o 5  46.1462 4.69397 49.3648     10.5681  34.1032     10.2439  49.5361    160.645     39.4237     160.645     
1 1 1 36 10 17 o 15 36.565  5.82292 26.0651     10.8527  29.0281     9.98858  29.6663    187.98      9.12262     187.98      
1 1 1 36 10 18 o 13 82.0497 3.42345 123.691     14.2441  126.505     13.7714  68.9292    135.967     15.3866     135.967     
1 1 1 36 10 19 o 5  22.474  5.99537 2.02468     9.12127  14.225      10.1521  4.44812    225.236     20.7216     45.2359     
1 1 1 36 10 20 o 18 25.7918 6.31713 11.8049     9.55919  15.0023     10.3705  16.5862    345.929     3.82809     345.929     
1 1 1 36 10 21 o 1  16.6426 5.30617 -2.52575    9.01333  -2.36304    9.68901  2.72797    335.449     11.0521     155.449     
1 1 1 36 10 22 o 10 19.6207 5.71655 -0.178013   8.50752  8.33548     9.94075  0.354329   324.885     24.3511     144.885     
1 1 1 36 10 23 o 8  17.4971 5.44421 -4.24652    8.47501  3.6572      10.1315  4.43202    175.099     6.62272     355.099     
1 1 1 36 10 24 o 5  36.816  6.45427 30.198      11.2954  28.4932     12.4393  23.0946    30.5561     5.20214     210.556     
1 1 1 36 10 25 o 4  37.7057 7.39332 31.4624     12.45    33.6364     16.6679  30.6123    164.672     10.826      164.672     
1 1 1 36 10 26 o 2  19.686  6.21054 0.95704     10.6932  -1.68406    14.2822  5.49438    8.50793     10.7044     188.508     
1 1 1 36 10 27 o 5  42.0326 7.32494 50.8966     15.2812  30.1901     16.2443  18.7233    338.046     22.5256     158.046     
1 1 1 36 10 28 o 4  19.7076 6.30238 -1.4493     12.1345  -1.84512    14.46    5.60759    308.3       9.03846     128.3       
1 1 1 36 10 29 o 15 28.8533 7.34765 18.2817     11.9947  18.408      15.3583  12.238     80.9049     13.4766     260.905     
1 1 1 36 10 30 o 4  40.4842 7.04424 42.9986     13.265   31.2175     15.6278  28.3955    283.029     1.17471     283.029     
1 1 1 36 10 31 o 2  29.7145 7.51072 4.07246     11.6702  37.7759     18.4028  8.26213    223.01      23.3737     43.0096     
1 1 1 36 10 32 o 12 25.6998 6.88146 15.9356     11.8515  10.3264     12.8075  4.41739    4.35459     2.08955     4.35459     
1 1 1 36 10 33 o 5  38.9002 6.87315 35.347      12.889   32.8427     13.8769  24.0937    291.737     5.23084     111.737     
1 1 1 36 10 34 o 14 33.6242 7.07209 33.0665     12.7993  18.45       14.0037  24.5013    42.1719     6.01519     42.1719     
1 1 1 36 10 35 o 16 30.3926 6.5165  35.3664     12.895   1.57386     13.2644  22.578     102.75      9.34387     102.75      
1 1 1 36 10 36 o 17 22.9421 6.94772 10.3852     14.5813  0.937085    14.2412  11.0035    270.701     3.60721     90.7006     
1 1 1 36 10 37 f 0  17.3898 5.83788 -10.3821    13.8556  -10.835     13.6437  20.616     289.212     0           0           
1 1 1 36 10 38 o 10 19.4199 6.30158 1.61471     14.303   -9.6513     13.8751  1.15806    156.653     26.915      156.653     
1 1 1 36 10 39 o 18 33.1271 7.9556  20.4851     15.8909  34.0753     16.3313  24.3142    336.91      6.52035     336.91      
1 1 1 36 10 40 o 10 39.6777 8.5734  39.4234     20.423   44.098      17.3725  35.4727    170.252     22.1856     170.252     
1 1 1 36 10 41 o 18 27.4896 7.98381 26.1386     19.4564  7.87039     16.1988  17.5386    266.021     7.01261     266.021     
1 1 1 36 10 42 o 7  28.3159 8.43382 22.1785     22.3999  17.3599     18.397   15.2164    239.329     4.3311      59.3293     
1 1 1 36 10 43 o 18 25.7171 7.8048  11.3577     20.0407  15.4592     16.5152  11.0014    359.067     8.89034     179.067     
1 1 1 36 10 44 o 9  31.1223 8.81938 45.1602     24.5602  16.6855     17.2365  20.0834    255.872     8.49961     255.872     
1 1 1 36 10 45 o 14 33.949  9.21242 48.8244     26.1623  30.491      17.9026  22.8207    36.9586     6.03655     36.9586     
1 1 1 36 10 46 o 11 22.9253 7.19547 -11.6593    17.7722  20.629      17.6783  6.35627    164.976     0.206152    344.976     
1 1 1 36 10 47 o 14 29.2546 8.31639 17.005      19.1406  34.2721     19.227   15.6878    355.269     1.05353     355.269     
1 1 1 36 10 48 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 10 49 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 11 0  o 18 35.0022 6.54426 27.0674     9.91764  27.0674     9.91764  26.9057    360         0.350891    360         
1 1 1 36 11 1  o 13 46.6246 4.5153  41.9337     10.4328  42.1034     10.1089  37.8344    163.614     7.57174     163.614     
1 1 1 36 11 2  o 13 50.0414 4.20555 48.1267     10.2867  47.5134     10.3925  32.0886    102.68      10.1005     282.68      
1 1 1 36 11 3  o 8  37.4714 5.26815 31.5819     9.51847  24.9137     9.5556   31.5928    286.187     10.9063     286.187     
1 1 1 36 11 4  o 2  33.5502 5.62387 18.4151     9.43617  27.9124     9.37577  20.9622    158.722     5.36657     338.722     
1 1 1 36 11 5  o 15 25.3714 5.98782 15.1439     8.93384  10.3353     9.13391  12.8732    68.4961     7.48736     248.496     
1 1 1 36 11 6  o 2  39.278  5.06162 31.4102     9.59151  29.9439     9.59861  23.8517    350.076     9.3117      170.076     
1 1 1 36 11 7  o 9  44.9403 4.65089 40.5959     10.1837  38.1256     10.1371  31.3073    187.27      3.24067     7.26979     
1 1 1 36 11 8  o 12 22.8017 5.91216 8.85769     8.74012  10.0245     8.94536  10.4411    85.9721     7.56737     265.972     
1 1 1 36 11 9  o 17 20.9886 5.76247 4.79909     8.62962  8.75644     8.84102  9.63554    298.35      0.77206     298.35      
1 1 1 36 11 10 o 7  23.7842 5.93583 12.2334     8.88744  9.44273     8.797    12.995     144.112     5.17616     144.112     
1 1 1 36 11 11 o 18 52.409  4.13577 55.3137     10.5532  49.7549     10.7524  34.993     71.5767     7.74769     251.577     
1 1 1 36 11 12 o 12 52.3532 4.32001 57.8279     10.472   47.8509     11.4843  43.9448    354.256     10.9734     354.256     
1 1 1 36 11 13 o 1  76.5626 3.56308 106.216     13.5367  113.191     13.6449  67.6806    307.036     20.7274     307.036     
1 1 1 36 11 14 o 13 66.8849 3.65833 91.8029     11.8916  76.6868     12.3007  64.2987    258.786     29.4587     258.786     
1 1 1 36 11 15 o 16 22.039  5.72542 1.00754     8.97006  14.2722     8.95735  4.33492    158.342     20.4154     338.342     
1 1 1 36 11 16 o 13 30.4972 5.73237 30.7526     10.0633  8.20423     9.65625  14.4813    288.154     13.5866     108.153     
1 1 1 36 11 17 o 10 43.1639 5.02356 35.5344     10.0612  39.1105     10.9218  33.852     334.023     5.77093     334.023     
1 1 1 36 11 18 o 17 72.7007 3.54588 101.708     13.377   96.9082     12.2976  58.6308    307.239     8.90773     307.239     
1 1 1 36 11 19 o 11 18.5768 5.60005 3.06406     9.3602   1.77894     8.99748  5.66557    6.13396     7.39659     186.134     
1 1 1 36 11 20 o 6  41.0472 6.12369 34.9428     13.1307  36.6072     11.2444  25.5855    163.045     7.65963     343.045     
1 1 1 36 11 21 o 2  36.518  6.46481 23.5991     12.8972  34.6109     11.1996  30.282     349.801     11.5716     349.801     
1 1 1 36 11 22 o 16 22.8623 6.53484 0.579955    12.5706  13.2572     11.6918  9.94119    147.482     7.09441     327.482     
1 1 1 36 11 23 o 5  23.7984 6.72218 6.27614     12.0773  12.7335     12.356   12.1882    17.0049     1.76199     197.005     
1 1 1 36 11 24 o 7  24.2246 6.782   8.43209     12.3451  12.3863     12.2008  12.7288    264.545     1.03896     264.545     
1 1 1 36 11 25 o 18 18.4952 5.98431 -1.90738    11.9433  -5.43459    13.0499  4.5864     240.003     5.13803     60.0035     
1 1 1 36 11 26 o 8  25.645  6.45438 23.3086     11.6835  -2.26579    12.8031  14.6209    154.532     2.91496     154.532     
1 1 1 36 11 27 o 17 40.6281 6.92041 35.4259     14.3788  39.0449     13.5117  22.4791    81.4338     12.2676     261.434     
1 1 1 36 11 28 o 10 22.2347 6.57375 9.47249     12.0151  3.06804     12.8091  7.53624    205.743     9.86444     25.7433     
1 1 1 36 11 29 o 13 36.4871 7.19086 30.1796     13.2517  31.5587     14.0266  18.7036    108.607     13.095      288.607     
1 1 1 36 11 30 o 19 27.7077 7.1277  11.4924     12.2299  22.1096     13.7354  14.1353    118.316     6.94838     298.316     
1 1 1 36 11 31 o 3  21.577  6.51856 10.8531     11.8714  -8.7257     15.5046  7.91206    193.397     8.7495      13.397      
1 1 1 36 11 32 o 8  23.5759 7.17931 -9.8564     14.1011  19.3299     17.9576  10.9797    73.5012     5.62698     253.501     
1 1 1 36 11 33 o 9  36.4988 8.33704 23.7904     15.8019  44.2895     19.4454  24.1307    93.1725     1.29672     273.173     
1 1 1 36 11 34 o 12 33.3922 8.73838 21.9715     16.5076  36.7508     22.2178  26.2352    106.729     11.6917     106.729     
1 1 1 36 11 35 o 19 27.9496 8.74671 11.3449     17.0849  18.4261     31.7787  16.8893    80.6252     0.0510858   260.626     
1 1 1 36 11 36 o 6  28.3758 8.33325 0.267314    16.5183  35.692      23.3833  18.3595    205.549     2.73105     205.549     
1 1 1 36 11 37 o 5  32.1952 8.46498 -6.10354    16.7889  59.2992     24.8812  20.9176    172.788     0.0797208   172.788     
1 1 1 36 11 38 o 6  24.0562 7.68402 -5.70237    16.7313  17.7158     22.364   12.6687    267.329     3.3043      267.329     
1 1 1 36 11 39 o 1  31.4619 8.46988 24.0693     18.1685  30.4615     18.8964  20.4752    245.745     12.9032     245.745     
1 1 1 36 11 40 o 17 19.7276 6.54284 1.01319     16.4675  -12.1073    16.5403  6.46043    117.546     3.21082     297.546     
1 1 1 36 11 41 o 4  18.896  6.37628 -11.787     17.7194  -6.12636    16.1016  2.65871    181.19      1.01255     1.19045     
1 1 1 36 11 42 o 10 40.2115 8.81202 54.2174     20.0341  43.2377     19.3805  30.9287    106.333     10.1771     106.333     
1 1 1 36 11 43 o 15 23.9431 7.56939 12.0848     19.6748  9.14908     17.4898  9.51238    127.967     0.65072     307.967     
1 1 1 36 11 44 o 15 19.424  6.65023 -22.9431    23.7197  -4.44262    17.4395  3.3608     35.8199     4.47042     215.82      
1 1 1 36 11 45 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 11 46 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 12 0  o 19 12.7941 5.81629 1.19485     8.53357  1.19485     8.53357  3.21142    180         20.916      180         
1 1 1 36 12 1  f 0  17.1783 5.26273 4.73792     8.58234  -5.86212    8.87478  14.3223    93.9014     0           0           
1 1 1 36 12 2  o 16 25.6812 6.04635 16.3114     9.07788  10.4875     9.45217  13.579     154.499     6.57961     334.499     
1 1 1 36 12 3  o 3  49.114  4.63556 53.4084     10.5403  41.4761     11.3425  39.9653    54.9389     7.67718     54.9389     
1 1 1 36 12 4  o 8  20.6116 5.74931 4.50698     8.91783  8.16038     8.71739  8.47726    359.328     45.6561     359.328     
1 1 1 36 12 5  o 13 56.1079 4.04823 65.8145     11.108   54.964      11.2277  53.1281    347.557     23.4922     347.557     
1 1 1 36 12 6  f 0  40.1881 5.18382 32.8339     10.0909  32.5409     10.0204  9.79776    332.011     0           0           
1 1 1 36 12 7  o 15 23.5799 5.89002 15.6196     9.01917  4.76443     9.32168  8.98011    315.669     13.0169     135.669     
1 1 1 36 12 8  o 18 32.1822 5.84186 19.8424     9.55526  23.984      9.44508  22.4718    142.26      0.709611    142.26      
1 1 1 36 12 9  o 9  33.7924 5.73379 20.3886     9.71441  27.7237     9.58166  25.8068    78.8991     5.19022     78.8991     
1 1 1 36 12 10 o 13 23.2433 5.7361  16.7538     8.93998  2.15609     9.08969  13.2765    313.644     1.02578     313.644     
1 1 1 36 12 11 f 0  18.0522 5.46414 -0.298137   8.72706  3.93236     8.98324  6.98093    152.425     0           0           
1 1 1 36 12 12 o 9  18.3944 5.67206 3.04183     9.50333  -1.5738     10.3666  5.49971    167.279     7.62518     347.279     
1 1 1 36 12 13 o 2  30.4633 6.05581 15.0177     10.0616  24.7574     9.70613  20.6574    212.613     0.444076    212.613     
1 1 1 36 12 14 o 11 33.0925 5.81727 38.8287     11.3129  8.93033     10.1349  25.296     356.921     5.86758     356.921     
1 1 1 36 12 15 o 19 43.1389 5.72389 37.5235     11.8873  40.0993     11.9493  43.1845    127.394     28.0167     127.394     
1 1 1 36 12 16 o 6  23.8466 6.37109 3.4209      11.4889  15.8868     10.5771  0.342027   88.2194     31.997      268.219     
1 1 1 36 12 17 o 13 83.553  4.02828 136.019     15.8254  131.559     17.5983  72.8751    146.896     20.6213     146.896     
1 1 1 36 12 18 o 12 26.2841 6.63892 8.07201     11.6372  19.8419     11.4003  15.8842    134.134     0.51901     134.134     
1 1 1 36 12 19 o 9  20.8398 6.19343 5.52838     11.3822  4.48596     10.5357  3.71543    286.15      18.4008     106.15      
1 1 1 36 12 20 o 16 31.9048 6.91205 19.0777     12.8773  26.9406     11.8053  22.6801    340.423     4.12139     340.423     
1 1 1 36 12 21 o 6  19.7839 6.04959 -1.03339    11.915   5.2824      10.4548  1.40492    323.999     27.92       323.999     
1 1 1 36 12 22 o 3  20.4724 6.19693 2.82705     12.1566  4.74104     10.5649  3.43135    25.5237     0.0659588   205.524     
1 1 1 36 12 23 o 7  27.1941 6.89704 19.378      12.585   12.8984     11.4121  16.5231    132.52      3.92161     132.52      
1 1 1 36 12 24 o 12 28.3295 7.14    21.1199     13.8376  15.0899     11.7329  9.16261    81.5798     19.8047     261.58      
1 1 1 36 12 25 o 11 31.7486 7.48241 33.2974     14.548   12.5964     15.6397  23.4011    283.273     12.231      283.273     
1 1 1 36 12 26 o 17 34.0395 7.59303 35.437      15.0533  20.0229     14.8278  20.6458    342.525     4.93102     162.525     
1 1 1 36 12 27 o 13 39.5827 7.92395 43.5741     17.8684  33.2027     15.0216  22.9293    273.223     9.83839     93.2231     
1 1 1 36 12 28 o 4  33.9629 8.5188  28.6594     20.6835  29.8096     16.2041  20.1924    354.148     5.65385     174.148     
1 1 1 36 12 29 o 4  49.9354 8.3193  70.8705     21.164   52.0181     20.0136  35.0349    278.621     1.53231     98.6214     
1 1 1 36 12 30 o 9  26.1452 7.69067 8.06247     17.7048  16.0092     16.0779  16.8388    80.8814     5.36984     80.8814     
1 1 1 36 12 31 o 12 23.8942 7.17035 18.9511     16.4391  -8.05948    15.5004  13.4201    355.959     0.440672    175.959     
1 1 1 36 12 32 o 8  24.7689 7.27914 -10.1156    17.3332  21.8397     16.0728  9.92811    223.929     12.1117     43.9291     
1 1 1 36 12 33 o 2  33.1896 8.01551 8.21983     18.2736  45.1083     18.268   19.5638    322.141     5.82805     142.141     
1 1 1 36 12 34 o 16 36.783  8.60482 36.3108     18.404   37.6236     18.5081  29.9163    302.386     11.9178     302.386     
1 1 1 36 12 35 o 6  21.3477 6.97116 8.60238     18.6683  -13.319     16.5902  9.78826    282.52      0.255878    102.52      
1 1 1 36 12 36 o 2  23.2287 7.34021 7.02243     17.333   5.33096     17.6205  11.7957    324.187     0.0422101   144.186     
1 1 1 36 12 37 o 15 23.7493 7.43823 2.743       17.7173  13.3939     17.7     9.12258    70.1463     3.02598     70.1463     
1 1 1 36 12 38 o 4  21.3174 7.14166 -0.999219   17.3283  -7.09961    23.8284  3.69637    114.158     18.0467     294.158     
1 1 1 36 12 39 o 12 29.5883 8.75133 27.1322     19.1491  27.6645     25.1134  11.0871    60.8292     16.0175     240.829     
1 1 1 36 12 40 o 4  27.1441 8.26274 26.0421     18.6859  11.3991     24.5667  13.3008    254.395     3.89392     254.395     
1 1 1 36 12 41 o 16 22.0824 7.36423 5.40011     18.2298  -5.91316    25.5263  6.16608    56.3817     1.7482      236.382     
1 1 1 36 12 42 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 12 43 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 12 44 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 13 0  o 7  65.2406 3.82303 79.5416     12.2949  79.5416     12.2949  58.1361    1.8155e-05  16.1017     1.8155e-05  
1 1 1 36 13 1  o 6  19.3437 5.74269 5.05802     9.40451  2.40707     9.46953  1.84147    214.015     20.7538     34.0152     
1 1 1 36 13 2  o 10 21.2877 5.95808 2.75684     9.52886  10.8931     9.77763  9.78308    255.572     2.87011     75.5723     
1 1 1 36 13 3  f 0  21.0327 6.00171 5.11083     9.83413  7.88036     9.74122  17.9903    237.253     0           0           
1 1 1 36 13 4  o 12 36.3291 6.16958 30.6747     11.2736  26.4899     10.9317  30.1648    9.77104     10.468      9.77104     
1 1 1 36 13 5  o 17 79.6588 3.6214  120.6       14.529   119.425     14.2307  72.288     185.141     24.3428     185.141     
1 1 1 36 13 6  o 4  27.9594 6.42749 13.426      10.527   20.3799     10.4297  5.74606    92.2085     3.86278     92.2085     
1 1 1 36 13 7  o 12 43.2972 5.47363 41.2286     11.5653  36.3439     11.3055  38.6148    209.224     15.6183     209.224     
1 1 1 36 13 8  o 2  35.1044 6.22715 24.7889     11.2908  28.9033     10.6541  24.1981    273.495     0.706927    93.4954     
1 1 1 36 13 9  o 3  14.7935 4.90175 -6.41681    9.24426  -6.70663    9.0193   1.20053    24.046      17.1947     24.046      
1 1 1 36 13 10 o 19 37.4901 6.25458 22.9897     11.5944  38.8701     11.9111  28.1073    158.9       3.66341     158.9       
1 1 1 36 13 11 o 2  32.4074 7.01369 16.6632     11.4242  32.178      13.9581  23.2707    327.012     3.5712      327.012     
1 1 1 36 13 12 o 2  55.873  5.36766 64.8092     14.6889  63.1055     14.5923  45.5305    83.5524     8.61598     83.5524     
1 1 1 36 13 13 o 2  53.6869 5.294   58.5408     14.2565  59.3065     13.4232  37.4326    8.19696     4.53138     188.197     
1 1 1 36 13 14 o 14 33.8477 7.2583  33.4894     14.7363  20.7163     12.2481  19.3624    182.545     8.18166     2.54512     
1 1 1 36 13 15 o 17 32.8087 7.03618 24.8895     13.292   24.8394     11.9013  25.4423    310.634     9.78922     310.634     
1 1 1 36 13 16 f 0  23.2433 6.7382  8.36243     12.2375  9.16034     12.8185  11.2771    306.048     0           0           
1 1 1 36 13 17 o 13 33.44   6.9778  28.3135     13.0597  23.4193     11.9573  26.608     306.55      13.7622     306.55      
1 1 1 36 13 18 o 15 22.3642 6.50753 6.16256     12.2259  8.87257     11.3566  8.67313    105.699     0.680134    105.699     
1 1 1 36 13 19 o 10 27.1562 6.86059 21.9506     12.667   10.1024     11.5061  14.76      338.676     4.93436     158.676     
1 1 1 36 13 20 o 8  31.3248 6.99239 28.4974     13.122   16.9814     11.8109  15.2428    225.404     12.6044     45.4043     
1 1 1 36 13 21 o 16 22.8688 6.50316 15.2956     12.3914  0.606037    11.3769  6.85205    278.772     2.48183     278.772     
1 1 1 36 13 22 o 2  43.4807 6.43683 49.5764     14.1716  34.1291     13.0574  38.1377    151.763     15.2629     151.763     
1 1 1 36 13 23 o 12 30.3742 7.30215 16.6054     15.6012  25.0465     12.1859  23.2224    195.376     11.1945     195.376     
1 1 1 36 13 24 o 4  28.812  7.63799 14.6692     17.1474  21.8334     13.633   18.2309    304.77      0.80298     124.77      
1 1 1 36 13 25 f 0  22.5796 6.87452 -7.85432    17.2381  12.0334     13.319   18.5938    39.0556     0           0           
1 1 1 36 13 26 o 2  62.897  6.80276 81.6728     23.0336  92.9103     16.7791  50.3299    244.763     8.1904      244.763     
1 1 1 36 13 27 o 16 21.0892 6.71631 -6.40602    18.6601  4.50452     12.3653  7.92793    189.927     2.13046     189.927     
1 1 1 36 13 28 o 14 32.6223 8.31442 39.1267     18.3983  14.1317     18.8987  20.4608    168.628     3.19149     348.628     
1 1 1 36 13 29 o 6  36.7171 8.48433 23.4282     21.3069  47.7061     18.0919  28.6218    150.531     7.83373     150.531     
1 1 1 36 13 30 o 7  26.1934 7.90433 17.6869     20.3605  10.163      16.1446  15.0552    61.0572     7.29677     61.0572     
1 1 1 36 13 31 o 15 31.4068 8.67464 29.1709     22.7094  25.8403     17.186   23.8678    148.261     10.5288     148.261     
1 1 1 36 13 32 o 13 24.1151 7.58121 -12.297     20.2836  19.8794     19.1453  6.06451    354.742     19.3923     174.742     
1 1 1 36 13 33 o 15 24.1312 7.56563 1.64332     20.8332  13.6338     16.7726  11.4812    255.095     3.67338     255.095     
1 1 1 36 13 34 o 9  21.3573 6.91828 -5.35465    16.9344  7.62226     16.8959  8.11232    62.7753     0.34473     242.775     
1 1 1 36 13 35 o 6  18.7891 6.30705 -18.2669    16.5805  1.10778     16.1514  4.65275    93.8159     8.19025     273.816     
1 1 1 36 13 36 o 15 27.1907 7.9604  31.669      19.1472  7.14293     17.7092  6.92932    141.187     3.58749     141.187     
1 1 1 36 13 37 o 12 24.6788 7.69597 8.62956     19.8832  17.4953     17.8707  6.43251    235.839     17.528      55.8385     
1 1 1 36 13 38 o 5  27.9599 8.33471 29.9703     20.8276  18.3716     19.1962  14.6538    19.7296     3.62527     19.7296     
1 1 1 36 13 39 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 13 40 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 13 41 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 14 0  o 13 12.5892 5.92051 -1.19364    10.0139  -1.19364    10.0139  14.3702    180         46.0275     180         
1 1 1 36 14 1  o 10 35.4339 6.73884 23.6564     13.3143  33.3824     11.7038  23.9859    0.0213705   1.41341     180.021     
1 1 1 36 14 2  o 19 19.2712 5.81781 -0.986669   10.2499  6.37683     9.9817   3.26417    106.915     15.957      286.915     
1 1 1 36 14 3  o 8  26.6878 6.84461 14.8949     10.7339  16.0849     12.9162  10.5896    85.5174     14.4643     265.517     
1 1 1 36 14 4  o 5  29.5514 6.57636 13.4991     11.3334  25.4302     11.2133  19.1158    293.834     0.148677    113.834     
1 1 1 36 14 5  o 5  58.9537 5.23327 66.3741     14.0544  75.981      16.1978  51.9477    343.294     16.5172     343.294     
1 1 1 36 14 6  o 1  17.6846 5.55777 -16.9044    11.2217  6.7937      10.6056  0.764795   250.841     18.4156     70.8413     
1 1 1 36 14 7  f 0  68.6904 5.02738 98.3502     16.6152  92.4204     17.4196  38.0474    133.938     0           0           
1 1 1 36 14 8  o 5  18.929  5.95313 -5.51085    12.3026  4.02305     10.9774  4.98165    343.872     8.50642     163.872     
1 1 1 36 14 9  o 17 58.063  5.22106 72.5024     15.7174  65.5411     13.9816  58.3495    16.1297     31.8652     16.1297     
1 1 1 36 14 10 o 10 56.0262 6.04907 61.2342     16.8381  72.844      15.7396  54.2308    8.72486     26.8021     8.72486     
1 1 1 36 14 11 o 12 22.3433 6.51801 7.72341     12.9853  7.53809     10.6883  10.0325    219.673     4.66131     39.6727     
1 1 1 36 14 12 o 1  37.3703 6.7843  44.4133     14.0772  20.6192     12.4714  31.2718    246.771     11.6483     246.771     
1 1 1 36 14 13 o 15 29.3416 7.22267 13.4179     15.2428  24.6211     12.3075  20.9021    266.739     10.1091     266.739     
1 1 1 36 14 14 o 17 21.0949 6.34551 3.82429     12.4056  5.9923      11.1552  3.69528    358.561     19.6862     178.561     
1 1 1 36 14 15 o 10 65.5855 4.6758  90.9044     15.7317  80.4473     14.591   64.6229    160.562     31.9379     160.562     
1 1 1 36 14 16 o 4  22.4039 6.62479 2.69775     12.4123  10.895      12.7839  11.3314    278.604     1.95719     98.6042     
1 1 1 36 14 17 o 10 17.2166 5.61454 -9.65691    12.2325  -0.997624   10.7105  2.13371    160.903     15.5869     340.903     
1 1 1 36 14 18 o 7  32.1788 7.43025 37.4461     16.243   12.9927     12.4986  25.2999    352.881     16.7786     352.881     
1 1 1 36 14 19 o 11 18.0274 5.98895 -2.27364    15.7829  -9.64432    10.8773  4.98656    299.656     0.787823    119.656     
1 1 1 36 14 20 o 9  27.1003 7.77833 11.793      17.5242  18.1493     15.8656  14.6989    8.48714     6.44373     188.487     
1 1 1 36 14 21 o 10 24.3302 7.1352  0.866309    17.3939  14.9941     13.0647  14.4113    30.9865     5.62973     30.9865     
1 1 1 36 14 22 o 3  24.8739 7.2995  19.9295     17.4384  3.59342     12.4568  15.3486    183.165     1.30309     183.165     
1 1 1 36 14 23 f 0  39.1022 8.09517 28.3425     18.9463  50.0264     16.9406  33.1382    68.5887     0           0           
1 1 1 36 14 24 o 8  19.076  6.33956 -1.66239    18.1363  -7.50297    11.7281  7.54265    347.411     2.36433     167.411     
1 1 1 36 14 25 o 17 24.1544 7.22983 26.5205     18.5182  -11.4035    13.8098  14.4567    141.495     1.87122     141.495     
1 1 1 36 14 26 o 1  32.319  8.08881 24.1915     20.9665  29.9058     13.9741  21.6323    67.0486     0.29924     247.049     
1 1 1 36 14 27 o 19 21.0165 6.73293 -2.53196    17.9492  4.17538     13.1897  9.76886    258.789     3.31447     78.7892     
1 1 1 36 14 28 o 6  24.6607 7.79332 13.7875     26.799   8.20661     13.1192  10.9141    137.552     9.30969     317.552     
1 1 1 36 14 29 o 8  22.3857 6.97297 1.72673     18.4844  9.31616     12.9984  10.9139    3.00038     0.0731422   3.00044     
1 1 1 36 14 30 o 10 25.1666 7.72458 13.2834     19.2988  13.787      16.9463  9.75256    255.976     4.35043     255.976     
1 1 1 36 14 31 o 17 38.0016 8.88712 38.9055     21.4549  51.5745     19.2495  31.4291    37.1328     14.4787     37.1328     
1 1 1 36 14 32 o 1  19.4158 6.53307 -1.24311    18.5536  -9.65317    15.9979  5.35406    177.142     4.20287     357.142     
1 1 1 36 14 33 o 16 23.3958 7.49884 1.31119     22.2479  13.6023     17.2042  6.85896    78.7051     1.30033     78.7051     
1 1 1 36 14 34 o 7  21.9693 7.18523 -4.69789    21.8365  9.60925     16.9325  7.64395    250.429     4.31812     70.4294     
1 1 1 36 14 35 o 13 21.8933 7.25064 -2.30181    23.0136  6.48584     17.7546  2.90055    207.028     0.213202    27.0281     
1 1 1 36 14 36 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 14 37 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 15 0  o 4  68.5652 5.49492 92.7921     18.2562  92.7921     18.2562  83.577     1.70959e-05 61.4145     1.70959e-05 
1 1 1 36 15 1  o 18 25.0639 6.73142 16.455      11.508   8.38408     12.3997  12.2251    314.915     8.51617     134.915     
1 1 1 36 15 2  o 3  86.747  4.40629 159.123     19.7161  136.846     18.3352  102.148    251.097     73.7975     251.097     
1 1 1 36 15 3  o 18 37.218  7.60508 34.9718     15.1494  32.1791     14.8236  24.2291    200.404     4.85242     20.4044     
1 1 1 36 15 4  f 0  114.349 4.42109 248.151     27.6566  264.57      22.0992  69.0416    156.874     0           0           
1 1 1 36 15 5  f 0  33.4151 7.28451 19.3479     14.7966  33.1806     13.2817  19.1376    155.625     0           0           
1 1 1 36 15 6  o 13 41.5632 7.33544 38.5237     16.8114  42.7242     13.8851  27.6747    23.8646     5.27443     203.865     
1 1 1 36 15 7  o 9  48.0498 6.82429 60.0431     17.5283  44.502      14.261   46.3379    333.178     23.3496     333.178     
1 1 1 36 15 8  o 2  29.3202 7.41752 13.3382     14.5269  25.9344     14.0309  11.9867    141.845     17.3077     321.845     
1 1 1 36 15 9  o 19 34.809  8.15139 36.6269     16.6776  24.7754     17.1216  16.8105    288.273     16.4172     108.273     
1 1 1 36 15 10 o 1  50.9082 6.5436  62.6906     16.9175  52.0674     15.2604  47.8798    236.673     21.212      236.673     
1 1 1 36 15 11 o 11 19.9481 6.28491 -2.24049    13.4943  3.34802     12.1593  9.12446    33.2412     3.3636      213.241     
1 1 1 36 15 12 o 4  38.0205 8.27556 22.2584     25.9188  48.2896     15.8955  28.8588    178.77      3.95331     178.77      
1 1 1 36 15 13 o 1  34.1795 8.46348 34.8653     19.3391  26.9498     16.4391  26.5571    107.731     6.72924     107.731     
1 1 1 36 15 14 o 13 50.4524 7.98999 65.2408     22.8149  59.6367     16.5891  46.5684    88.9348     19.9079     88.9348     
1 1 1 36 15 15 o 5  63.4217 7.59889 114.04      25.5473  77.9337     21.0901  58.2403    1.12781     22.2145     1.12781     
1 1 1 36 15 16 o 15 33.3281 8.46968 27.1333     21.115   31.591      16.0779  20.6881    119.729     5.06645     299.729     
1 1 1 36 15 17 o 4  32.921  8.58309 39.4529     21.3622  20.7926     16.0483  24.8675    295.07      17.0629     295.07      
1 1 1 36 15 18 o 1  36.5632 8.62468 48.0678     21.0414  27.0444     16.2507  31.9156    242.002     15.5192     242.002     
1 1 1 36 15 19 o 17 28.7595 8.17613 30.008      20.7214  12.6471     15.2859  21.0935    157.444     8.10821     157.444     
1 1 1 36 15 20 o 19 28.1088 7.92529 11.0063     20.6428  24.1789     15.326   19.5097    170.025     10.3434     170.025     
1 1 1 36 15 21 o 1  21.9384 7.04559 12.5964     19.2827  -5.81749    13.887   9.48966    326.405     2.98808     326.405     
1 1 1 36 15 22 o 19 28.6535 8.16679 22.9542     21.2389  20.1337     15.2842  20.5646    101.883     6.84736     101.883     
1 1 1 36 15 23 o 14 26.1044 7.93315 26.9661     21.8138  5.33177     15.2549  9.58615    178.838     15.7807     358.838     
1 1 1 36 15 24 o 1  23.2387 7.4236  2.00415     24.4906  8.76069     14.0605  12.1319    12.4575     0.78681     12.4575     
1 1 1 36 15 25 o 14 29.6665 8.33976 40.37       21.8393  12.8855     15.4861  17.8443    275.432     2.79756     95.4322     
1 1 1 36 15 26 o 16 21.9664 7.01595 2.96326     19.9514  6.84735     13.5906  9.63346    272.737     3.40866     92.7365     
1 1 1 36 15 27 o 16 26.2292 7.81252 24.4908     21.2897  13.4164     13.6554  12.705     230.362     7.1862      50.3619     
1 1 1 36 15 28 o 7  24.5521 7.47709 10.1549     21.3692  15.6132     13.7669  10.635     353.975     8.05175     173.975     
1 1 1 36 15 29 o 14 18.3935 6.1816  -13.1073    19.471   -1.33234    12.5163  3.15979    120.006     2.89448     300.006     
1 1 1 36 15 30 o 11 24.7716 7.30258 -1.64221    21.4136  22.4816     13.9862  11.9498    77.2774     1.38334     257.277     
1 1 1 36 15 31 o 14 21.2731 7.26903 6.18898     32.4261  -1.2311     13.0052  5.26173    294.892     1.92822     114.892     
1 1 1 36 15 32 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 15 33 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 15 34 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 16 0  o 16 56.9808 10.9694 84.3108     27.0737  84.3108     27.0737  61.5995    180         35.1244     180         
1 1 1 36 16 1  o 19 50.1925 9.18727 57.5646     26.9034  83.4393     22.1192  42.4851    173.144     11.3759     173.144     
1 1 1 36 16 2  o 3  42.3615 9.15071 46.8352     21.3101  54.9112     21.3019  35.359     10.9809     10.2445     10.9809     
1 1 1 36 16 3  f 0  27.8301 8.33887 10.2825     20.8793  23.2998     20.0967  15.3915    139.989     0           0           
1 1 1 36 16 4  o 12 47.0197 7.71444 71.9316     19.6014  39.1199     16.6855  36.4454    340.95      3.53656     340.95      
1 1 1 36 16 5  o 6  25.4272 7.46608 10.3908     17.5108  14.6585     14.2559  11.5877    93.4409     11.1802     273.441     
1 1 1 36 16 6  o 1  35.7286 8.57588 27.6725     26.903   40.402      15.5722  17.7653    300.325     16.1572     120.325     
1 1 1 36 16 7  o 2  40.8607 8.47805 48.2932     20.9142  41.8229     16.2475  31.7114    344.149     4.70188     344.149     
1 1 1 36 16 8  o 19 20.8781 6.86885 8.06913     19.177   -14.4422    15.4495  10.1512    65.5394     0.543745    65.5393     
1 1 1 36 16 9  f 0  25.7466 7.55582 13.5423     19.3709  13.9282     13.2347  22.9744    129.708     0           0           
1 1 1 36 16 10 o 16 25.2262 7.47842 3.51894     20.5427  16.9607     13.8453  15.4053    135.497     7.11526     135.497     
1 1 1 36 16 11 o 8  30.544  9.13143 45.1682     31.9055  15.8121     15.7338  17.5414    138.666     6.66313     318.666     
1 1 1 36 16 12 o 17 27.1494 7.89522 30.4027     20.48    6.17866     14.1578  19.1249    31.438      6.30862     31.438      
1 1 1 36 16 13 o 14 23.4149 7.30689 2.61285     19.9611  10.4818     14.606   7.66409    170.409     3.84791     170.409     
1 1 1 36 16 14 o 11 38.6504 8.74254 41.4276     22.6312  45.1586     17.064   35.5957    302.884     19.7106     302.884     
1 1 1 36 16 15 o 15 23.0829 7.42195 5.92719     20.0096  4.46973     17.514   9.35536    296.878     3.90313     296.878     
1 1 1 36 16 16 o 5  26.9019 7.94474 18.3002     20.6794  17.2692     15.4511  10.7935    297.61      15.0707     117.61      
1 1 1 36 16 17 o 19 20.2217 6.69682 4.7739      19.6677  -6.58509    13.2585  8.36291    218.539     4.65129     38.5389     
1 1 1 36 16 18 o 17 31.6961 8.62688 39.8645     21.9692  22.8953     16.6084  24.4182    106.27      10.7752     106.27      
1 1 1 36 16 19 o 12 24.1427 7.48159 8.35051     20.8191  13.0389     14.7821  13.0004    257.837     2.85113     257.837     
1 1 1 36 16 20 o 5  24.3459 7.44178 1.90686     20.6075  18.1903     15.224   11.3753    319.017     3.96381     319.017     
1 1 1 36 16 21 o 1  23.2566 7.36004 13.9032     20.8852  6.53679     14.1487  11.3889    356.542     0.865884    176.542     
1 1 1 36 16 22 o 16 44.8349 9.14314 70.1805     25.1689  57.7285     18.6058  39.2229    285.794     16.5914     285.794     
1 1 1 36 16 23 o 1  28.4158 7.96123 45.4586     20.7994  2.99361     15.0912  17.7393    27.7584     6.88282     27.7584     
1 1 1 36 16 24 o 16 23.3199 7.44539 17.2802     21.4457  5.42129     15.079   10.1175    152.783     4.56989     332.783     
1 1 1 36 16 25 o 15 21.2227 6.95661 -1.49822    21.2598  6.26316     15.012   7.21101    70.731      5.05248     250.731     
1 1 1 36 16 26 o 17 22.8524 7.31282 18.4291     20.6379  2.96558     14.7006  4.97277    84.0031     0.592301    84.0032     
1 1 1 36 16 27 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 16 28 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 16 29 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 16 30 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 17 0  o 9  17.6434 8.65826 -5.26224    26.731   -5.26224    26.731   5.17052    180         12.7745     3.63522e-05 
1 1 1 36 17 1  o 4  28.2372 9.09751 33.3942     28.5859  8.76813     29.2857  17.1657    42.6906     2.07387     222.691     
1 1 1 36 17 2  o 13 28.3243 8.87346 35.1563     29.8817  14.3691     19.5339  18.8182    201.552     2.41282     201.552     
1 1 1 36 17 3  o 16 45.3499 10.0147 65.8931     32.733   77.6712     23.1237  36.3177    331.085     7.30223     331.085     
1 1 1 36 17 4  o 12 28.7663 8.83714 8.969       38.459   28.712      18.9971  19.8949    32.0467     8.81314     32.0467     
1 1 1 36 17 5  o 6  26.4658 8.77191 36.2026     37.071   4.02665     19.0793  16.02      191.506     5.63109     191.506     
1 1 1 36 17 6  o 3  37.5348 10.164  39.5531     39.3055  68.681      25.8473  15.9144    113.87      22.4659     293.87      
1 1 1 36 17 7  o 15 25.9251 8.87526 -157.108    117.221  15.3139     22.0517  15.0404    148.652     4.075       148.652     
1 1 1 36 17 8  o 3  25.8152 8.38425 -14.117     36.1073  22.8095     21.4959  11.1676    258.386     5.37386     258.386     
1 1 1 36 17 9  o 15 25.41   8.46649 41.0731     35.9059  0.205387    15.1966  12.8497    292.449     4.81377     292.449     
1 1 1 36 17 10 o 2  25.2556 8.28233 28.7545     34.006   6.58744     15.1617  9.70373    294.503     4.36647     294.503     
1 1 1 36 17 11 o 6  29.0124 9.15198 23.22       37.7379  31.3943     22.2982  13.9659    288.656     10.9888     108.656     
1 1 1 36 17 12 o 15 22.3444 7.29253 1.24364     19.8133  7.89436     18.5268  7.09506    242.223     1.8066      242.223     
1 1 1 36 17 13 o 18 21.6202 7.03619 1.61304     20.9309  5.55855     14.7704  9.21624    280.053     1.12981     100.053     
1 1 1 36 17 14 o 17 20.9401 6.98907 -12.5214    21.0253  6.40525     18.4478  7.65492    225.391     1.20033     45.3907     
1 1 1 36 17 15 o 11 20.6902 6.84081 4.33042     20.5133  -0.756933   14.3105  7.60287    160.746     2.94367     340.746     
1 1 1 36 17 16 o 8  34.3444 8.92453 40.7616     24.1207  41.5618     17.9065  26.8952    108.435     11.6909     108.435     
1 1 1 36 17 17 o 16 20.9902 6.85184 -8.54374    21.4131  8.56318     14.6176  6.84445    44.0499     1.28088     224.05      
1 1 1 36 17 18 o 9  18.2767 6.21884 -3.48982    19.478   -8.39096    13.0287  1.57137    73.0335     1.08608     253.034     
1 1 1 36 17 19 o 8  22.8749 7.3055  18.9109     20.7106  3.59748     14.303   9.50795    52.033      1.95871     232.033     
1 1 1 36 17 20 o 8  17.5148 5.95476 -25.9026    19.8927  -1.26881    13.0852  0.0774446  19.5764     0.101679    199.576     
1 1 1 36 17 21 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 17 22 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 17 23 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 17 24 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 17 25 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 18 0  o 1  28.7797 12.9249 55.3573     40.5982  55.3573     40.5982  21.4534    1.8138e-05  5.20172     1.8138e-05  
1 1 1 36 18 1  o 9  25.339  12.3773 13.655      36.6191  0           0        9.01838    178.375     5.08061     358.375     
1 1 1 36 18 2  o 15 31.1145 14.592  59.9242     40.6104  0           0        5.41279    299.675     1.90543     299.675     
1 1 1 36 18 3  f 0  23.0045 8.24853 -39.608     33.4208  16.8491     52.457   16.6919    207.226     0           0           
1 1 1 36 18 4  o 18 29.1866 10.0154 33.0664     39.3906  75.8375     51.3728  11.1679    161.062     5.60405     161.062     
1 1 1 36 18 5  o 9  26      9.08051 14.2283     37.1864  27.4069     49.467   13.3856    352.045     1.0017      352.045     
1 1 1 36 18 6  o 1  27.027  9.33574 43.2426     38.1523  6.04052     50.7725  14.5418    281.491     2.4727      281.491     
1 1 1 36 18 7  o 18 24.8311 8.74982 0.129825    37.4754  17.4084     49.1915  11.7945    295.152     2.33995     115.152     
1 1 1 36 18 8  o 15 22.46   8.04554 -34.1203    35.3774  -8.88004    51.4769  2.75568    129.057     0.330375    129.057     
1 1 1 36 18 9  o 11 27.8189 13.3703 37.0514     38.4919  0           0        7.13467    170.726     0.639471    170.726     
1 1 1 36 18 10 o 18 23.0398 7.91332 7.74092     38.4244  2.98016     20.4594  7.45982    8.07262     0.359551    8.0726      
1 1 1 36 18 11 o 8  26.2324 8.64484 25.0861     36.4364  21.8837     22.21    12.7788    118.007     5.16987     298.007     
1 1 1 36 18 12 o 1  22.8384 7.94327 23.8792     37.6758  -9.44386    21.3254  8.57477    165.543     2.34463     345.543     
1 1 1 36 18 13 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 18 14 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 18 15 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 18 16 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 18 17 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 18 18 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 19 0  x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 19 1  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 19 2  x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 19 3  x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 19 4  x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 19 5  x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 36 19 6  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 0  0  o 18 30.9674 9.03048 24.1774     13.8861  24.1774     13.8861  4.72505    0.000117935 31.4209     0.000117936 
1 1 1 37 0  1  o 3  61.1646 4.24608 68.7811     12.7069  68.7811     12.7069  53.9393    240         16.313      240         
1 1 1 37 0  2  o 18 11.5554 5.43905 -2.39905    8.48252  -2.39905    8.48252  13.9546    120         32.5018     120         
1 1 1 37 0  3  o 3  25.1745 8.06237 16.736      10.9616  16.736      10.9616  1.51748    180         11.4073     360         
1 1 1 37 0  4  o 8  50.8672 4.26267 48.1555     10.4651  48.1555     10.4651  46.6907    240         23.3696     240         
1 1 1 37 0  5  o 11 12.6792 5.88694 -1.3242     9.40743  -1.3242     9.40743  3.35985    300         8.28214     300         
1 1 1 37 0  6  o 10 165.661 3.38641 490.473     28.0607  490.473     28.0607  170.815    180         92.4109     180         
1 1 1 37 0  7  o 17 129.929 3.33904 302.104     21.6762  302.104     21.6762  124.163    240         52.9338     240         
1 1 1 37 0  8  o 11 16.2129 6.83597 5.26519     9.7854   5.26519     9.7854   13.4812    300         40.4261     300         
1 1 1 37 0  9  o 19 11.7393 5.57203 -3.42787    9.23648  -3.42787    9.23648  5.98602    360         14.6685     360         
1 1 1 37 0  10 o 12 71.3979 4.31312 93.2074     15.1632  93.2074     15.1632  50.6045    240         6.01085     60          
1 1 1 37 0  11 o 12 21.1626 7.9009  11.9535     11.1809  11.9535     11.1809  0.514129   300         8.18004     120         
1 1 1 37 0  12 o 18 20.0033 8.10681 9.6445      12.8864  9.6445      12.8864  0.0452671  8.65206e-06 10.1623     8.65198e-06 
1 1 1 37 0  13 o 10 17.0393 7.01555 6.5505      9.88673  6.5505      9.88673  33.1876    60          90.6127     60          
1 1 1 37 0  14 o 19 143.643 3.15851 368.868     22.6868  368.868     22.6868  147.541    120         79.9419     120         
1 1 1 37 0  15 o 7  72.6801 3.53147 95.6329     12.7209  95.6329     12.7209  55.7938    180         2.81839     180         
1 1 1 37 0  16 o 14 92.9783 2.8824  154.873     13.3717  154.873     13.3717  70.1295    60          1.23161     59.9999     
1 1 1 37 0  17 o 2  70.0286 3.25711 88.6148     11.3155  88.6148     11.3155  51.386     300         1.84394     120         
1 1 1 37 0  18 o 6  15.6808 6.44448 5.57244     8.31838  5.57244     8.31838  0.878807   180         4.07127     180         
1 1 1 37 0  19 o 8  8.30598 4.17509 -10.0873    7.4647   -10.0873    7.4647   34.7856    240         77.329      240         
1 1 1 37 0  20 o 1  113.613 3.31015 231.681     18.7738  231.681     18.7738  90.4896    300         11.7729     300         
1 1 1 37 0  21 o 11 19.6184 7.05866 10.3964     8.70032  10.3964     8.70032  0.94452    180         11.9259     8.65191e-06 
1 1 1 37 0  22 o 2  29.8701 6.72341 20.3813     8.8597   20.3813     8.8597   12.7977    240         4.48058     240         
1 1 1 37 0  23 f 0  73.1894 3.34373 96.9319     12.1452  96.9319     12.1452  37.7201    300         0           0           
1 1 1 37 0  24 o 1  80.5741 3.19181 117.072     12.795   117.072     12.795   53.2353    3.30968e-07 12.9484     180         
1 1 1 37 0  25 o 16 28.8193 7.27223 19.9808     9.58046  19.9808     9.58046  1.04491    60          0.415485    60          
1 1 1 37 0  26 o 5  13.8092 6.19443 1.5863      9.2935   1.5863      9.2935   5.67521    300         19.8121     300         
1 1 1 37 0  27 o 7  28.4824 7.28343 19.6641     9.53689  19.6641     9.53689  4.81566    180         31.6242     8.65124e-06 
1 1 1 37 0  28 o 14 33.247  7.01457 24.841      10.1735  24.841      10.1735  22.2921    240         2.1913      60          
1 1 1 37 0  29 o 15 17.8701 7.00065 8.31045     9.19659  8.31045     9.19659  0.56333    300         6.46159     120         
1 1 1 37 0  30 o 1  65.6864 3.6747  78.8676     11.9172  78.8676     11.9172  31.959     180         32.5681     8.64897e-06 
1 1 1 37 0  31 o 2  115.039 3.15677 237.898     18.1367  237.898     18.1367  74.8575    60          18.9796     240         
1 1 1 37 0  32 o 19 146.79  2.89586 385.969     21.2652  385.969     21.2652  129.797    120         44.7146     120         
1 1 1 37 0  33 o 12 14.3032 6.29964 2.82352     9.14592  2.82352     9.14592  13.6383    8.44543e-06 44.3313     8.44543e-06 
1 1 1 37 0  34 o 19 11.519  5.47321 -3.14556    8.95493  -3.14556    8.95493  5.11538    60          15.5184     60          
1 1 1 37 0  35 o 16 80.0628 3.38736 116.228     13.4785  116.228     13.4785  61.8717    120         7.19177     120         
1 1 1 37 0  36 o 4  8.81586 4.43931 -11.7224    8.57884  -11.7224    8.57884  4.84676    8.44864e-06 12.1817     8.44864e-06 
1 1 1 37 0  37 o 7  13.9177 6.21654 2.05265     9.24671  2.05265     9.24671  7.97733    240         31.4024     240         
1 1 1 37 0  38 o 1  14.4051 6.36512 2.85249     9.41512  2.85249     9.41512  7.08582    120         31.1305     120         
1 1 1 37 0  39 o 4  71.0347 3.67287 92.4125     12.9107  92.4125     12.9107  83.7102    180         64.8621     180         
1 1 1 37 0  40 o 3  13.61   6.18635 1.02958     9.64982  1.02958     9.64982  2.68616    60          17.988      60          
1 1 1 37 0  41 o 5  59.8179 4.24232 66.9251     12.4013  66.9251     12.4013  53.0883    300         20.187      300         
1 1 1 37 0  42 o 1  14.6695 6.49592 3.11433     9.8616   3.11433     9.8616   0.750399   360         4.55537     180         
1 1 1 37 0  43 o 12 54.0542 4.93225 56.2417     12.7498  56.2417     12.7498  33.3106    240         10.723      60          
1 1 1 37 0  44 f 0  37.0512 6.98544 30.5231     11.2064  30.5231     11.2064  29.0257    120         0           0           
1 1 1 37 0  45 o 11 90.849  3.42619 150.649     15.4969  150.649     15.4969  83.4073    180         37.4529     180         
1 1 1 37 0  46 o 6  32.2139 7.89839 25.8091     11.5028  25.8091     11.5028  24.9255    240         4.96326     240         
1 1 1 37 0  47 o 19 23.9107 8.04282 16.5753     10.9892  16.5753     10.9892  12.2281    300         6.86473     120         
1 1 1 37 0  48 o 11 14.6039 6.54253 2.80781     10.3291  2.80781     10.3291  3.69822    360         23.5001     360         
1 1 1 37 0  49 o 5  67.5542 4.62376 86.5987     15.2943  86.5987     15.2943  53.3417    60          11.486      60          
1 1 1 37 0  50 o 6  18.9061 7.58095 10.1308     11.1021  10.1308     11.1021  3.658      120         13.1422     300         
1 1 1 37 0  51 o 8  34.3457 8.52116 30.1393     13.2889  30.1393     13.2889  25.0362    180         2.8177      180         
1 1 1 37 0  52 o 7  17.8732 7.69531 7.55129     12.9377  7.55129     12.9377  1.17959    60          18.4661     240         
1 1 1 37 0  53 o 5  64.6037 5.10378 80.6274     15.9956  80.6274     15.9956  58.88      120         27.7413     120         
1 1 1 37 0  54 o 6  24.8714 8.82008 18.9479     13.4784  18.9479     13.4784  12.3853    1.57307e-07 8.62448     180         
1 1 1 37 0  55 o 12 23.1595 8.56186 16.5707     13.0309  16.5707     13.0309  11.9287    60          4.02486     60          
1 1 1 37 0  56 o 10 25.5125 9.02972 20.4407     14.113   20.4407     14.113   2.30569    300         30.5048     120         
1 1 1 37 0  57 o 3  69.6449 4.97256 93.8788     16.9173  93.8788     16.9173  50.8075    1.25847e-06 5.74472     1.25847e-06 
1 1 1 37 0  58 o 12 26.6074 9.57611 23.5492     16.0157  23.5492     16.0157  7.55262    60          4.20042     60          
1 1 1 37 0  59 f 0  21.6192 8.82412 15.4458     15.4295  15.4458     15.4295  17.2843    120         0           0           
1 1 1 37 0  60 o 7  11.2161 5.70927 -22.2331    15.8497  -22.2331    15.8497  3.06668    180         10.0257     180         
1 1 1 37 0  61 o 13 20.5455 8.9917  13.4183     18.3409  13.4183     18.3409  3.73582    240         13.9133     60          
1 1 1 37 0  62 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 0  63 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 1  0  o 9  73.6013 3.45186 97.9133     12.6017  97.9133     12.6017  77.691     360         44.42       360         
1 1 1 37 1  1  o 4  43.1546 5.18797 27.4587     10.9439  43.0917     10.2776  22.6856    136.912     13.6832     316.912     
1 1 1 37 1  2  o 13 24.8694 6.07887 5.61185     8.89504  15.0333     10.0206  4.38876    221.089     39.4527     221.089     
1 1 1 37 1  3  o 14 39.9928 5.10216 33.3019     9.80865  26.9171     9.84426  20.0228    337.537     13.8718     157.537     
1 1 1 37 1  4  o 10 51.5954 4.22119 51.1402     10.7049  46.4748     10.6977  34.6089    100.757     3.10052     280.757     
1 1 1 37 1  5  o 16 21.1081 5.90114 5.3897      9.36734  4.50651     9.11309  5.62657    27.9312     34.515      27.9312     
1 1 1 37 1  6  o 13 108.31  3.36609 224.281     18.9145  198.403     17.5443  88.9881    73.6512     17.54       73.6512     
1 1 1 37 1  7  o 15 131.63  3.31972 300.29      21.7943  323.099     21.9143  123.303    87.1479     51.0626     87.1479     
1 1 1 37 1  8  o 1  36.0296 5.83485 28.6077     10.3728  21.2666     10.3161  0.662824   136.921     51.3682     136.922     
1 1 1 37 1  9  o 15 31.967  6.27749 15.1154     11.2111  23.6923     10.0654  8.95422    114.251     23.1495     294.251     
1 1 1 37 1  10 o 16 42.8827 5.74865 27.1833     12.0633  43.4509     11.5426  24.1709    346.772     9.92503     166.772     
1 1 1 37 1  11 f 0  68.9931 3.93283 85.7529     13.5081  87.4458     13.4555  38.7793    122.915     0           0           
1 1 1 37 1  12 o 6  58.8964 4.46515 64.4306     12.7114  63.1332     13.221   38.8315    260.555     6.49342     80.5548     
1 1 1 37 1  13 o 15 66.8787 3.74454 90.5984     12.3545  72.4238     12.3993  62.4567    33.7934     30.5146     33.7934     
1 1 1 37 1  14 o 6  116.044 3.03302 248.849     17.6501  235.308     17.5577  98.4875    303.534     25.4265     303.534     
1 1 1 37 1  15 o 9  20.9552 5.85961 2.26694     9.15709  7.2496      9.25778  10.9413    116.084     47.2298     116.084     
1 1 1 37 1  16 o 6  59.0664 4.03082 58.7078     11.7512  69.2005     11.7396  38.231     202.671     7.98359     22.6714     
1 1 1 37 1  17 f 0  96.0734 3.18802 168.293     15.3314  164.561     15.2803  76.748     45.5297     0           0           
1 1 1 37 1  18 o 16 25.2768 5.83847 17.9176     9.02845  2.66339     9.71391  7.05259    302.396     11.6353     122.396     
1 1 1 37 1  19 o 11 26.1426 6.08456 17.782      9.65309  5.91333     9.79539  8.37249    310.79      10.3958     130.79      
1 1 1 37 1  20 o 3  34.0253 5.96772 24.3628     10.0611  20.6995     10.2302  17.4145    100.026     8.01822     280.026     
1 1 1 37 1  21 o 6  55.8252 4.16089 56.1009     10.7668  58.7503     12.1439  38.4955    28.1305     1.88711     208.131     
1 1 1 37 1  22 o 5  32.3445 5.79162 21.4356     9.3305   19.2729     9.47893  12.3569    174.148     16.9245     354.148     
1 1 1 37 1  23 o 4  57.3223 3.89342 60.6098     11.0446  60.0245     11.0492  24.882     118.235     32.5634     298.235     
1 1 1 37 1  24 o 4  76.945  3.35144 108.26      12.7163  106.682     13.0001  58.379     170.308     5.55619     170.308     
1 1 1 37 1  25 o 11 64.0257 4.03147 69.4362     12.8814  81.5999     12.614   51.7132    260.934     12.597      260.934     
1 1 1 37 1  26 o 12 53.3947 4.3507  51.1239     11.8662  54.8497     10.903   27.3377    35.4778     21.1126     215.478     
1 1 1 37 1  27 o 2  32.7837 6.06519 17.0788     9.80615  25.4103     10.5237  15.9805    299.473     9.63976     119.473     
1 1 1 37 1  28 o 5  35.8093 5.62843 30.1225     9.74985  20.1275     10.0354  25.8119    80.7766     11.4545     80.7766     
1 1 1 37 1  29 o 12 24.5105 6.09402 9.07227     9.39534  11.9269     9.24361  7.13936    159.416     0.621101    339.416     
1 1 1 37 1  30 o 5  30.7562 6.08402 16.1323     9.69895  21.1462     9.88952  14.067     219.754     10.2062     39.7545     
1 1 1 37 1  31 o 5  49.5622 4.59253 41.0437     11.1649  51.5287     10.9107  33.4973    280.811     1.68917     100.811     
1 1 1 37 1  32 o 4  39.8491 5.51826 37.1963     10.7519  25.0422     10.4689  22.1488    345.217     9.42414     165.217     
1 1 1 37 1  33 o 19 32.081  6.23668 18.7731     10.7939  22.1755     9.97606  18.6248    182.884     2.1822      2.88391     
1 1 1 37 1  34 o 8  31.4756 6.12346 16.3849     10.0005  23.0988     10.1023  13.9791    337.873     12.6513     157.873     
1 1 1 37 1  35 o 19 30.7811 6.188   22.4632     10.0872  15.3003     10.1547  13.867     267.71      11.8523     87.7101     
1 1 1 37 1  36 o 7  39.7787 5.55489 34.3728     10.7159  27.9407     10.6347  23.7936    115.408     6.30268     295.408     
1 1 1 37 1  37 o 14 46.8176 4.79263 40.227      10.7634  43.6789     11.0677  34.1946    298.297     3.95011     298.297     
1 1 1 37 1  38 o 7  50.825  5.11023 43.5957     12.5267  56.6327     12.562   37.2024    280.695     3.90029     280.695     
1 1 1 37 1  39 o 17 75.6737 3.6671  107.841     13.1177  104.213     14.4566  61.0181    340.357     14.6548     340.357     
1 1 1 37 1  40 o 12 19.4693 5.71223 8.21812     9.56553  -5.08289    9.8865   5.85408    315.788     3.00918     135.788     
1 1 1 37 1  41 o 19 17.2056 5.42491 -2.77293    9.38511  -0.951493   9.59916  2.97948    179.425     9.11476     359.425     
1 1 1 37 1  42 o 18 66.9635 3.9125  80.2796     12.751   88.3209     13.2704  54.3881    133.761     14.8639     133.761     
1 1 1 37 1  43 o 1  26.9249 6.58429 11.8798     10.2893  17.3825     11.4191  8.45453    84.1256     17.3873     264.126     
1 1 1 37 1  44 o 10 27.9358 6.4781  18.2546     10.4035  14.0921     10.6716  15.1997    350.478     3.32714     170.478     
1 1 1 37 1  45 o 2  53.8195 4.65459 57.7105     11.8776  55.0662     12.6523  46.6827    24.8577     20.2934     24.8577     
1 1 1 37 1  46 o 17 77.0911 3.72801 108.046     13.9785  115.557     14.6559  63.7957    60.1343     20.0902     60.1343     
1 1 1 37 1  47 o 19 57.241  4.6209  56.0046     12.6717  72.1583     13.2247  41.0208    239.739     3.56339     239.739     
1 1 1 37 1  48 o 16 26.1888 6.59907 17.9939     10.9642  9.14171     11.4869  9.40129    76.8326     12.3627     256.833     
1 1 1 37 1  49 o 10 22.5904 6.39219 3.34706     11.3078  11.6323     11.1018  6.68965    125.541     10.1812     305.541     
1 1 1 37 1  50 o 9  34.8237 6.75818 35.3914     12.038   17.7484     13.7775  16.8668    167.352     10.9358     347.352     
1 1 1 37 1  51 o 15 45.6609 5.73447 39.103      12.699   47.1711     12.5074  42.9244    4.80796     30.7394     4.80796     
1 1 1 37 1  52 f 0  25.579  6.93691 11.9818     12.6062  13.049      12.3328  14.1286    235.452     0           0           
1 1 1 37 1  53 o 6  40.5177 7.10411 35.6131     15.0036  38.1339     13.7552  24.0513    266.316     5.07248     86.3158     
1 1 1 37 1  54 o 19 29.7111 7.42907 8.28378     14.8862  29.5046     14.823   19.0885    111.472     4.20777     111.472     
1 1 1 37 1  55 o 9  26.2108 7.55157 11.9743     14.5189  14.6234     16.6977  14.3892    10.1076     4.63629     10.1076     
1 1 1 37 1  56 o 3  39.5041 7.80722 38.2029     16.1336  38.6248     15.9729  32.6274    220.024     18.5836     220.024     
1 1 1 37 1  57 o 6  30.5227 7.68432 30.5713     15.2308  14.9681     15.6364  19.3269    265.756     7.15057     265.756     
1 1 1 37 1  58 o 8  29.1683 8.39264 45.8236     23.6962  -4.03657    17.825   15.2661    197.686     0.510824    17.6857     
1 1 1 37 1  59 o 8  30.7107 8.58434 11.4993     24.8042  37.1852     19.0824  15.7412    178.618     2.08349     358.618     
1 1 1 37 1  60 o 10 24.2439 7.58376 8.12567     18.0688  12.2704     18.3149  5.84719    169.134     0.491947    349.134     
1 1 1 37 1  61 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 2  0  o 6  58.2243 3.8332  62.2031     10.9493  62.2031     10.9493  61.528     180         35.46       180         
1 1 1 37 2  1  o 11 41.9523 4.89185 28.144      9.84593  38.1637     9.86302  23.111     206.249     11.2592     26.249      
1 1 1 37 2  2  o 2  69.2176 3.48192 78.2525     12.222   95.6504     11.5942  42.0325    166.286     17.2864     346.286     
1 1 1 37 2  3  o 7  40.4403 5.21561 35.0263     10.6975  27.0509     9.67011  21.3422    144.228     12.304      324.228     
1 1 1 37 2  4  o 12 56.9666 4.41349 64.7864     11.6861  54.8469     12.8533  29.7916    191.436     22.7472     11.4361     
1 1 1 37 2  5  o 5  90.7009 3.34146 137.776     15.8198  159.52      14.2121  67.9893    323.287     1.90413     323.287     
1 1 1 37 2  6  o 19 22.8751 6.04689 8.60525     9.19913  6.85423     9.49192  4.07984    171.288     9.57316     351.288     
1 1 1 37 2  7  o 14 48.2124 4.79391 38.476      11.0272  48.3911     11.4087  40.3238    167.882     16.3068     167.882     
1 1 1 37 2  8  o 16 54.9541 4.21812 63.5898     11.0053  47.9232     11.5287  54.1468    325.911     39.6205     325.911     
1 1 1 37 2  9  o 14 40.6243 4.89168 29.3133     9.31922  32.7951     9.88776  26.6468    353.877     0.571467    173.877     
1 1 1 37 2  10 o 17 25.8583 5.8403  12.5885     8.44934  12.0832     8.63884  3.95595    337.218     22.8183     157.218     
1 1 1 37 2  11 o 5  64.8985 3.4052  77.6594     11.008   75.0453     10.9816  41.8017    293.646     10.6507     113.646     
1 1 1 37 2  12 o 14 75.4391 3.21637 103.25      11.9264  102.386     12.2754  51.46      135.847     7.55709     315.847     
1 1 1 37 2  13 o 13 27.1784 5.86133 19.0047     9.30486  8.58707     8.6994   6.83224    237.43      18.8941     57.4301     
1 1 1 37 2  14 o 17 87.9183 3.09691 141.944     14.0204  136.916     13.1819  84.6161    31.5751     41.1593     31.5751     
1 1 1 37 2  15 o 12 82.8083 3.1413  122.196     13.3798  125.464     12.5692  73.4337    195.441     26.2117     195.441     
1 1 1 37 2  16 o 1  56.8209 3.8406  60.7599     11.1306  57.5207     10.4778  51.3813    319.751     23.978      319.751     
1 1 1 37 2  17 o 9  104.626 3.00009 183.602     15.6409  211.479     15.6959  83.206     153.851     11.9954     153.851     
1 1 1 37 2  18 o 18 80.151  3.38584 102.547     13.4506  131.4       13.4537  65.125     212.188     13.4849     212.188     
1 1 1 37 2  19 o 18 24.3366 6.25352 10.8618     10.2992  8.72707     9.42146  6.46296    169.514     11.9074     349.514     
1 1 1 37 2  20 o 15 21.2325 5.97844 3.12593     10.1759  6.74545     9.08764  1.78492    286.858     2.17579     106.858     
1 1 1 37 2  21 f 0  87.4723 3.30794 126.2       14.0494  151.911     14.8107  34.9961    230.559     0           0           
1 1 1 37 2  22 o 16 33.7407 5.95065 16.1809     10.0521  28.7506     10.3947  14.8254    292.547     14.5919     112.547     
1 1 1 37 2  23 o 19 25.3328 6.15825 13.4664     9.09903  9.20796     10.0386  7.95086    358.173     12.1781     178.173     
1 1 1 37 2  24 o 13 28.168  6.0309  3.8667      9.80681  25.1553     10.7753  11.4022    22.4094     10.8365     202.409     
1 1 1 37 2  25 o 3  19.6829 5.75068 2.41044     8.67797  3.67649     9.74744  0.317578   318.61      20.5259     318.61      
1 1 1 37 2  26 o 8  35.8139 5.92095 23.0841     10.1137  27.5125     10.7793  26.1236    76.973      11.4905     76.973      
1 1 1 37 2  27 o 7  20.8513 5.62784 -7.24531    8.7769   13.6949     9.90744  2.06575    85.8528     17.546      265.853     
1 1 1 37 2  28 o 16 50.0139 4.34181 40.8023     10.47    53.0223     10.6852  32.1298    2.7308      5.87233     182.731     
1 1 1 37 2  29 o 4  58.2035 3.87262 64.3161     11.1656  60.7296     11.1521  49.1809    225.448     16.7506     225.448     
1 1 1 37 2  30 o 16 39.326  5.32652 24.135      10.0238  36.3022     10.1361  18.5473    192.757     16.7759     12.7574     
1 1 1 37 2  31 o 9  47.3127 4.72648 32.7654     10.6253  53.1746     10.5662  28.4258    356.579     9.21517     176.579     
1 1 1 37 2  32 o 2  40.6773 5.36379 34.5303     10.8812  29.888      10.1881  12.0111    246.649     32.8137     66.6489     
1 1 1 37 2  33 o 13 18.5476 5.5827  1.7822      8.98471  0.804995    9.21864  0.0954411  40.2325     19.7588     220.232     
1 1 1 37 2  34 o 1  60.3245 3.98018 61.6161     11.9981  74.0062     11.6498  45.704     221.833     5.87306     221.833     
1 1 1 37 2  35 f 0  21.2189 5.93501 7.66938     9.37794  3.99112     9.43328  34.0702    169.069     0           0           
1 1 1 37 2  36 o 7  20.7609 5.93093 5.73468     9.48495  4.32457     9.61198  3.02269    46.4417     18.5997     226.442     
1 1 1 37 2  37 o 7  44.0471 5.19618 40.5358     11.3073  35.4982     10.8186  23.8047    25.7419     13.7019     205.742     
1 1 1 37 2  38 o 19 56.2861 4.20727 55.1254     11.5547  64.8868     11.7627  46.3126    257.19      13.8781     257.19      
1 1 1 37 2  39 o 12 24.4887 6.37234 10.38       10.1226  11.4118     10.4473  7.05448    313.239     16.635      133.239     
1 1 1 37 2  40 o 5  26.3771 6.36188 8.93978     10.3604  18.1741     10.3817  14.9495    309.709     0.937687    129.709     
1 1 1 37 2  41 o 10 20.4335 5.94573 -4.23113    9.86854  10.6136     10.8183  1.44739    238.54      0.212295    238.54      
1 1 1 37 2  42 o 5  20.8553 6.10597 7.19598     10.8617  2.37447     10.0725  7.42795    34.7427     1.1413      214.743     
1 1 1 37 2  43 o 3  21.8345 6.17086 5.03686     10.168   8.82058     10.341   8.92888    169.512     3.0349      349.512     
1 1 1 37 2  44 o 3  17.7897 5.58103 -6.34613    9.89395  3.15161     10.3189  2.81963    221.192     10.8691     41.1917     
1 1 1 37 2  45 o 6  34.134  6.48867 29.9077     11.4896  20.5952     11.4783  19.7443    15.5136     4.42447     195.514     
1 1 1 37 2  46 o 14 50.3367 5.10502 52.5534     12.3644  48.7402     12.6192  29.2014    256.634     10.5791     76.6341     
1 1 1 37 2  47 o 16 47.1818 5.42447 38.7519     12.2437  52.2029     12.3254  37.1882    29.7318     11.9167     29.7318     
1 1 1 37 2  48 o 19 51.1198 5.57407 51.984      13.3771  54.978      14.2663  30.1666    269.742     9.23298     89.7415     
1 1 1 37 2  49 o 19 43.5122 6.2031  43.6324     12.603   36.8098     13.4759  29.5737    271.059     1.58529     271.059     
1 1 1 37 2  50 o 10 53.9152 5.68977 65.2061     14.566   54.2304     15.0377  44.5036    326.752     16.4977     326.752     
1 1 1 37 2  51 o 2  43.1205 6.58566 48.1231     14.0795  33.1059     13.6602  30.7229    143.081     4.46336     143.081     
1 1 1 37 2  52 o 11 18.5737 5.96485 -1.31275    12.0581  -3.99719    12.1343  1.91204    320.629     16.7882     140.629     
1 1 1 37 2  53 o 16 43.8371 6.55408 36.8761     13.9396  47.941      13.9904  39.2607    45.3661     23.371      45.3661     
1 1 1 37 2  54 o 2  27.4645 7.25138 26.1022     14.5442  4.49293     14.3831  15.5479    40.9868     0.316619    220.987     
1 1 1 37 2  55 o 8  29.2547 7.51361 9.54136     15.1003  29.7854     15.2007  16.2454    341.705     1.78196     161.705     
1 1 1 37 2  56 o 4  26.9155 7.67348 12.3834     17.6496  19.7375     14.9622  13.9081    88.0467     0.867476    88.0467     
1 1 1 37 2  57 o 5  35.7853 8.14073 52.1012     18.3859  17.7874     18.8011  19.8746    321.738     13.5891     321.738     
1 1 1 37 2  58 o 10 22.4113 7.17091 -11.1821    17.404   15.7664     18.3962  6.24304    356.159     6.14165     176.159     
1 1 1 37 2  59 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 2  60 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 3  0  o 18 118.624 3.27126 252.597     19.3795  252.597     19.3795  121.74     4.79673e-06 64.1069     4.79673e-06 
1 1 1 37 3  1  o 17 23.7776 6.23297 6.01552     9.53339  11.3652     10.3534  3.60181    179.238     36.752      179.238     
1 1 1 37 3  2  o 4  62.5086 3.89146 69.5254     12.0408  73.3631     12.0845  47.564     346.117     4.78699     346.117     
1 1 1 37 3  3  o 10 95.2239 3.17073 159.714     15.0713  167.591     15.0993  44.1007    12.6223     53.999      192.622     
1 1 1 37 3  4  o 14 128.724 3.06743 293.802     19.2326  303.085     20.2845  112.057    10.0284     31.683      10.0284     
1 1 1 37 3  5  f 0  37.7463 5.61534 28.0624     10.203   26.7995     10.3669  35.2013    166.502     0           0           
1 1 1 37 3  6  o 5  81.5939 3.08888 124.741     12.7504  115.648     12.4151  62.9895    321.181     5.7067      321.181     
1 1 1 37 3  7  o 9  46.0075 4.41281 40.3072     10.0304  38.4113     9.79387  29.4203    219.724     5.44092     39.7243     
1 1 1 37 3  8  o 17 76.3657 3.52114 102.928     13.865   108.937     12.8774  66.4813    171.747     21.5063     171.747     
1 1 1 37 3  9  o 19 50.6183 4.16209 45.6693     10.4611  48.9812     10.2363  20.2053    149.231     32.6646     329.231     
1 1 1 37 3  10 o 14 15.6522 4.97176 -5.0267     8.23863  -1.76691    8.08901  4.07369    294.323     18.599      294.323     
1 1 1 37 3  11 o 13 122.418 2.83454 271.231     17.3134  267.917     17.4174  114.339    53.0361     46.5973     53.0361     
1 1 1 37 3  12 o 8  103.742 2.90818 195.005     15.0274  192.746     15.1501  88.9133    245.226     24.0833     245.226     
1 1 1 37 3  13 f 0  53.5493 4.00809 62.3176     10.3773  44.0783     10.4766  31.4926    235.637     0           0           
1 1 1 37 3  14 o 8  28.8708 5.82886 13.1261     8.91147  19.0837     8.97525  6.84199    110.424     23.5185     290.424     
1 1 1 37 3  15 o 16 25.0628 5.52612 0.98396     8.71261  19.8047     8.87016  7.37979    284.724     0.609988    104.724     
1 1 1 37 3  16 o 7  23.7512 5.72157 15.8825     8.67034  1.08461     9.39242  2.05474    183.097     24.2092     3.09748     
1 1 1 37 3  17 o 18 100.47  3.10772 171.985     14.7398  193.403     16.492   85.577     14.2133     22.8857     14.2133     
1 1 1 37 3  18 o 6  58.4595 4.02463 69.7873     12.4315  56.5887     10.8663  37.8387    28.6753     8.55839     208.675     
1 1 1 37 3  19 o 15 57.1529 4.09813 59.5748     11.4762  61.165      11.6753  26.9319    320.627     28.947      140.627     
1 1 1 37 3  20 o 10 53.3609 4.44514 64.4085     12.3261  42.8768     10.8356  33.8246    340.457     8.49915     160.457     
1 1 1 37 3  21 o 9  94.719  3.0608  163.304     14.9202  161.446     14.0513  74.3967    64.7447     9.52375     64.7447     
1 1 1 37 3  22 o 14 50.512  4.60389 42.8954     11.2341  53.1388     11.423   14.6615    62.5558     43.4612     242.556     
1 1 1 37 3  23 o 5  34.2595 6.04852 24.6828     10.7695  21.8316     9.9428   23.6132    324.971     11.5169     324.971     
1 1 1 37 3  24 o 3  32.1116 6.10336 24.9956     10.1562  15.8252     10.2396  20.5667    158.96      4.06827     158.96      
1 1 1 37 3  25 o 8  27.6923 6.38236 13.5069     10.3651  15.7505     10.0216  13.2522    318.178     2.88947     318.178     
1 1 1 37 3  26 o 13 172.551 2.89041 541.259     24.3459  533.729     25.6147  159.023    218.7       63.3267     218.7       
1 1 1 37 3  27 o 12 18.1157 5.59441 0.746728    9.47001  -2.35893    9.80782  1.64762    130.877     6.77846     310.877     
1 1 1 37 3  28 o 4  44.7546 5.35495 40.4342     10.6362  37          12.3724  24.8861    110.659     12.8309     290.659     
1 1 1 37 3  29 o 7  38.4696 5.87394 30.5271     10.1524  28.0615     11.823   20.2975    308.5       12.0499     128.5       
1 1 1 37 3  30 o 11 39.3307 5.59473 29.4801     10.2185  31.3618     11.0726  31.5688    154.947     11.7477     154.947     
1 1 1 37 3  31 o 11 104.312 3.15351 189.876     15.5976  206.625     17.301   82.5201    152.861     12.956      152.861     
1 1 1 37 3  32 o 6  36.6662 5.96423 23.0463     10.297   31.2516     11.235   20.82      44.0261     8.22069     224.026     
1 1 1 37 3  33 o 7  22.2132 6.00912 -0.925855   9.45809  13.7543     10.4382  7.62414    158.562     1.31808     158.562     
1 1 1 37 3  34 o 18 41.9798 5.56028 34.8796     10.9157  35.0372     11.6131  31.0063    55.067      4.59998     55.067      
1 1 1 37 3  35 o 15 26.5225 6.18971 18.4545     9.83409  8.61781     9.95102  16.2324    155.647     3.71947     155.647     
1 1 1 37 3  36 o 16 44.9926 5.25465 33.8406     11.4336  46.3878     11.1996  32.9011    45.9998     3.58423     45.9999     
1 1 1 37 3  37 o 6  40.4993 5.6972  31.3153     10.8871  35.1112     11.4299  18.5969    125.45      19.1127     305.45      
1 1 1 37 3  38 o 5  45.3247 5.17909 35.7961     11.306   45.7998     11.2825  30.9999    49.9828     0.812622    229.983     
1 1 1 37 3  39 o 13 42.9939 5.83958 26.181      12.1946  50.9237     11.818   19.3508    235.5       21.1336     55.5001     
1 1 1 37 3  40 o 16 29.67   6.51239 22.9729     11.0447  14.354      10.698   20.5461    91.3844     7.26219     91.3844     
1 1 1 37 3  41 o 14 30.8158 6.54755 27.9942     11.8527  12.8757     10.8539  19.9507    1.87949     1.79361     1.87949     
1 1 1 37 3  42 o 1  18.03   5.62934 -8.55864    10.6961  4.36448     10.1259  3.97629    41.5797     6.09736     221.58      
1 1 1 37 3  43 o 12 28.1004 6.33339 7.51121     10.938   24.5794     10.8334  14.8118    179.752     4.49875     359.752     
1 1 1 37 3  44 o 17 52.945  4.93199 64.914      12.637   46.8388     12.5416  40.0897    195.164     7.57582     195.164     
1 1 1 37 3  45 o 3  30.7025 6.94864 21.4004     11.4963  20.3648     12.747   16.7834    205.863     3.95282     25.8631     
1 1 1 37 3  46 o 17 26.4999 6.82613 11.2869     11.2844  17.6827     12.3552  10.1641    81.886      11.175      261.886     
1 1 1 37 3  47 o 11 48.0048 6.14668 57.7928     14.3337  40.1047     13.9877  28.5577    251.625     8.17314     71.6249     
1 1 1 37 3  48 o 5  39.9941 6.67289 36.0751     13.1109  34.0104     13.2099  13.9069    116.524     26.3008     296.524     
1 1 1 37 3  49 o 18 58.5667 5.21165 68.5854     14.5987  69.2928     15.3075  34.5931    107.073     11.8025     287.073     
1 1 1 37 3  50 o 16 28.3373 7.16714 15.3991     12.8117  19.6246     13.0453  12.9632    165.519     9.49207     345.519     
1 1 1 37 3  51 o 6  25.7173 7.01613 18.4025     13.035   6.66694     13.4186  2.63688    111.225     27.6173     291.225     
1 1 1 37 3  52 o 12 24.9591 6.99802 8.88003     12.9993  14.9522     13.2375  13.2874    330.589     0.217717    150.589     
1 1 1 37 3  53 o 2  48.9694 6.95647 52.8581     16.3686  56.8462     16.5892  30.8116    216.877     4.0699      36.8765     
1 1 1 37 3  54 f 0  19.8838 6.41603 -0.738813   14.2374  -1.1419     14.1397  12.322     284.264     0           0           
1 1 1 37 3  55 o 11 24.3941 7.04145 -7.08365    15.8081  23.0745     14.9226  10.1716    89.8581     4.31039     269.858     
1 1 1 37 3  56 o 4  21.4318 6.84001 -11.8982    18.4215  10.636      15.0029  5.52038    348.021     7.97198     168.021     
1 1 1 37 3  57 o 7  25.2188 7.648   -12.3674    18.9686  29.7631     19.4497  9.4749     108.286     3.77654     288.286     
1 1 1 37 3  58 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 3  59 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 4  0  o 12 53.1883 4.65736 53.3152     11.9025  53.3152     11.9025  42.8322    180         5.12799     180         
1 1 1 37 4  1  o 6  47.3393 4.79767 37.1776     10.533   47.3733     11.5515  22.5577    247.377     22.7824     67.3775     
1 1 1 37 4  2  o 3  90.7033 3.22777 146.597     14.1171  151.327     15.1273  66.5006    191.463     1.99415     11.4626     
1 1 1 37 4  3  f 0  89.1069 3.39121 150.713     14.1863  137.599     15.8306  62.7536    155.833     0           0           
1 1 1 37 4  4  o 4  124.824 2.96353 275.857     18.0494  286.024     18.9748  120.919    173.792     55.3089     173.792     
1 1 1 37 4  5  o 12 62.3548 3.76008 75.1142     10.8731  67.3626     12.2336  51.47      264.944     12.8251     264.944     
1 1 1 37 4  6  o 3  34.934  5.49974 21.7793     9.31975  25.5901     9.45705  22.8652    239.44      1.95497     239.44      
1 1 1 37 4  7  o 11 28.4835 5.97404 15.0153     9.04006  16.3502     9.24562  10.8154    183.069     13.4202     3.06941     
1 1 1 37 4  8  o 13 61.3988 3.7954  80.364      11.7496  58.7074     11.2075  44.0039    320.52      1.24972     140.52      
1 1 1 37 4  9  o 18 41.4062 5.30687 28.1626     10.7144  37.8402     10.3744  18.9856    238.715     20.2302     58.7149     
1 1 1 37 4  10 o 15 24.0558 5.91151 6.83294     8.88287  13.072      8.876    0.157175   269.869     30.4418     269.869     
1 1 1 37 4  11 o 10 43.7666 4.70892 33.9963     10.1359  38.2789     9.81411  13.54      323.596     35.669      143.596     
1 1 1 37 4  12 o 11 71.4748 3.54965 84.2547     12.8098  102.588     12.2878  65.8589    63.8691     27.9898     63.8691     
1 1 1 37 4  13 o 15 24.2643 5.82595 15.6446     8.98923  4.24143     8.88433  5.18688    327.047     18.0796     147.047     
1 1 1 37 4  14 o 17 53.3061 4.0661  52.4819     10.8394  52.6797     10.5378  31.2029    328.895     14.5192     148.895     
1 1 1 37 4  15 o 7  58.065  3.94241 53.9691     11.2784  70.9008     11.164   35.9554    35.8195     12.3458     215.819     
1 1 1 37 4  16 o 10 17.6771 5.32139 4.91612     8.65321  -6.24888    8.70268  1.339      209.487     18.2425     209.487     
1 1 1 37 4  17 o 7  69.4286 3.56929 93.2343     12.6951  83.199      11.973   57.6635    213.848     14.3961     213.848     
1 1 1 37 4  18 o 2  47.3957 4.4892  40.0235     10.2919  44.339      10.4815  21.1256    151.509     25.6913     331.509     
1 1 1 37 4  19 o 2  27.1556 6.13058 10.2649     9.12581  17.8767     9.97142  13.1637    348.813     0.976878    348.813     
1 1 1 37 4  20 o 12 46.7631 4.59791 43.4944     10.2116  38.9482     10.6827  44.2059    221.811     27.976      221.811     
1 1 1 37 4  21 o 12 94.8901 3.01308 157.258     14.253   168.983     14.3179  74.1093    296.678     8.30623     296.678     
1 1 1 37 4  22 o 8  20.0053 5.89162 2.37877     10.6077  3.35295     8.98618  2.36689    313.3       27.9806     313.3       
1 1 1 37 4  23 o 11 80.153  3.49067 125.666     13.9583  109.51      13.8971  71.2531    171.345     25.8068     171.345     
1 1 1 37 4  24 o 13 44.1181 5.18211 44.0772     11.6287  31.3533     10.4363  31.5106    7.25543     2.02388     7.25544     
1 1 1 37 4  25 o 8  42.4354 5.56811 44.7244     11.4067  26.5392     11.2165  26.3133    111.997     6.33784     291.997     
1 1 1 37 4  26 o 6  76.2403 3.50333 101.842     13.6911  111.317     12.8534  60.5344    34.5696     10.0855     34.5696     
1 1 1 37 4  27 o 12 29.0871 6.35176 10.019      11.6251  22.1135     9.95024  8.65922    274.313     21.3517     94.3126     
1 1 1 37 4  28 o 4  95.9966 3.344   164.14      16.2435  172.926     15.8068  83.9472    52.1765     27.5131     52.1765     
1 1 1 37 4  29 o 15 75.3454 3.81713 103.369     14.4393  106.918     14.1856  59.1181    56.723      8.79325     56.723      
1 1 1 37 4  30 o 9  50.8995 4.4718  51.2972     11.1247  47.0921     11.1727  26.9525    276.259     19.071      96.2592     
1 1 1 37 4  31 o 14 45.7662 4.93026 47.3854     10.8988  34.1494     10.7731  46.1313    310.355     33.1947     310.355     
1 1 1 37 4  32 o 14 21.2978 5.71756 13.7449     9.40232  -5.19935    9.73868  8.84923    53.6393     1.37239     233.639     
1 1 1 37 4  33 o 2  19.1726 5.74474 6.56691     9.68633  -5.00397    10.3258  5.76127    96.2216     6.8404      276.222     
1 1 1 37 4  34 o 5  34.6214 6.31023 23.025      10.4918  27.1156     11.5587  25.5313    284.204     5.90045     284.204     
1 1 1 37 4  35 o 4  23.3834 6.28165 2.4052      10.2518  14.8173     10.9416  5.5568     284.435     18.5639     104.435     
1 1 1 37 4  36 o 8  71.5123 3.93634 89.9866     13.0849  103.017     14.9214  59.991     222.076     17.6133     222.076     
1 1 1 37 4  37 o 8  48.4592 5.26087 34.8874     11.6802  60.2212     12.5512  37.5359    350.439     7.71754     350.439     
1 1 1 37 4  38 o 3  41.544  5.89627 37.0249     11.2608  34.4255     12.4065  36.2089    342.205     17.7324     342.205     
1 1 1 37 4  39 f 0  22.6034 6.20396 14.593      10.5228  -1.70754    11.4033  33.1685    62.4617     0           0           
1 1 1 37 4  40 o 8  100.659 3.51984 187.664     16.4208  191.216     18.897   82.6449    231.79      20.938      231.79      
1 1 1 37 4  41 o 8  34.3824 6.85418 26.1683     11.5886  26.138      13.0883  23.3279    168.616     2.92737     168.616     
1 1 1 37 4  42 o 17 51.4055 5.60825 60.6359     12.3294  47.5497     14.8599  45.5412    85.3363     21.6354     85.3363     
1 1 1 37 4  43 o 19 58.6201 5.60241 69.1103     13.9979  71.3333     17.7462  50.4637    38.2353     20.3868     38.2353     
1 1 1 37 4  44 f 0  25.8134 6.89217 16.0313     12.1498  10.0921     12.4799  7.20819    22.915      0           0           
1 1 1 37 4  45 o 10 29.9673 6.94745 25.2572     12.286   14.1397     12.5177  13.849     10.2908     10.096      190.291     
1 1 1 37 4  46 o 16 32.526  6.93104 15.1208     12.6736  32.1621     12.9657  23.1393    8.45585     14.2079     8.45585     
1 1 1 37 4  47 o 8  30.681  7.05595 29.239      13.3314  12.3726     12.761   17.1545    86.4578     4.49203     266.458     
1 1 1 37 4  48 o 7  35.4342 7.0206  21.1868     13.2489  36.0097     13.3986  22.3624    339.991     1.44443     159.991     
1 1 1 37 4  49 o 11 26.0186 7.20663 11.4668     12.9263  15.6209     14.4091  11.3162    247.99      9.06183     67.9903     
1 1 1 37 4  50 o 12 25.4246 7.25821 5.57131     14.7372  17.7804     14.5645  11.8857    169.883     6.15651     349.883     
1 1 1 37 4  51 o 3  63.6822 6.02924 75.9404     18.4319  98.5436     18.7381  48.0459    338.381     8.61952     338.381     
1 1 1 37 4  52 f 0  34.2627 7.98844 33.4865     16.2871  27.5905     15.6068  19.7198    87.4671     0           0           
1 1 1 37 4  53 o 15 33.0828 7.9902  35.64       16.6275  23.1421     15.6179  15.3976    323.63      10.8315     143.63      
1 1 1 37 4  54 o 2  26.2124 7.45519 -0.588508   16.2447  28.2148     16.575   12.4393    204.446     0.447231    204.446     
1 1 1 37 4  55 o 19 20.1667 6.69164 -3.26918    17.9871  -2.99454    16.2512  2.76343    10.7418     2.3038      190.742     
1 1 1 37 4  56 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 4  57 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 5  0  o 7  61.4814 3.65029 69.2693     11.0577  69.2693     11.0577  42.5877    1.86053e-05 8.07994     180         
1 1 1 37 5  1  f 0  26.805  5.91324 17.2125     8.96824  9.93074     9.0091   25.9576    84.7041     0           0           
1 1 1 37 5  2  o 18 61.6818 3.78806 79.4808     11.8373  60.8805     11.247   41.597     299.701     7.23524     119.701     
1 1 1 37 5  3  o 4  64.2704 3.85962 71.1841     12.6473  80.8134     11.8593  50.3335    8.01794     6.70346     8.01793     
1 1 1 37 5  4  o 12 47.0156 4.60376 36.9775     10.7052  46.3447     10.1913  30.1702    38.5824     6.64626     218.582     
1 1 1 37 5  5  o 6  83.8798 3.28829 130.69      13.7722  125.007     13.7594  46.4037    47.2623     32.4613     227.262     
1 1 1 37 5  6  o 13 34.8537 5.85441 29.9595     10.1751  18.0694     10.2541  22.6696    253.801     0.453334    253.801     
1 1 1 37 5  7  f 0  39.2291 5.59735 36.175      10.3588  24.0684     10.8481  34.0799    348.575     0           0           
1 1 1 37 5  8  o 5  37.7676 5.55823 28.3175     9.54858  27.2009     10.7915  26.1754    114.25      17.8082     114.25      
1 1 1 37 5  9  o 7  36.6942 5.76189 24.0948     9.81772  28.8264     10.8395  24.3966    209.642     0.295184    209.642     
1 1 1 37 5  10 o 12 21.6042 6.04023 3.84532     8.66101  8.03654     10.6967  1.5829     195.364     21.4085     15.3641     
1 1 1 37 5  11 o 3  73.9082 3.50791 93.9145     13.018   105.804     12.7587  59.4522    139.444     10.1023     139.444     
1 1 1 37 5  12 o 17 54.7942 4.00534 51.0694     10.6864  60.2702     10.9461  44.2674    87.8182     10.0685     87.8182     
1 1 1 37 5  13 o 10 17.4523 5.28198 -6.49948    8.4702   4.71581     8.74397  1.99861    82.9166     20.589      82.9166     
1 1 1 37 5  14 o 16 61.6748 3.773   73.0039     11.3385  67.0247     11.7128  60.8563    194.095     34.0532     194.095     
1 1 1 37 5  15 o 16 40.9941 4.88205 27.0566     9.23398  37.4859     10.0639  35.9223    340.017     20.5529     340.017     
1 1 1 37 5  16 o 15 102.691 3.13929 191.252     16.8343  191.421     15.3624  71.0753    235.336     10.8657     55.3357     
1 1 1 37 5  17 o 8  86.9127 3.10366 136.415     13.077   137.822     13.863   63.9677    169.289     0.782167    349.289     
1 1 1 37 5  18 o 13 23.9062 6.03191 6.42849     8.21632  13.6076     10.1883  1.66041    69.1364     0.282639    69.1364     
1 1 1 37 5  19 o 5  80.9555 3.29373 120.598     13.265   118.348     13.3456  61.1737    155.468     3.01022     155.468     
1 1 1 37 5  20 o 16 21.1929 5.82202 8.37075     8.55296  3.25346     9.48474  1.26547    83.7107     22.5585     263.711     
1 1 1 37 5  21 o 17 56.141  4.14614 56.3241     11.2076  61.2258     11.7803  42.8799    99.671      4.99179     99.671      
1 1 1 37 5  22 o 13 66.4841 3.5219  74.3537     11.1263  88.2747     12.1724  48.9979    356.028     0.9706      356.028     
1 1 1 37 5  23 o 2  36.0489 5.46726 22.0746     9.02921  29.3277     10.1711  28.4491    304.972     10.4951     304.972     
1 1 1 37 5  24 o 13 15.255  4.95222 -1.9273     7.73395  -10.4695    9.98343  0.446115   96.3203     4.04737     276.32      
1 1 1 37 5  25 o 13 31.3236 6.01349 25.3271     9.20006  13.4549     11.0918  1.04818    165.317     46.1231     165.317     
1 1 1 37 5  26 o 9  22.27   5.89492 8.22698     8.34418  7.90997     9.41894  1.23722    30.5149     31.7144     30.5149     
1 1 1 37 5  27 o 12 33.9379 6.02179 29.4759     10.5405  17.6098     10.2609  24.7925    163.802     5.08003     163.802     
1 1 1 37 5  28 o 2  103.752 3.23888 196.831     17.3516  197.71      16.2214  89.9975    255.832     27.492      255.832     
1 1 1 37 5  29 o 4  14.0668 4.71478 -6.00292    8.28139  -14.005     9.82164  6.16037    258.862     27.7904     258.862     
1 1 1 37 5  30 o 2  27.1006 6.28302 12.64       9.52633  16.8819     10.2326  12.1409    154.837     10.8636     334.837     
1 1 1 37 5  31 o 12 73.0798 3.58065 93.7203     12.8503  105.019     13.1977  59.4729    216.983     12.9333     216.983     
1 1 1 37 5  32 o 2  36.2313 5.94993 18.7587     10.7817  36.1258     10.8937  14.2728    213.08      22.0625     33.08       
1 1 1 37 5  33 o 13 42.7187 5.30004 34.2867     10.5598  38.7491     11.3109  30.3862    59.4194     1.27805     59.4194     
1 1 1 37 5  34 o 3  26.9707 6.37853 14.4079     9.77895  15.4691     10.4899  15.5991    30.4002     1.77394     210.4       
1 1 1 37 5  35 o 9  24.7864 6.20033 12.76       8.77247  11.0952     10.632   7.54113    215.094     3.87869     215.094     
1 1 1 37 5  36 o 6  58.1533 4.30775 66.4958     12.1492  63.7479     12.5628  42.7217    36.8893     2.69022     36.8892     
1 1 1 37 5  37 o 6  80.6874 3.60249 125.91      14.5246  118.492     14.4512  60.2945    227.206     4.37753     227.206     
1 1 1 37 5  38 o 3  38.1701 6.47424 33.5742     11.7286  29.3627     12.7877  28.8986    70.6361     7.55803     70.6361     
1 1 1 37 5  39 o 12 27.779  6.77369 11.7507     11.0569  21.0425     12.1515  16.9359    183.947     3.5863      183.947     
1 1 1 37 5  40 o 12 56.8777 5.19397 67.4276     13.9444  62.5784     14.8666  49.5942    54.278      20.4127     54.278      
1 1 1 37 5  41 o 10 18.2152 5.84865 1.21623     11.8678  -8.0735     11.6397  3.14074    208.033     6.40663     28.0327     
1 1 1 37 5  42 o 1  60.3184 4.91726 71.5733     14.4781  73.1745     14.7065  54.752     262.72      26.242      262.72      
1 1 1 37 5  43 f 0  64.8329 4.9581  68.5328     14.9667  100.078     16.4656  30.4624    301.35      0           0           
1 1 1 37 5  44 o 12 31.9702 7.62839 23.4181     12.8452  23.8952     16.3808  21.7677    127.423     4.91294     127.423     
1 1 1 37 5  45 o 3  31.885  7.27252 13.5699     12.9726  32.8875     14.641   20.6098    233.076     1.06838     233.076     
1 1 1 37 5  46 o 13 23.4267 6.93761 6.19776     12.8974  9.3792      14.4434  10.412     210.177     3.62095     210.177     
1 1 1 37 5  47 o 15 17.0027 5.75353 -8.47007    11.7965  -17.8365    16.2356  3.83272    158.532     4.98825     338.532     
1 1 1 37 5  48 o 2  33.1162 7.63807 9.45681     14.8829  43.4944     17.3156  24.7903    306.644     9.9305      306.644     
1 1 1 37 5  49 o 12 45.0937 8.16922 56.1615     17.4141  46.2938     20.2002  37.4487    45.2623     15.9631     45.2623     
1 1 1 37 5  50 o 3  24.6324 7.53432 5.14997     15.6651  14.9902     18.4429  11.6442    334.101     3.32733     154.101     
1 1 1 37 5  51 o 10 62.8867 7.48118 107.038     19.338   82.8205     24.3411  49.6615    200.028     13.7204     200.028     
1 1 1 37 5  52 o 19 25.2459 7.68903 16.7628     16.2028  7.48682     20.1489  11.0344    40.5425     3.55093     220.542     
1 1 1 37 5  53 o 16 22.1128 7.20567 2.09301     15.8893  4.28334     21.0038  5.1843     236.337     1.36169     56.3369     
1 1 1 37 5  54 o 16 18.3822 6.24416 -30.6235    19.4297  -0.830819   15.9886  1.47746    297.459     10.311      117.459     
1 1 1 37 5  55 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 6  0  o 3  13.696  6.08456 2.19026     8.72743  2.19026     8.72743  3.64567    360         16.2276     360         
1 1 1 37 6  1  o 7  33.6156 5.66031 12.6652     10.1154  32.0716     9.6093   4.08323    114.97      39.3025     294.97      
1 1 1 37 6  2  o 13 61.7641 3.8116  73.9728     11.4677  66.6564     11.8357  43.2507    48.0569     4.33541     228.057     
1 1 1 37 6  3  o 14 95.7945 3.06735 176.774     15.0087  156.249     14.3557  82.0578    221.394     20.8635     221.394     
1 1 1 37 6  4  o 9  34.1524 5.73916 27.4465     9.67037  18.6699     9.84804  21.1181    239.012     2.81212     59.012      
1 1 1 37 6  5  o 19 45.0764 4.45991 37.2373     9.31776  39.2497     10.2746  29.3809    167.019     5.45915     347.019     
1 1 1 37 6  6  o 3  29.6553 5.89132 17.2917     8.77258  17.3627     9.46559  17.3521    165.323     6.46294     165.323     
1 1 1 37 6  7  o 18 16.0836 5.05519 -1.07063    7.84256  -3.34782    8.54877  0.588721   151.464     11.0397     151.464     
1 1 1 37 6  8  o 1  20.3028 5.66592 5.13207     8.14104  5.13293     8.8673   4.02428    64.3423     10.3079     244.342     
1 1 1 37 6  9  o 18 26.6086 6.30097 12.5438     8.73235  14.1608     11.0722  13.1815    56.0522     1.99281     236.052     
1 1 1 37 6  10 o 6  31.1285 6.10893 20.9046     9.37714  17.4927     10.4816  11.909     272.173     18.0451     92.173      
1 1 1 37 6  11 o 8  20.116  5.83666 1.71139     8.20561  6.02476     10.5769  2.30854    288.926     1.81341     108.926     
1 1 1 37 6  12 o 16 93.4278 3.15252 164.092     13.3678  153.28      15.8435  80.6986    28.6884     22.2634     28.6884     
1 1 1 37 6  13 o 2  49.3623 4.6337  53.4462     9.64247  39.0656     11.8441  44.714     112.918     20.6368     112.918     
1 1 1 37 6  14 o 15 33.8248 5.86595 21.6385     8.85259  23.8946     10.8937  21.1203    240.597     2.47279     60.5974     
1 1 1 37 6  15 o 19 97.8224 3.14239 187.1       13.8774  161.334     16.4537  87.4742    62.2523     29.3733     62.2523     
1 1 1 37 6  16 o 5  62.3446 3.77271 72.5293     11.3125  71.0407     12.0122  49.7656    76.5234     8.48403     76.5234     
1 1 1 37 6  17 o 13 53.4701 4.29172 59.6519     10.0317  47.7862     12.0017  41.629     295.746     6.16091     295.746     
1 1 1 37 6  18 o 9  32.7578 5.93828 25.4399     8.98325  17.1604     11.0446  20.3647    129.867     2.63461     309.867     
1 1 1 37 6  19 o 1  40.0656 5.64243 35.5068     10.283   27.9746     11.4975  17.362     301.958     22.4        121.958     
1 1 1 37 6  20 o 17 42.4419 5.28283 41.8376     10.1929  28.8289     11.1282  23.3718    238.752     13.8436     58.7523     
1 1 1 37 6  21 o 16 30.0124 5.98683 16.691      8.8143   19.6415     9.9799   20.592     253.909     11.2911     253.909     
1 1 1 37 6  22 o 6  17.3618 5.33684 -1.29101    8.05296  1.26006     9.23153  3.11685    271.431     3.75306     91.4312     
1 1 1 37 6  23 f 0  47.2255 4.80496 54.9347     10.0207  32.1328     11.0252  24.8493    279.178     0           0           
1 1 1 37 6  24 o 6  25.0658 6.14345 15.9837     8.679    4.64351     11.8172  12.209     236.864     6.51712     56.8642     
1 1 1 37 6  25 o 19 84.2013 3.42353 119.732     13.6042  142.23      15.1788  75.3494    272.055     26.891      272.055     
1 1 1 37 6  26 o 9  27.5967 6.22953 13.8032     9.24756  17.0722     10.2097  13.9472    359.84      8.01094     179.84      
1 1 1 37 6  27 o 2  53.2486 4.3883  51.9913     11.2926  56.3802     11.6863  53.1992    130.976     31.5865     130.976     
1 1 1 37 6  28 o 2  19.8431 5.69073 -1.50819    8.44511  9.52165     9.81041  7.22263    197.366     5.81281     17.3657     
1 1 1 37 6  29 o 18 44.7591 5.46849 43.1368     11.2534  37.3138     12.2615  38.2652    55.3975     14.2368     55.3975     
1 1 1 37 6  30 o 6  66.9964 3.69449 81.9893     11.7774  86.3016     12.8308  59.2225    66.3739     21.5178     66.3739     
1 1 1 37 6  31 o 12 20.1539 5.93735 3.8154      9.26939  4.53293     10.6032  7.05236    18.8102     7.31528     198.81      
1 1 1 37 6  32 o 16 42.6725 5.39342 28.5844     10.7706  45.9437     11.262   27.7084    234.269     4.48903     54.2693     
1 1 1 37 6  33 o 11 21.4687 6.29485 6.03316     11.8397  5.17091     10.351   8.59717    340.197     0.0862608   340.197     
1 1 1 37 6  34 o 2  24.3735 6.735   7.88425     11.8708  12.923      12.0946  12.5605    57.4234     3.02331     57.4234     
1 1 1 37 6  35 o 2  22.0433 6.61445 9.48086     13.8636  0.680007    11.6225  9.23106    41.2669     3.65778     221.267     
1 1 1 37 6  36 o 17 33.7582 7.09733 22.162      13.3624  29.0977     12.7069  24.8692    253.243     7.65731     253.243     
1 1 1 37 6  37 o 9  49.7706 6.26227 35.5414     15.1565  71.54       13.8944  36.7674    18.2146     4.27777     18.2147     
1 1 1 37 6  38 o 14 83.5399 4.13409 131.111     17.6724  136.906     16.6673  81.6758    233.147     44.194      233.147     
1 1 1 37 6  39 o 6  44.0054 6.32152 43.5529     13.25    39.72       13.6706  27.1811    5.92297     6.04757     185.923     
1 1 1 37 6  40 o 1  65.4262 4.88068 70.1501     14.7732  101.187     16.5656  57.9217    178.114     23.8919     178.114     
1 1 1 37 6  41 o 14 36.1557 6.92928 18.4335     14.3454  40.5196     13.2063  22.0579    122.471     3.79491     302.471     
1 1 1 37 6  42 o 6  43.5617 6.61447 51.8674     13.7286  31.8714     14.4783  29.2081    93.749      1.1491      273.749     
1 1 1 37 6  43 o 1  26.9933 7.15408 15.326      12.5024  15.1092     13.6741  16.8366    56.1195     3.00488     56.1195     
1 1 1 37 6  44 o 4  29.1067 7.4908  27.8484     14.6949  6.9021      16.0718  12.4659    270.555     12.828      90.5545     
1 1 1 37 6  45 o 14 23.1193 7.09582 -5.81991    16.0197  13.2877     15.7699  8.31338    54.2231     11.0026     234.223     
1 1 1 37 6  46 o 1  28.6512 7.71466 25.2512     15.8901  11.8969     15.549   18.6786    329.112     4.425       329.112     
1 1 1 37 6  47 f 0  23.541  7.11788 14.2161     15.0244  -0.642008   15.8222  8.76751    277.956     0           0           
1 1 1 37 6  48 o 7  22.1283 6.91553 10.7354     15.3747  -3.6056     15.4953  1.46777    109.011     24.3558     289.011     
1 1 1 37 6  49 o 3  25.0046 7.48151 12.3935     15.6404  12.6449     16.7142  12.2514    62.1627     0.0145382   242.161     
1 1 1 37 6  50 o 19 23.191  7.11485 -3.43702    15.9579  17.4085     16.0694  6.15609    199.094     13.9301     19.0941     
1 1 1 37 6  51 o 3  24.5628 7.43589 5.59068     16.1135  18.8728     16.9543  9.16584    15.0042     7.38504     195.004     
1 1 1 37 6  52 o 12 33.2717 8.22421 44.8265     18.065   20.0503     18.0205  20.2706    250.092     2.54847     250.092     
1 1 1 37 6  53 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 6  54 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 7  0  o 3  17.7146 6.74123 8.49363     8.27504  8.49363     8.27504  0.891747   360         18.7296     180         
1 1 1 37 7  1  o 17 40.4017 4.9591  41.5282     9.9491   22.5388     9.16182  23.0659    294.949     11.3332     114.949     
1 1 1 37 7  2  o 16 92.6132 2.96541 153.046     13.8048  158.153     13.6437  74.4906    175.173     9.98176     175.173     
1 1 1 37 7  3  o 4  19.6631 5.61078 2.46981     8.0648   5.84625     9.0238   0.112033   174.031     22.6294     354.031     
1 1 1 37 7  4  o 15 18.3027 5.45934 -6.56349    8.00121  7.37083     9.94214  0.0894705  253.073     19.2029     73.0725     
1 1 1 37 7  5  o 17 50.1266 4.27845 53.1194     10.1204  41.4609     10.6688  34.6034    271.853     3.61547     91.8528     
1 1 1 37 7  6  f 0  17.8677 5.39108 1.03235     8.13186  0.962092    8.90174  16.1616    150.511     0           0           
1 1 1 37 7  7  o 16 20.1269 5.68214 -0.178244   8.18076  8.92067     9.54819  5.28216    63.1469     6.59855     243.147     
1 1 1 37 7  8  o 13 29.3123 5.85457 12.9807     8.53555  21.3364     9.63836  18.8182    47.9786     2.56466     47.9786     
1 1 1 37 7  9  o 6  23.1273 5.88677 10.9628     8.27633  7.06582     9.3871   9.67857    120.798     4.67089     300.798     
1 1 1 37 7  10 o 10 40.0811 5.29469 32.4357     9.71564  30.2003     10.7289  26.1064    11.1922     4.33088     191.192     
1 1 1 37 7  11 o 17 70.1332 3.61192 85.1801     12.2428  96.1191     12.9707  51.4078    273.832     1.36754     93.8319     
1 1 1 37 7  12 o 6  14.7384 4.81843 -3.8165     7.98884  -8.30283    8.88496  4.59564    208.097     24.1928     208.097     
1 1 1 37 7  13 o 8  64.6863 3.65617 79.8488     11.5403  74.7076     11.9351  54.8046    348.51      14.3873     348.51      
1 1 1 37 7  14 o 10 47.5202 4.77691 32.3256     10.4494  55.4892     11.1456  42.3021    148.294     17.369      148.294     
1 1 1 37 7  15 o 3  69.4731 3.73797 92.6905     12.3109  86.0529     13.4258  65.2865    253.787     28.382      253.787     
1 1 1 37 7  16 o 15 67.1229 3.68142 76.8165     11.1747  90.2883     13.4145  43.1207    321.178     13.3775     141.178     
1 1 1 37 7  17 o 11 68.8668 3.82693 99.4993     11.6058  77.3429     13.9252  69.4459    87.891      38.1319     87.891      
1 1 1 37 7  18 o 16 23.9819 6.08321 12.6428     8.35     6.81053     10.9047  12.6969    188.8       2.86384     188.8       
1 1 1 37 7  19 o 6  33.5885 6.48074 24.4152     10.474   22.2832     12.0473  17.9807    61.6742     10.5404     241.674     
1 1 1 37 7  20 o 9  27.1672 6.36562 10.2114     8.758    19.6251     11.5951  6.25311    117.143     24.6336     297.143     
1 1 1 37 7  21 o 11 52.6054 4.69999 55.2833     11.0178  51.184      12.9576  46.7421    181.127     17.8741     181.127     
1 1 1 37 7  22 o 9  42.4512 5.3315  41.9916     9.73886  29.8287     11.6378  41.4364    75.9172     26.1472     75.9172     
1 1 1 37 7  23 o 2  54.6698 4.27624 64.4536     10.7038  49.7168     11.8744  45.1831    81.1085     11.1641     81.1085     
1 1 1 37 7  24 o 10 31.1559 6.37964 22.6782     9.94708  17.8513     11.3926  19.7148    205.119     13.784      205.119     
1 1 1 37 7  25 o 16 41.4705 5.75826 31.459      9.96049  38.9251     13.1278  35.5765    78.944      13.8701     78.944      
1 1 1 37 7  26 o 12 15.6898 5.07863 -7.89789    8.18855  -0.705964   9.75437  2.15432    5.05868     8.74875     185.059     
1 1 1 37 7  27 o 13 19.0317 5.51856 9.89884     9.15265  -8.96988    9.79449  5.22969    12.6275     10.5609     192.627     
1 1 1 37 7  28 o 7  26.297  6.04599 5.57225     9.37018  21.8498     10.2801  14.3109    127.529     4.59061     307.529     
1 1 1 37 7  29 o 9  45.5594 5.22284 35.953      11.2852  47.7538     11.6178  41.8944    240.803     20.8479     240.803     
1 1 1 37 7  30 o 8  29.1038 6.94284 15.0798     10.8401  21.8793     13.202   10.972     252.558     17.1497     72.5581     
1 1 1 37 7  31 o 12 24.9295 6.38419 1.73395     10.4714  20.6448     11.7543  6.91096    161.023     18.6592     341.023     
1 1 1 37 7  32 o 9  27.5093 6.98568 14.3042     12.818   17.4047     11.8384  17.3466    222.015     6.46587     222.015     
1 1 1 37 7  33 o 18 65.4222 4.68984 71.2043     14.6408  97.6603     15.4423  47.7456    235.168     1.04514     235.168     
1 1 1 37 7  34 o 19 35.6534 6.69937 18.5247     12.4749  38.3936     12.9396  12.3542    34.2558     24.6203     214.256     
1 1 1 37 7  35 o 9  20.7734 6.42302 8.11458     13.8891  -4.14264    11.7365  6.061      24.2635     1.60058     204.263     
1 1 1 37 7  36 o 3  31.9397 7.52792 33.5444     16.1483  14.6843     12.7294  22.0811    95.2809     7.08984     95.2809     
1 1 1 37 7  37 o 15 74.4959 4.78765 107.58      18.482   111.969     16.7455  58.8066    158.528     10.7046     158.528     
1 1 1 37 7  38 o 13 28.7059 7.35337 20.2558     14.0485  16.3228     13.2107  16.8048    23.3136     0.773363    203.314     
1 1 1 37 7  39 o 13 18.2849 5.95878 -9.21009    13.2049  -1.38437    12.3763  1.80766    11.6752     25.4194     11.6752     
1 1 1 37 7  40 o 7  22.147  6.69325 0.221569    13.8408  8.86696     12.9672  8.49077    15.4187     8.4166      195.419     
1 1 1 37 7  41 o 12 25.8269 7.6671  11.7563     18.458   10.5371     15.1139  2.57825    277.399     28.9958     97.3992     
1 1 1 37 7  42 o 18 19.839  6.48066 -20.9357    18.1321  2.78424     14.1091  7.56566    213.736     2.77263     33.7358     
1 1 1 37 7  43 o 16 17.008  5.77083 -12.6252    14.227   -13.9797    14.1958  3.18384    270.228     1.93857     90.2279     
1 1 1 37 7  44 o 15 33.6581 8.04158 15.8297     18.0697  40.1818     16.9088  17.6845    27.6025     9.11085     207.603     
1 1 1 37 7  45 o 10 25.7283 7.4578  -1.63121    15.9798  24.2323     16.8232  15.0781    212.248     2.81917     212.248     
1 1 1 37 7  46 o 8  38.9015 8.25656 41.8626     17.1956  38.832      17.6193  21.8624    83.4779     8.22868     263.478     
1 1 1 37 7  47 o 3  56.2004 7.06424 65.0824     18.492   85.5231     19.7693  45.2282    204.959     13.5329     204.959     
1 1 1 37 7  48 o 10 28.0515 7.65497 5.50675     16.4043  32.424      16.7323  15.9133    305.019     3.38593     305.019     
1 1 1 37 7  49 o 14 20.7207 6.77995 -1.90785    16.4261  2.38007     16.8401  3.96881    191.723     1.72572     11.7225     
1 1 1 37 7  50 o 19 17.8554 6.06252 -18.4162    15.2988  -2.80656    16.2225  1.37689    62.1967     10.0325     242.197     
1 1 1 37 7  51 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 7  52 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 8  0  o 12 36.0274 5.83255 27.1459     9.1722   27.1459     9.1722   35.742     180         17.6712     180         
1 1 1 37 8  1  o 12 16.5208 5.11528 -2.22046    8.13835  0.581547    8.07005  1.86187    8.29273     3.73037     188.293     
1 1 1 37 8  2  o 8  89.9484 3.00307 147.868     13.7427  146.817     13.2513  71.2933    344.34      7.0806      344.34      
1 1 1 37 8  3  o 17 51.6691 4.06506 55.9095     10.2412  44.4906     10.3045  47.6988    44.6422     20.7276     44.6422     
1 1 1 37 8  4  o 16 45.8665 4.34728 38.9243     9.69301  40.8313     9.78601  28.3481    138.407     10.3547     318.407     
1 1 1 37 8  5  o 3  30.564  5.72311 20.1442     8.91515  17.3883     8.92243  19.7986    83.7108     0.951596    263.711     
1 1 1 37 8  6  o 9  36.2619 5.20125 32.0813     9.23102  20.1546     9.03679  25.8913    200.527     1.27094     200.527     
1 1 1 37 8  7  o 5  74.3415 3.18709 110.049     11.7841  92.6972     11.7787  54.3097    239.362     2.81537     59.3618     
1 1 1 37 8  8  o 19 19.9823 5.65748 -0.437334   8.40209  8.96098     9.32362  2.30998    358.7       20.2135     178.7       
1 1 1 37 8  9  o 12 72.7062 3.39185 97.3943     11.8385  97.1985     12.7203  59.9393    18.4487     11.2918     18.4487     
1 1 1 37 8  10 o 4  44.7148 4.79997 39.2379     9.77417  37.9202     10.9854  26.9839    259.382     11.2694     79.3818     
1 1 1 37 8  11 o 11 49.874  4.44517 49.5807     10.3219  45.1894     11.2837  25.6791    129.946     22.3056     309.946     
1 1 1 37 8  12 o 18 72.5974 3.48657 95.5253     11.6878  99.2271     13.4877  67.2381    225.456     26.6013     225.456     
1 1 1 37 8  13 o 6  19.9355 5.72663 3.6973      8.32298  5.39283     9.56027  6.58938    164.571     0.686864    344.571     
1 1 1 37 8  14 f 0  27.1905 6.40475 15.0402     10.514   14.456      9.92607  25.7487    109.625     0           0           
1 1 1 37 8  15 o 18 45.074  4.91643 42.1743     10.4737  37.029      10.9392  44.8775    70.6477     27.4987     70.6477     
1 1 1 37 8  16 f 0  28.053  6.16084 10.7558     9.28248  21.3346     10.3316  31.2423    131.379     0           0           
1 1 1 37 8  17 o 9  61.5323 4.09253 74.114      11.659   68.9815     13.1359  56.0888    294.86      21.8865     294.86      
1 1 1 37 8  18 o 1  72.9011 3.72405 103.451     13.6828  95.2355     13.338   79.6408    131.529     52.5286     131.529     
1 1 1 37 8  19 o 4  29.1362 6.14258 24.6662     10.1781  9.903       10.3029  14.2153    126.833     11.254      306.833     
1 1 1 37 8  20 o 5  27.5899 6.33799 9.86628     8.86643  21.9689     11.5581  19.3759    33.2601     8.16253     33.2601     
1 1 1 37 8  21 o 15 26.9105 6.4686  12.3729     9.42313  17.3832     11.4371  18.0846    312.937     7.76853     312.937     
1 1 1 37 8  22 f 0  15.8494 5.15659 -12.1432    8.02776  1.59567     10.7449  10.3385    329.84      0           0           
1 1 1 37 8  23 o 2  72.7066 3.75029 93.0507     12.2826  106.071     14.8511  63.9491    281.014     20.7307     281.014     
1 1 1 37 8  24 o 2  73.4447 3.77278 101.913     12.2999  101.42      15.0852  71.4389    359.35      35.1643     359.35      
1 1 1 37 8  25 o 8  25.6981 6.61905 15.1791     9.78185  9.78024     13.0748  15.3685    55.7269     0.674453    55.7269     
1 1 1 37 8  26 o 17 18.5732 5.83927 3.67552     10.0602  -9.32439    12.8951  3.87821    106.012     0.960818    286.012     
1 1 1 37 8  27 o 14 19.1853 6.09268 -8.23098    12.0795  3.64393     12.7356  6.17164    76.0043     3.67012     256.004     
1 1 1 37 8  28 o 19 23.1936 6.51777 -0.166118   12.3839  14.7416     11.6774  11.5628    248.877     1.77681     68.8772     
1 1 1 37 8  29 o 12 17.3331 5.56887 -13.69      10.9507  2.95817     11.0669  3.51551    280.444     4.74591     100.444     
1 1 1 37 8  30 o 7  17.976  5.78281 -0.978491   11.1377  -5.60896    11.8197  2.59168    77.7506     1.69246     257.751     
1 1 1 37 8  31 o 10 30.5444 7.23804 22.9125     12.063   18.9382     14.45    20.1883    35.3853     2.83614     35.3853     
1 1 1 37 8  32 o 10 37.5254 6.75923 41.2374     12.7002  21.9321     13.9424  22.3213    54.8626     6.67451     234.863     
1 1 1 37 8  33 o 4  29.0025 7.10163 17.7599     12.0605  19.858      13.0941  13.4672    181.569     10.2535     1.56861     
1 1 1 37 8  34 o 6  21.3389 6.39488 10.2225     11.8406  -3.74418    13.0359  7.01695    200.099     1.44198     20.0986     
1 1 1 37 8  35 o 4  24.7679 7.01733 9.28365     13.6461  12.6769     12.9421  12.479     5.72766     1.81776     185.728     
1 1 1 37 8  36 o 2  33.2445 7.30572 23.1005     12.6573  28.421      14.2652  25.5653    153.627     10.94       153.627     
1 1 1 37 8  37 f 0  50.6695 6.43363 55.5958     14.0389  55.0869     17.2241  25.7052    333.82      0           0           
1 1 1 37 8  38 o 15 20.4257 6.5295  -4.43411    14.456   1.7974      14.245   7.98129    172.096     5.57727     352.096     
1 1 1 37 8  39 o 5  35.2662 8.05418 28.0326     16.1085  33.394      16.4067  14.6536    333.078     19.0302     153.078     
1 1 1 37 8  40 o 6  38.3394 9.18461 49.0401     23.2964  32.659      18.7807  20.7891    330.16      10.5308     150.16      
1 1 1 37 8  41 o 19 25.6529 7.81856 7.50316     19.6313  13.4305     17.2555  7.48332    96.1718     18.0478     276.172     
1 1 1 37 8  42 o 18 57.3517 7.46133 62.377      21.2724  93.2252     19.2685  50.2802    257.001     20.7357     257.001     
1 1 1 37 8  43 o 5  27.9586 8.03751 11.9162     19.6071  23.3358     16.8583  15.5507    55.9219     2.95331     235.922     
1 1 1 37 8  44 o 12 45.3439 8.91385 49.1196     25.3051  68.305      19.5998  26.2881    222.128     9.47001     42.1279     
1 1 1 37 8  45 o 14 20.6451 6.91299 -0.479795   21.6361  -7.1674     15.7145  6.31991    348.574     2.60529     168.574     
1 1 1 37 8  46 o 15 27.3778 7.94038 19.8447     17.5716  19.6201     17.2468  5.94032    27.4566     2.99502     27.4566     
1 1 1 37 8  47 f 0  33.0726 8.41007 25.2541     19.2021  40.5954     17.8194  5.22549    74.7279     0           0           
1 1 1 37 8  48 o 11 38.7065 8.81435 60.0328     21.1005  34.5879     18.7569  27.6395    271.993     8.14196     271.993     
1 1 1 37 8  49 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 8  50 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 9  0  o 7  89.2472 2.97936 144.167     13.2574  144.167     13.2574  92.379     360         48.4335     360         
1 1 1 37 9  1  o 17 34.139  5.5983  24.3408     9.65483  22.8582     9.12981  29.816     235.133     15.6943     235.133     
1 1 1 37 9  2  o 1  49.0681 4.23671 45.8445     10.1244  45.7363     10.2789  39.9329    186.188     8.01019     186.188     
1 1 1 37 9  3  o 9  26.5138 5.91227 10.6396     9.22586  17.1959     8.71486  12.3694    214.156     10.8058     34.1556     
1 1 1 37 9  4  o 18 43.8885 4.71993 31.6262     9.97921  43.473      9.89024  36.5659    220.5       9.94141     220.5       
1 1 1 37 9  5  o 18 32.2377 5.68495 21.6036     9.10031  20.7641     9.20851  20.3471    113.868     4.00309     293.868     
1 1 1 37 9  6  o 7  60.1644 3.67386 63.6007     10.9421  71.6529     10.9596  53.0887    34.7849     16.978      34.7849     
1 1 1 37 9  7  o 19 40.7408 5.02415 37.2771     9.92683  28.3696     9.76312  33.8303    39.233      9.80912     39.233      
1 1 1 37 9  8  o 8  27.8337 5.78705 9.94198     8.88482  21.3704     9.05998  19.3297    187.977     3.6976      187.977     
1 1 1 37 9  9  o 8  56.9733 3.80935 67.3449     10.6933  54.8711     10.6908  53.2249    183.101     22.6908     183.101     
1 1 1 37 9  10 o 13 56.2017 3.9377  63.4311     11.0647  55.88       10.8007  51.2956    31.2216     19.9755     31.2216     
1 1 1 37 9  11 o 5  20.1816 5.70599 6.73526     8.51741  3.83038     9.05456  7.50741    259.831     0.258841    259.832     
1 1 1 37 9  12 o 8  34.0066 5.92143 21.9039     9.65337  26.1159     10.415   26.4511    80.9652     6.66305     80.9652     
1 1 1 37 9  13 o 2  26.8238 6.11122 19.9168     9.46855  8.28296     10.3049  11.1298    53.4797     14.2057     233.48      
1 1 1 37 9  14 o 2  81.4385 3.46839 112.85      13.5816  134.362     14.5847  69.8472    255.229     17.6521     255.229     
1 1 1 37 9  15 o 13 59.793  4.03608 75.9826     11.2431  60.1524     12.2913  50.6746    175.823     12.9835     175.823     
1 1 1 37 9  16 o 13 29.9291 5.61425 3.8656      9.25727  33.0042     10.6792  16.2855    335.385     8.6639      155.385     
1 1 1 37 9  17 o 11 27.3959 6.32809 21.3085     9.8574   7.71854     11.8261  18.6996    263.634     9.35019     263.634     
1 1 1 37 9  18 o 5  46.001  5.06555 29.702      10.6231  56.3359     11.3303  47.4046    325.403     31.5319     325.403     
1 1 1 37 9  19 o 4  31.5275 6.41581 25.0545     10.5643  17.6412     11.1359  18.8367    293.471     5.42609     113.471     
1 1 1 37 9  20 o 13 22.7239 6.06073 2.13742     9.54829  14.814      10.2458  10.9266    309.412     2.98347     309.412     
1 1 1 37 9  21 o 19 18.4207 5.63151 2.85402     9.07866  -0.242171   10.0914  5.62124    218.06      6.23348     38.0601     
1 1 1 37 9  22 o 9  20.9712 6.26657 -0.0435717  11.9354  7.68794     11.1458  5.93274    325.299     1.10747     325.299     
1 1 1 37 9  23 o 11 28.7606 7.19295 11.9336     12.573   23.8933     13.8302  13.9176    132.042     10.5047     312.042     
1 1 1 37 9  24 o 11 45.3413 6.03081 51.4676     12.6111  35.5545     13.5365  32.2225    211.819     0.413358    31.8189     
1 1 1 37 9  25 o 19 32.4921 7.71602 27.7103     12.052   18.3693     20.7123  22.2564    239.555     2.29706     239.555     
1 1 1 37 9  26 o 18 31.7864 7.05113 20.7328     12.1055  25.0526     12.9299  20.6595    304.55      0.303692    124.55      
1 1 1 37 9  27 o 3  18.8542 6.18559 -2.70338    13.2565  -10.2054    14.9752  3.99114    38.1773     2.13587     218.177     
1 1 1 37 9  28 o 19 22.8275 6.82585 2.14901     11.6781  11.7003     15.1548  7.8754     156.119     11.0538     336.119     
1 1 1 37 9  29 o 7  27.3305 7.25909 18.1469     12.23    12.6729     15.4135  15.6157    75.8071     0.524448    255.807     
1 1 1 37 9  30 o 6  28.9343 7.4746  18.6964     12.572   18.8719     15.8477  18.1858    142.702     5.40982     142.702     
1 1 1 37 9  31 o 9  24.6155 7.34167 -4.83972    11.7091  24.7984     19.5699  9.1898     170.13      11.4402     350.13      
1 1 1 37 9  32 o 16 29.8354 7.11839 28.038      12.3557  8.0887      16.2694  17.1302    297.483     4.05534     117.483     
1 1 1 37 9  33 o 15 30.2625 7.2713  27.4581     12.6649  11.8682     15.9996  18.5515    79.5805     1.73296     259.58      
1 1 1 37 9  34 o 10 18.3419 6.04572 -0.731059   14.0648  -14.5325    13.4541  5.37097    216.47      5.717       36.4704     
1 1 1 37 9  35 o 17 38.4389 7.81925 49.0263     16.0364  21.3724     19.2191  33.9304    84.4006     18.518      84.4006     
1 1 1 37 9  36 o 15 31.7526 8.05585 19.583      17.8098  28.6677     15.6335  12.3666    53.3759     18.5012     233.376     
1 1 1 37 9  37 o 8  17.8092 5.9736  -11.4666    14.1188  -8.76134    14.5484  4.84183    211.581     1.95077     31.5807     
1 1 1 37 9  38 o 6  29.4978 8.04024 20.5379     16.5065  21.3933     17.0953  18.2993    150.939     0.597324    330.939     
1 1 1 37 9  39 o 13 27.7499 7.67316 5.55328     17.1135  26.3998     16.0036  18.5822    130.588     6.77204     130.588     
1 1 1 37 9  40 o 15 30.9591 8.22579 25.2072     17.2551  25.2183     17.359   19.6309    113.987     12.6833     113.987     
1 1 1 37 9  41 o 14 20.5858 6.72222 -6.12784    16.1088  2.50682     16.4687  7.83326    276.012     2.71636     96.0121     
1 1 1 37 9  42 o 8  19.3304 6.45983 1.21019     17.6167  -13.7177    15.0684  4.92429    50.4519     2.10185     230.452     
1 1 1 37 9  43 f 0  21.4205 7.02565 5.14977     17.8966  -5.27823    18.4255  5.09849    177.174     0           0           
1 1 1 37 9  44 o 5  26.2346 8.0847  2.11021     24.5394  24.8097     18.8258  12.7269    78.5255     1.45469     78.5255     
1 1 1 37 9  45 o 14 29.8817 8.8351  42.6197     24.9291  17.7079     19.3015  15.4447    232.296     6.14213     232.296     
1 1 1 37 9  46 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 9  47 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 10 0  o 2  11.5122 5.41201 -1.52684    8.35457  -1.52684    8.35457  9.44067    360         33.5767     360         
1 1 1 37 10 1  o 2  31.498  6.05244 21.5569     9.80056  20.1942     9.80923  10.3018    160.416     24.595      340.416     
1 1 1 37 10 2  f 0  44.7762 4.75559 35.4248     10.4133  43.4335     10.1278  31.6236    293.88      0           0           
1 1 1 37 10 3  o 5  24.2019 5.92744 14.3231     8.93374  8.3174      8.87816  14.4041    257.658     5.44314     257.658     
1 1 1 37 10 4  o 14 24.0523 5.99866 10.5857     8.95694  11.8367     9.05044  1.20703    60.4995     31.0807     240.5       
1 1 1 37 10 5  o 3  30.8861 5.85978 16.1012     9.3      23.855      9.44539  19.5254    76.5927     3.59231     256.593     
1 1 1 37 10 6  o 14 25.5971 6.02901 10.8144     9.04203  15.6624     9.22676  3.18693    114.684     29.5036     294.684     
1 1 1 37 10 7  o 18 26.9409 5.99391 17.0898     9.1176   12.9291     9.04876  17.6303    90.4321     9.75235     90.4321     
1 1 1 37 10 8  o 6  36.9112 5.44917 32.2025     9.74659  23.6879     9.77878  12.274     258.421     29.4394     78.4205     
1 1 1 37 10 9  o 11 35.469  5.62271 29.8637     9.7521   22.2734     9.80875  25.7886    30.596      1.73431     30.596      
1 1 1 37 10 10 o 12 22.4352 5.89639 4.3126      9.40403  12.6948     8.94136  8.22759    343.994     12.2803     163.994     
1 1 1 37 10 11 o 15 48.1178 4.74242 42.0638     11.4775  49.1175     10.5685  40.2985    250.893     10.4389     250.893     
1 1 1 37 10 12 o 7  30.8631 6.24407 16.558      9.85082  24.4223     10.6319  11.9609    128.324     19.6939     308.324     
1 1 1 37 10 13 o 5  25.1629 6.30047 10.877      10.5977  14.2643     9.47802  14.8966    308.883     0.930353    128.883     
1 1 1 37 10 14 o 14 27.6125 5.8056  23.866      9.23585  6.71614     9.86791  18.6835    33.3557     10.5249     33.3557     
1 1 1 37 10 15 o 10 44.4008 4.75408 38.6147     10.2248  39.523      10.2698  33.7576    353.162     3.1936      353.162     
1 1 1 37 10 16 o 14 22.1792 5.99672 16.305      10.1641  -9.45293    12.2747  11.1203    240.889     1.83793     60.8894     
1 1 1 37 10 17 o 17 20.6928 5.70666 13.4863     9.28097  -8.24592    10.8142  9.11654    14.808      2.081       194.808     
1 1 1 37 10 18 o 18 44.0537 6.10202 41.1675     12.6107  41.0622     13.3605  41.7248    70.5475     22.3178     70.5475     
1 1 1 37 10 19 o 18 27.8634 6.87862 21.3097     11.7003  11.2        12.7874  8.974      89.1522     20.2016     269.152     
1 1 1 37 10 20 o 3  33.7337 6.89804 29.3034     11.9321  21.8125     13.1208  28.033     38.7158     15.2683     38.7158     
1 1 1 37 10 21 o 1  18.156  5.80329 -0.336286   10.9082  -4.2627     11.7486  2.86762    125.227     14.1063     305.227     
1 1 1 37 10 22 o 7  21.104  6.44605 0.697121    12.9051  5.98301     12.2154  8.22983    249.772     2.15911     69.7719     
1 1 1 37 10 23 o 4  31.9737 7.12546 19.2635     12.8537  27.6        12.9689  20.2657    339.719     1.75697     159.719     
1 1 1 37 10 24 o 14 23.321  6.81041 13.0427     12.6796  1.14925     14.1659  9.8683     93.2026     6.9539      273.203     
1 1 1 37 10 25 o 3  20.3645 6.21894 -7.15331    12.1942  9.49935     12.1961  6.68778    9.10085     5.21414     189.101     
1 1 1 37 10 26 o 17 31.1325 7.23747 25.3965     13.2739  19.5072     12.9974  18.9399    140.294     2.28095     320.294     
1 1 1 37 10 27 o 6  23.0203 6.96349 2.24308     16.3381  9.14478     12.8446  6.89621    206.345     14.1709     26.3455     
1 1 1 37 10 28 o 8  21.8738 6.58419 8.02505     12.917   2.69499     12.4981  9.16169    57.6248     3.55839     237.625     
1 1 1 37 10 29 o 14 63.7289 5.23208 74.1471     15.842   91.3386     16.8874  56.7449    277.273     21.0449     277.273     
1 1 1 37 10 30 o 5  31.022  8.18855 17.8311     17.4726  27.9104     17.2106  21.5269    296.962     12.4259     296.962     
1 1 1 37 10 31 f 0  22.6138 6.93256 15.7444     16.051   -13.3795    15.2192  36.1335    24.4256     0           0           
1 1 1 37 10 32 o 17 23.9606 7.05297 -14.9047    15.3424  22.012      16.3097  11.8988    242.891     5.53454     62.8912     
1 1 1 37 10 33 o 1  22.8598 7.47769 8.23979     20.0717  -21.1926    22.2932  10.5554    194.282     5.58674     14.2825     
1 1 1 37 10 34 o 13 35.4476 9.07913 16.2596     18.4335  55.1703     24.7051  24.579     305.225     2.07606     305.225     
1 1 1 37 10 35 o 16 25.5488 7.9778  10.9292     16.4182  6.9626      24.4988  9.43842    255.64      14.0683     75.6398     
1 1 1 37 10 36 o 7  23.8713 7.66821 6.9115      17.2529  -0.203285   23.4506  4.38781    269.892     2.16588     269.892     
1 1 1 37 10 37 o 4  20.7606 6.99467 -22.5916    16.48    6.98205     22.2732  2.67627    56.8899     20.6244     236.89      
1 1 1 37 10 38 o 11 23.3419 7.59947 4.17989     17.5367  2.03583     23.7405  8.16421    176.04      2.77874     176.04      
1 1 1 37 10 39 f 0  31.6177 8.92747 23.6024     18.6026  38.5864     23.9887  6.6368     71.0237     0           0           
1 1 1 37 10 40 o 6  20.4751 6.74341 -1.30649    16.8162  -1.53739    16.9101  6.46608    354.563     6.76394     174.563     
1 1 1 37 10 41 o 4  22.2474 7.12143 14.2672     17.8117  -6.01508    17.078   5.7552     12.922      0.329624    12.922      
1 1 1 37 10 42 o 3  31.879  8.83495 29.0254     21.3344  38.2087     20.3176  14.3295    313.038     8.48792     313.038     
1 1 1 37 10 43 o 9  21.9794 7.13084 -0.368113   18.0459  9.17641     17.8774  3.97278    247.557     0.626518    67.5569     
1 1 1 37 10 44 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 10 45 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 11 0  o 10 11.3377 5.38924 -2.46333    8.69846  -2.46333    8.69846  2.72873    8.63579e-06 13.9721     8.63579e-06 
1 1 1 37 11 1  o 11 53.183  4.4239  55.8486     11.917   54.4771     11.2066  37.2187    324.571     4.84412     144.571     
1 1 1 37 11 2  o 3  21.0262 5.80041 12.0214     9.36616  0.203742    9.28521  6.63737    256.881     13.0653     76.8808     
1 1 1 37 11 3  o 19 25.8531 5.94765 5.09193     9.70344  21.1194     9.6362   13.2208    209.612     7.82532     29.6125     
1 1 1 37 11 4  o 14 45.433  4.99298 38.5612     10.9347  44.316      11.0224  25.902     349.12      15.4344     169.12      
1 1 1 37 11 5  o 11 40.301  5.36301 33.7576     10.3924  32.8308     10.4741  25.9935    218.024     6.62515     38.0243     
1 1 1 37 11 6  o 5  47.1514 4.89215 46.7859     11.0372  41.9856     11.3348  42.6496    127.799     16.9576     127.799     
1 1 1 37 11 7  o 9  38.9159 5.63417 35.7275     10.3934  27.5217     10.8273  25.0228    30.1379     6.18543     210.138     
1 1 1 37 11 8  o 1  21.2198 5.74538 13.5911     9.27293  -1.83606    9.49155  9.94002    227.286     3.10678     47.286      
1 1 1 37 11 9  o 11 56.1346 4.41558 67.8335     12.248   55.3912     12.0614  45.9568    204.568     8.60887     204.568     
1 1 1 37 11 10 o 7  17.6964 5.47551 4.42797     9.54121  -5.0601     9.42589  4.8745     129.226     4.08447     309.226     
1 1 1 37 11 11 o 10 22.4733 6.12272 13.0525     10.1213  3.81118     9.94415  10.767     235.377     4.70221     55.3767     
1 1 1 37 11 12 o 17 19.8511 5.94201 -5.4745     10.127   10.0054     11.2729  6.46426    141.93      9.38808     321.93      
1 1 1 37 11 13 o 6  48.7158 5.54258 54.6311     12.9137  43.4401     13.0624  31.7332    86.8037     8.21933     266.804     
1 1 1 37 11 14 o 1  22.0141 6.37966 4.29593     11.7819  9.2132      10.9119  10.1852    138.092     0.555636    318.092     
1 1 1 37 11 15 o 18 20.209  6.25384 5.35963     13.3257  -0.733947   10.6736  7.02637    11.5732     7.26031     191.573     
1 1 1 37 11 16 o 19 18.3039 5.68934 -15.8449    11.4723  7.70625     10.8397  4.40693    131.772     9.47089     311.772     
1 1 1 37 11 17 o 17 22.1726 6.40431 10.0052     12.0006  4.95289     10.5637  6.68336    192.289     1.5498      192.289     
1 1 1 37 11 18 o 4  23.8821 6.64103 14.0877     12.1754  6.50785     11.3553  12.247     167.725     0.605011    347.725     
1 1 1 37 11 19 o 7  23.1391 6.50467 6.34642     12.0804  11.6317     10.826   10.3598    188.937     1.26046     188.937     
1 1 1 37 11 20 o 16 20.8312 6.37447 7.15753     11.8611  -1.77275    13.1626  7.21005    9.73757     6.65333     189.738     
1 1 1 37 11 21 o 4  30.3846 7.32114 23.4073     12.9401  19.3328     13.9729  19.2206    278.604     0.17806     98.6038     
1 1 1 37 11 22 o 18 28.0682 6.80183 27.9197     12.685   2.63345     13.8253  15.5674    357.014     8.17786     357.014     
1 1 1 37 11 23 o 8  52.2358 6.0559  46.2319     14.6359  71.0699     15.6479  46.6466    224.169     18.44       224.169     
1 1 1 37 11 24 o 5  25.3784 7.10949 16.6982     12.542   5.63589     15.6798  14.5318    272.573     1.06168     272.573     
1 1 1 37 11 25 o 16 30.3539 7.3757  17.6613     12.9771  25.3879     14.2719  20.5764    99.0321     2.30963     99.0321     
1 1 1 37 11 26 o 18 19.7349 6.38436 -1.8967     15.2581  -3.19773    12.9857  6.11434    274.066     9.89096     94.0658     
1 1 1 37 11 27 o 7  25.6967 7.58151 -1.44089    18.2598  19.453      16.3283  15.8883    223.568     4.33872     223.568     
1 1 1 37 11 28 o 18 27.8197 8.02679 5.17286     18.5632  24.5483     18.2361  18.3429    134.197     2.64833     134.197     
1 1 1 37 11 29 o 12 28.4841 8.45147 14.1636     22.8845  19.3931     18.4958  9.71265    214.982     6.402       214.982     
1 1 1 37 11 30 o 15 25.7207 7.75032 23.616      19.5437  -4.29279    17.0727  15.239     279.767     6.56785     279.767     
1 1 1 37 11 31 o 15 27.337  8.10156 21.4771     19.9866  10.0816     17.4368  15.1376    184.75      4.57925     4.75046     
1 1 1 37 11 32 o 9  19.5496 6.50584 -8.31323    16.6365  -5.78207    16.1783  7.25627    101.185     0.607512    281.185     
1 1 1 37 11 33 o 2  25.1709 7.61242 8.02099     17.3168  14.655      16.9985  13.8846    230.761     2.58166     50.7612     
1 1 1 37 11 34 o 3  46.4984 8.33919 50.3768     19.7633  63.6967     19.4585  36.5876    149.91      8.12566     149.91      
1 1 1 37 11 35 o 13 19.3084 6.47192 -4.36418    17.3732  -10.2878    16.0958  6.39705    35.8344     5.8836      215.834     
1 1 1 37 11 36 o 14 26.218  7.90504 13.5365     18.4933  18.2874     18.2019  14.9776    76.6767     1.45706     76.6767     
1 1 1 37 11 37 o 14 29.1992 8.16108 36.0146     18.7798  10.0098     19.0041  18.5826    294.925     7.09        294.925     
1 1 1 37 11 38 o 3  25.3519 7.49292 31.5018     18.1935  -12.1069    18.3457  5.33466    129.382     2.29172     129.382     
1 1 1 37 11 39 o 8  34.4377 8.80141 47.7769     19.8307  29.6452     20.7503  23.6199    250.604     5.08469     250.604     
1 1 1 37 11 40 o 16 24.0133 7.81083 12.3872     18.5879  5.94538     25.8689  7.48864    171.854     0.433026    171.854     
1 1 1 37 11 41 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 11 42 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 12 0  o 7  62.2826 4.40162 73.9357     13.3998  73.9357     13.3998  48.2669    180         0.82608     180         
1 1 1 37 12 1  o 16 20.3234 5.83044 12.0537     10.3202  -3.40364    9.44432  6.4927     64.9109     0.0917252   64.9107     
1 1 1 37 12 2  o 14 22.1527 6.13457 4.74438     10.3973  11.3777     9.81927  9.27214    356.346     7.80683     176.346     
1 1 1 37 12 3  o 6  32.4881 6.57624 23.0471     11.1501  24.1726     11.3543  22.7248    247.617     1.36793     247.617     
1 1 1 37 12 4  o 15 27.3381 6.5166  17.2981     10.8776  15.2683     10.28    5.91484    131.158     3.75554     131.158     
1 1 1 37 12 5  o 3  17.5941 5.49097 -1.44455    9.78122  1.46223     9.24439  3.79413    28.1659     3.3383      208.166     
1 1 1 37 12 6  o 3  32.4863 6.28654 29.4222     10.8463  17.2351     10.7799  20.4313    276.337     4.03244     96.3368     
1 1 1 37 12 7  o 11 26.7865 6.63847 15.6898     11.846   15.3017     10.2167  10.0016    142.045     16.2768     322.045     
1 1 1 37 12 8  f 0  35.09   6.40787 28.0308     11.1159  26.5086     11.5963  14.44      356.441     0           0           
1 1 1 37 12 9  o 11 25.462  6.46478 16.479      10.3528  10.1585     11.0359  10.9748    327.964     11.2223     147.964     
1 1 1 37 12 10 o 10 41.6079 6.47322 41.4337     13.9461  34.998      12.3318  39.9129    342.478     24.3552     342.478     
1 1 1 37 12 11 o 8  25.5467 7.1612  13.7699     14.0225  11.8577     13.2548  14.2938    308.653     3.22341     308.653     
1 1 1 37 12 12 o 3  36.9166 6.70009 35.5986     13.1641  26.207      11.8572  23.0264    296.748     6.05754     116.748     
1 1 1 37 12 13 o 10 37.4854 6.67409 39.398      13.2718  24.5355     12.13    28.1954    206.735     4.56849     206.735     
1 1 1 37 12 14 o 3  18.0979 5.74596 -19.0346    14.0004  5.16752     10.357   3.28128    102.35      2.92507     282.35      
1 1 1 37 12 15 o 7  27.6466 7.02576 18.9255     12.7091  15.0874     12.1337  16.804     191.753     0.113533    11.7529     
1 1 1 37 12 16 o 16 32.7944 6.83707 36.8579     13.1459  11.7735     13.4517  12.0237    286.239     22.3236     106.239     
1 1 1 37 12 17 o 15 35.156  6.95795 24.7052     13.5671  32.2615     12.3026  14.8714    315.054     20.3439     135.054     
1 1 1 37 12 18 o 4  19.3702 6.02755 -2.37879    12.3843  4.00103     10.6589  6.47732    322.697     4.86243     142.697     
1 1 1 37 12 19 o 6  24.7223 6.79687 15.7688     12.8167  8.13767     11.5208  10.8453    126.184     9.93864     306.184     
1 1 1 37 12 20 o 9  30.8049 7.07211 22.3208     13.0157  21.6207     11.9791  21.9284    153.607     3.70942     153.607     
1 1 1 37 12 21 o 16 38.289  7.33262 30.2619     16.1203  38.5919     13.343   26.4167    47.5677     1.16191     227.568     
1 1 1 37 12 22 o 7  29.235  7.5882  26.4639     16.9195  14.0915     12.2119  17.272     276.925     4.40739     96.9251     
1 1 1 37 12 23 o 17 49.081  7.7985  63.2485     18.9983  51.8247     18.4947  40.4873    13.1412     10.2521     13.1412     
1 1 1 37 12 24 o 17 21.0884 7.13043 -11.4922    23.7673  -11.7225    18.409   6.71249    210.195     12.6787     30.1948     
1 1 1 37 12 25 o 12 21.0734 6.80978 -6.73742    16.3113  3.1879      16.0945  7.88306    156.443     9.80661     336.443     
1 1 1 37 12 26 o 6  61.4904 6.96755 101.57      20.565   70.5743     20.314   43.2439    78.6153     4.16561     258.615     
1 1 1 37 12 27 o 18 54.4638 7.61579 64.3864     20.1729  77.5694     19.883   43.5808    49.7101     8.10351     49.7101     
1 1 1 37 12 28 o 19 28.7806 8.13441 8.18405     19.2482  29.3676     18.217   20.4874    301.251     6.86262     301.251     
1 1 1 37 12 29 o 10 48.7605 8.9075  76.5712     20.363   54.9958     25.7391  37.8579    57.5499     6.25759     57.5499     
1 1 1 37 12 30 o 2  42.092  8.44614 62.8178     19.6637  34.8093     19.4424  34.0019    268.273     9.69388     268.273     
1 1 1 37 12 31 o 3  25.6841 7.71618 31.331      20.2007  -10.8936    17.5164  14.8307    349.509     5.58111     349.509     
1 1 1 37 12 32 o 10 23.5291 7.51525 2.44765     20.3747  10.3239     17.8438  8.85392    38.7213     11.0982     218.721     
1 1 1 37 12 33 o 10 25.519  7.89835 14.5704     20.5328  14.2883     18.0133  12.0897    90.2896     6.53176     270.29      
1 1 1 37 12 34 o 9  20.8834 6.94393 0.819176    20.5627  -2.99032    16.3987  7.19006    14.0498     2.92231     194.05      
1 1 1 37 12 35 o 10 19.9551 6.70746 -17.9573    21.0249  2.16013     16.9654  4.78216    179.133     2.1937      359.133     
1 1 1 37 12 36 o 17 26.6441 8.09552 18.0414     20.3656  21.7476     18.7664  13.6127    253.975     2.19205     253.975     
1 1 1 37 12 37 o 16 21.9496 7.18545 8.15575     19.5354  0.95932     17.8027  5.86668    73.6795     1.38076     253.679     
1 1 1 37 12 38 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 12 39 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 13 0  o 6  21.1698 7.82351 13.7548     10.8775  13.7548     10.8775  9.49806    180         0.834833    180         
1 1 1 37 13 1  o 1  39.6094 6.18364 31.1932     11.8746  37.4918     12.0455  23.8083    53.2888     9.79        233.289     
1 1 1 37 13 2  o 4  20.9209 6.44807 -2.22915    15.814   6.33937     10.5918  8.04119    282.424     2.06613     102.424     
1 1 1 37 13 3  o 18 24.632  6.71133 11.7816     11.0448  12.4294     12.3728  13.3912    26.0088     1.76245     206.009     
1 1 1 37 13 4  f 0  25.9913 6.62972 2.01308     12.6284  23.1536     12.0422  12.4894    191.336     0           0           
1 1 1 37 13 5  o 9  32.5848 7.55091 23.6512     15.9008  27.2515     13.0319  25.7371    99.1235     11.5294     99.1235     
1 1 1 37 13 6  o 6  37.0486 6.8285  19.8655     14.2408  43.4575     13.1522  32.0651    100.401     14.4459     100.401     
1 1 1 37 13 7  o 1  89.2685 4.34368 182.624     19.1487  130.921     18.9919  81.2589    2.41265     27.1184     2.41265     
1 1 1 37 13 8  o 3  18.3957 5.92291 0.643319    12.7322  -5.27532    11.245   1.82685    138.682     18.2426     318.682     
1 1 1 37 13 9  o 1  24.8653 7.00397 12.9744     13.5004  10.8861     12.7141  14.1225    73.247      3.87061     73.247      
1 1 1 37 13 10 o 18 37.7655 7.54562 20.0141     15.7072  49.6465     16.4034  33.6207    209.893     17.1868     209.893     
1 1 1 37 13 11 o 13 37.2305 7.16555 28.0498     14.2699  36.9531     13.5184  29.565     155.244     7.46557     155.244     
1 1 1 37 13 12 o 11 23.179  6.5694  18.1764     13.2651  -2.05938    11.4032  9.20068    165.275     3.67977     165.275     
1 1 1 37 13 13 o 5  25.2334 7.20532 13.3851     16.2461  11.1455     11.9644  13.7218    134.66      4.26748     314.66      
1 1 1 37 13 14 o 15 21.4496 6.49834 2.84461     13.5251  6.57017     11.6185  10.3312    25.1988     2.64188     205.199     
1 1 1 37 13 15 o 17 42.2597 7.10392 28.3297     15.6189  55.4999     15.1531  37.8106    13.7796     15.9843     13.7796     
1 1 1 37 13 16 o 3  32.6988 7.76454 35.0344     17.6187  18.5825     12.5187  8.63143    122.768     29.8279     302.768     
1 1 1 37 13 17 f 0  30.3762 7.67215 18.7685     19.0816  23.6982     12.2189  16.0453    93.8359     0           0           
1 1 1 37 13 18 o 15 19.1195 6.31599 -1.31477    17.325   -7.56704    11.7511  7.46493    307.998     5.72869     127.998     
1 1 1 37 13 19 f 0  22.7544 6.8345  -7.95126    17.9965  13.044      12.3621  15.1326    145.126     0           0           
1 1 1 37 13 20 o 7  28.4513 7.48708 -0.43576    20.4073  27.9149     13.9615  8.9328     49.4102     21.9911     229.41      
1 1 1 37 13 21 o 15 31.3202 8.16618 39.5242     20.7076  13.3914     13.3454  3.46623    236.987     38.0083     56.9873     
1 1 1 37 13 22 o 7  38.1207 8.22892 39.8022     20.2282  36.6309     14.6307  32.4167    65.0951     12.857      65.0951     
1 1 1 37 13 23 o 11 34.8583 8.32168 35.9814     20.0108  29.9029     14.7397  26.0543    238.454     4.70516     238.454     
1 1 1 37 13 24 o 15 22.0642 7.01107 5.42006     18.8557  2.58858     13.3184  10.2116    59.8296     2.91935     59.8296     
1 1 1 37 13 25 o 7  23.8144 7.21748 25.1722     18.0942  -16.0173    15.8953  12.0014    258.176     5.58502     78.1757     
1 1 1 37 13 26 o 6  19.5748 6.64119 -4.9679     20.8879  -13.4592    15.831   7.69329    200.535     3.10554     20.5351     
1 1 1 37 13 27 o 7  31.5164 8.70871 12.7405     22.5877  42.9441     20.8783  22.7033    243.115     5.82539     243.115     
1 1 1 37 13 28 o 14 19.9996 6.66808 -3.51135    17.8038  -5.3989     16.9071  6.27116    330.079     9.61178     150.079     
1 1 1 37 13 29 o 14 51.1432 8.65154 83.1913     22.4729  64.6382     21.4947  47.5141    248.16      23.639      248.16      
1 1 1 37 13 30 o 8  27.5674 8.18617 28.8835     20.0449  13.9255     18.5945  16.6496    97.3381     3.77404     97.3381     
1 1 1 37 13 31 o 2  30.7064 8.40603 45.0866     20.3318  12.5393     19.4127  20.7543    208.074     8.1697      208.074     
1 1 1 37 13 32 o 17 27.2268 8.1973  30.6799     20.785   12.9191     18.8771  11.1777    178.5       11.819      358.5       
1 1 1 37 13 33 o 3  20.3534 6.7885  -1.38153    18.7251  -1.17475    17.3371  0.980293   191.359     0.253132    11.3587     
1 1 1 37 13 34 o 15 20.0262 6.68113 -21.0109    19.5402  8.37591     17.3399  4.23846    211.247     3.63188     31.2469     
1 1 1 37 13 35 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 13 36 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 14 0  o 2  75.2375 5.89099 112.832     21.5168  112.832     21.5168  68.2964    180         20.4753     180         
1 1 1 37 14 1  o 3  63.1196 5.99163 88.1914     19.8303  81.8178     17.0406  55.7039    187.895     16.4253     187.895     
1 1 1 37 14 2  f 0  57.7422 7.40458 58.5574     22.2423  96.3024     17.1198  18.1998    68.6494     0           0           
1 1 1 37 14 3  o 2  21.4463 6.62984 -10.8325    16.626   10.212      12.8425  10.2802    308.174     2.46358     308.174     
1 1 1 37 14 4  o 17 71.1062 5.70773 84.8909     19.9993  127.792     18.2284  76.022     6.56094     45.3622     6.56094     
1 1 1 37 14 5  o 18 35.4781 7.3304  46.9935     15.583   12.4643     16.1909  33.0466    233.966     21.6838     233.966     
1 1 1 37 14 6  o 1  31.6543 7.70456 27.6735     15.7685  21.5949     13.8354  18.3708    256.286     13.7478     256.286     
1 1 1 37 14 7  o 15 46.0279 7.77626 55.91       16.8976  46.7982     18.6966  36.9947    237.455     6.63341     237.455     
1 1 1 37 14 8  o 16 24.867  7.11054 15.6212     14.5406  8.0935      13.0084  15.5164    49.0082     6.96771     49.0082     
1 1 1 37 14 9  o 16 26.9845 7.65733 5.43428     15.9657  24.0635     16.7931  14.3013    173.358     7.83629     353.358     
1 1 1 37 14 10 o 18 55.6526 7.19343 66.7135     21.104   75.8831     16.9457  56.536     50.6435     31.557      50.6435     
1 1 1 37 14 11 o 16 37.9247 8.26136 47.0799     19.5827  28.7604     15.0605  29.0144    25.5474     4.39154     25.5474     
1 1 1 37 14 12 o 15 39.7904 8.26012 18.3408     32.5186  56.2694     16.0559  31.1404    8.90073     5.62793     8.90073     
1 1 1 37 14 13 o 16 27.3581 7.55602 2.90615     20.0978  23.7614     13.9541  19.782     266.836     8.40796     266.836     
1 1 1 37 14 14 o 2  26.0531 7.79655 22.5462     20.4837  5.96194     14.3817  16.2691    217.213     0.0956102   37.213      
1 1 1 37 14 15 o 5  33.8492 9.04084 28.2209     21.9959  37.7694     20.5804  19.0055    225.139     9.55756     45.1394     
1 1 1 37 14 16 o 1  31.5856 8.35742 23.7734     21.5899  28.8723     15.6213  19.7814    285.53      3.8187      105.53      
1 1 1 37 14 17 o 19 25.6817 7.69623 23.18       19.8191  4.72111     14.3845  15.3371    3.85022     1.65629     183.85      
1 1 1 37 14 18 o 1  23.6472 7.14062 -14.1966    19.7299  18.7212     14.9475  13.5346    158.999     4.67489     158.999     
1 1 1 37 14 19 o 1  29.0505 8.15265 20.663      20.9364  22.8465     15.3815  21.2563    7.56096     6.74345     7.56096     
1 1 1 37 14 20 o 12 22.9027 7.25809 7.32629     20.0253  5.21546     14.3737  6.63257    207.191     16.9387     27.1915     
1 1 1 37 14 21 o 17 22.9514 7.25769 11.6612     20.1369  3.49975     13.6613  4.05519    58.1558     22.6102     238.156     
1 1 1 37 14 22 o 6  35.1388 7.94738 12.9726     22.2943  51.0901     17.0235  24.6277    252.363     0.842602    252.363     
1 1 1 37 14 23 o 8  20.4209 6.74832 7.93236     19.6635  -7.80315    13.4139  7.98887    325.22      1.59593     145.22      
1 1 1 37 14 24 f 0  20.6735 6.79218 -7.01806    21.3341  3.71126     13.8495  7.81147    152.809     0           0           
1 1 1 37 14 25 f 0  28.6818 8.05959 13.6935     21.5628  30.5841     16.3688  18.3168    48.5522     0           0           
1 1 1 37 14 26 o 5  28.8216 8.83289 25.1729     22.6548  30.4551     24.4371  17.4122    296.529     6.71776     296.529     
1 1 1 37 14 27 o 2  29.7643 8.25627 19.4362     21.979   33.7867     16.9124  10.9965    53.7897     18.0804     233.79      
1 1 1 37 14 28 o 18 22.7281 7.34317 -23.9987    20.2369  25.154      20.3905  7.6992     303.841     0.167647    303.841     
1 1 1 37 14 29 o 12 26.226  8.11814 19.9802     22.4911  20.0341     18.5069  9.45717    119.682     3.33845     119.682     
1 1 1 37 14 30 x 18 ?       ?       ?           ?        ?           ?        2.21868    318.454     0           0           
1 1 1 37 14 31 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 14 32 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 15 0  o 1  30.2085 10.8258 33.0145     20.4186  33.0145     20.4186  28.4213    2.64462e-05 13.2494     2.64462e-05 
1 1 1 37 15 1  o 17 59.2726 8.23415 84.4946     23.789   94.0795     23.3493  65.7976    45.5157     45.594      45.5157     
1 1 1 37 15 2  o 7  24.0767 7.43199 -5.86119    17.7528  18.8958     17.8145  14.8892    261.049     2.70955     261.049     
1 1 1 37 15 3  o 8  35.63   8.90216 -36.3391    49.1527  58.4494     20.9617  22.6651    312.758     5.37466     132.758     
1 1 1 37 15 4  o 7  26.5222 8.09575 -8.01889    26.6672  23.8257     18.2679  10.8136    311.489     14.7996     131.489     
1 1 1 37 15 5  o 4  34.7627 9.19016 19.5467     29.0824  48.9875     21.0215  29.1789    299.034     12.7693     299.034     
1 1 1 37 15 6  o 16 38.5777 8.97067 42.2219     31.6665  45.9349     15.8504  20.1637    184.836     15.8976     4.83623     
1 1 1 37 15 7  o 1  57.723  9.68647 112.817     36.6544  84.5697     19.2     57.1682    127.478     29.952      127.478     
1 1 1 37 15 8  f 0  28.4041 9.4413  36.3007     57.4987  13.1292     18.5058  9.67253    306.418     0           0           
1 1 1 37 15 9  o 1  25.4295 7.73369 19.4366     19.9733  7.60956     15.4047  15.6607    100.027     0.344047    280.027     
1 1 1 37 15 10 o 9  22.5559 7.10754 -16.1428    23.3629  12.472      14.0703  11.927     133.505     3.513       133.505     
1 1 1 37 15 11 o 15 43.1694 10.0643 74.4036     35.3133  55.8568     19.3122  31.686     257.705     1.30304     257.705     
1 1 1 37 15 12 o 10 29.0319 8.21902 34.705      21.1416  12.9096     15.1461  17.2837    235.905     4.58013     55.9053     
1 1 1 37 15 13 o 10 23.9988 7.44604 19.8816     19.7459  1.60272     14.3311  13.4769    285.653     4.43311     285.653     
1 1 1 37 15 14 o 17 25.409  7.92369 12.5954     20.7419  13.9274     18.7429  8.68121    185.163     4.69482     185.163     
1 1 1 37 15 15 o 4  18.2558 6.18814 -8.91462    19.1138  -7.94927    12.7976  5.27025    139.372     8.82285     319.372     
1 1 1 37 15 16 o 13 27.1286 8.00772 20.5433     21.5459  18.4891     15.301   17.7444    88.7534     4.14981     88.7534     
1 1 1 37 15 17 o 8  20.0683 6.4773  -26.136     20.1927  9.74032     13.5223  7.42916    194.521     1.11589     14.5212     
1 1 1 37 15 18 o 12 24.2343 7.35159 1.87692     20.1981  18.1558     14.5557  10.638     12.3934     9.15913     192.393     
1 1 1 37 15 19 o 10 24.4765 7.57362 10.9408     21.38    14.5179     15.0182  4.32163    251.172     1.96422     251.172     
1 1 1 37 15 20 o 4  26.1242 7.71895 7.71961     21.3418  24.0971     15.5782  12.5479    58.8876     5.35748     58.8876     
1 1 1 37 15 21 o 19 19.9426 6.61961 -5.64341    20.5212  1.56254     13.7743  3.57568    216.698     16.2376     36.6978     
1 1 1 37 15 22 o 17 22.5356 7.18686 2.44466     20.9994  11.4384     14.832   9.0599     53.2572     0.585639    233.257     
1 1 1 37 15 23 o 3  25.6117 7.83846 28.3842     21.0252  9.42937     15.7216  9.00756    280.662     3.35715     280.662     
1 1 1 37 15 24 o 14 21.5574 7.04213 9.5813      20.1465  1.78721     15.1448  3.04057    271.61      0.00359677  91.6105     
1 1 1 37 15 25 o 2  21.3247 7.00919 14.7578     20.7259  -3.709      14.4033  4.49708    161.439     0.805635    341.439     
1 1 1 37 15 26 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 15 27 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 15 28 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 16 0  o 2  22.0226 10.9626 6.34256     47.4257  6.34256     47.4257  11.8347    5.54997e-05 0.00613022  180         
1 1 1 37 16 1  o 11 30.4771 9.63516 48.6897     30.458   20.6303     31.4062  21.5712    303.162     8.48671     303.162     
1 1 1 37 16 2  o 11 24.8582 8.41321 -13.9235    33.1308  18.3525     28.5947  13.1099    129.425     3.52177     309.425     
1 1 1 37 16 3  o 18 29.0944 9.52523 16.9694     38.3204  39.6458     30.7099  17.0863    123.576     3.44234     303.576     
1 1 1 37 16 4  o 16 32.1084 9.30339 14.5682     39.4212  48.3888     22.1558  21.0534    162.23      0.950195    342.23      
1 1 1 37 16 5  o 9  27.519  9.06749 39.4471     37.9273  12.8967     22.552   17.2462    48.1347     3.02574     48.1347     
1 1 1 37 16 6  o 13 27.854  9.16572 47.1946     36.0296  8.20678     24.3543  16.3011    67.6418     6.93161     67.6418     
1 1 1 37 16 7  o 9  26.3687 9.05103 -59.2753    121.875  17.3729     22.4471  11.7185    302.045     5.03382     302.045     
1 1 1 37 16 8  o 15 24.8489 8.25676 -6.18644    33.8547  17.9024     22.8721  9.7001     308.923     3.80357     308.923     
1 1 1 37 16 9  o 1  26.0514 8.76276 58.335      36.3927  -14.559     20.2974  14.399     286.916     1.63454     106.916     
1 1 1 37 16 10 o 8  25.4204 8.50124 7.569       36.1443  16.2641     23.9005  10.6112    346.249     4.04225     346.249     
1 1 1 37 16 11 o 3  27.9831 9.13984 45.5246     37.4964  17.2555     22.3044  13.1608    58.0797     10.2681     238.08      
1 1 1 37 16 12 o 8  23.1099 7.77256 8.61398     35.8315  5.06818     15.3449  6.97928    26.3807     1.71563     26.3807     
1 1 1 37 16 13 o 15 20.7853 7.1266  -22.3752    36.1377  0.565219    14.6377  6.07849    83.7449     0.764381    263.745     
1 1 1 37 16 14 o 10 24.8958 8.41905 41.7827     36.3352  -1.48197    18.6575  12.4251    47.3362     0.165785    227.336     
1 1 1 37 16 15 o 13 19.2285 6.52766 5.06171     20.8322  -11.1267    13.6836  5.19134    23.4683     6.96991     203.468     
1 1 1 37 16 16 o 10 19.535  6.49404 -12.2726    20.1608  3.98949     14.1321  0.637968   177.87      0.158709    357.87      
1 1 1 37 16 17 o 13 20.5926 6.86685 6.07647     21.3354  -2.19956    14.8328  3.83943    47.01       0.670899    227.01      
1 1 1 37 16 18 o 16 24.4792 7.70949 14.6681     22.7083  15.5832     16.3414  10.9155    220.901     0.732147    220.901     
1 1 1 37 16 19 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 16 20 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 16 21 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 16 22 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 16 23 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 0  x 0  ?       ?       ?           ?        ?           ?        5.504      180         0           0           
1 1 1 37 17 1  o 14 28.8231 13.7776 46.1143     39.6555  0           0        9.74858    231.597     0.877381    231.597     
1 1 1 37 17 2  o 17 25.5763 12.4883 18.6763     37.1741  0           0        8.84215    10.803      5.93739     190.803     
1 1 1 37 17 3  o 13 26.5119 12.8765 26.9319     38.0909  0           0        3.12007    153.209     0.195266    153.209     
1 1 1 37 17 4  f 0  26.4923 9.31949 6.99847     37.4553  64.063      56.7708  7.30109    293.386     0           0           
1 1 1 37 17 5  o 19 23.6538 8.44906 -23.2031    34.6581  23.0732     55.1225  9.59584    207.589     1.05893     27.5891     
1 1 1 37 17 6  o 8  23.1556 11.8009 0           0        -32.7133    54.5323  5.67493    286.752     10.1007     106.752     
1 1 1 37 17 7  o 1  29.9742 10.3263 74.2605     44.785   69.7739     61.429   17.8227    164.331     3.54676     164.331     
1 1 1 37 17 8  o 18 24.3022 8.62816 2.21437     37.7611  0.000879427 57.5534  4.35498    16.6079     0.988706    16.6079     
1 1 1 37 17 9  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 10 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 11 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 12 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 13 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 14 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 15 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 37 17 16 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 0  0  o 6  24.1466 8.56603 15.5732     12.7154  15.5732     12.7154  0.902834   180         7.96664     180         
1 1 1 38 0  1  o 11 55.3219 4.36152 56.8869     11.7073  56.8869     11.7073  50.4137    60          17.3973     60          
1 1 1 38 0  2  o 12 44.8299 4.61626 38.2662     9.7298   38.2662     9.7298   36.5274    120         5.85803     120         
1 1 1 38 0  3  o 3  53.5564 3.92216 52.9512     10.2453  52.9512     10.2453  26.4849    180         27.8674     360         
1 1 1 38 0  4  o 2  39.5084 5.95479 31.6681     10.3606  31.6681     10.3606  27.1986    240         4.45967     60          
1 1 1 38 0  5  o 14 56.7523 4.19185 59.5812     11.5968  59.5812     11.5968  57.7083    300         30.043      300         
1 1 1 38 0  6  o 9  49.7106 5.07769 47.1515     11.8826  47.1515     11.8826  53.461     180         36.1608     180         
1 1 1 38 0  7  o 18 68.3315 3.59258 84.8418     12.1424  84.8418     12.1424  68.324     240         33.6316     240         
1 1 1 38 0  8  o 11 15.1369 6.48511 4.16405     9.09188  4.16405     9.09188  4.11758    120         16.5336     120         
1 1 1 38 0  9  o 14 17.9248 6.97784 8.28861     9.07218  8.28861     9.07218  0.227318   180         6.25653     180         
1 1 1 38 0  10 o 10 18.3519 6.86503 8.97175     8.45464  8.97175     8.45464  0.607912   240         14.0124     240         
1 1 1 38 0  11 o 10 114.505 2.75788 234.453     15.7839  234.453     15.7839  104.225    300         36.1501     300         
1 1 1 38 0  12 o 9  20.0009 7.08504 10.8294     8.69239  10.8294     8.69239  0.517181   6.45064e-07 19.0087     180         
1 1 1 38 0  13 o 3  57.0932 3.73924 59.8375     10.476   59.8375     10.476   44.2153    240         38.9903     240         
1 1 1 38 0  14 o 17 23.9273 7.46091 15.0877     9.38552  15.0877     9.38552  5.94587    120         2.7489      300         
1 1 1 38 0  15 o 18 17.9059 6.98877 8.29593     9.12709  8.29593     9.12709  0.757504   180         14.0218     180         
1 1 1 38 0  16 f 0  34.2521 6.68326 25.5799     9.92006  25.5799     9.92006  13.2869    60          0           0           
1 1 1 38 0  17 o 7  49.6422 4.48357 46.4467     10.657   46.4467     10.657   23.2668    120         27.8173     300         
1 1 1 38 0  18 o 19 63.8407 3.80669 74.6361     11.9721  74.6361     11.9721  71.6102    180         47.8559     180         
1 1 1 38 0  19 o 5  48.1866 5.21764 44.8102     11.7233  44.8102     11.7233  51.4246    240         38.5741     240         
1 1 1 38 0  20 o 1  130.934 2.98663 307.201     19.5509  307.201     19.5509  100.074    120         4.6398      120         
1 1 1 38 0  21 o 16 73.919  4.08799 100.064     14.9245  100.064     14.9245  94.3207    180         79.4235     180         
1 1 1 38 0  22 o 5  13.7471 6.1638  1.63589     9.18978  1.63589     9.18978  8.20348    60          28.1737     60          
1 1 1 38 0  23 o 9  20.5664 7.38482 11.6164     9.51192  11.6164     9.51192  0.782536   120         28.1275     120         
1 1 1 38 0  24 o 12 53.8135 4.12179 53.9148     10.7857  53.9148     10.7857  62.1399    4.69209e-06 46.3158     4.69209e-06 
1 1 1 38 0  25 o 18 18.8991 7.33237 9.50285     9.98091  9.50285     9.98091  3.55608    240         30.9983     240         
1 1 1 38 0  26 o 3  17.9346 6.97779 8.4822      9.06655  8.4822      9.06655  1.42241    120         22.3426     120         
1 1 1 38 0  27 o 15 17.0858 6.98795 7.03986     9.70657  7.03986     9.70657  3.55669    180         26.1506     180         
1 1 1 38 0  28 o 6  17.1625 6.83426 7.51701     8.94074  7.51701     8.94074  0.604947   60          5.15613     240         
1 1 1 38 0  29 o 18 12.258  5.66265 -0.534952   8.54263  -0.534952   8.54263  1.02131    300         3.58646     300         
1 1 1 38 0  30 o 10 12.0162 5.60867 -1.37569    8.71512  -1.37569    8.71512  1.36258    180         4.6918      180         
1 1 1 38 0  31 o 4  46.5676 4.74294 41.6346     10.4022  41.6346     10.4022  9.6458     240         49.1723     60          
1 1 1 38 0  32 o 9  77.3795 3.36806 108.714     12.9461  108.714     12.9461  75.0255    300         36.4852     300         
1 1 1 38 0  33 o 19 37.9098 6.13015 30.0215     10.1452  30.0215     10.1452  16.8818    0           21.7649     180         
1 1 1 38 0  34 o 19 50.5889 4.94719 49.1788     11.8591  49.1788     11.8591  45.8099    240         17.6504     240         
1 1 1 38 0  35 o 18 21.4445 7.50917 12.9062     9.71175  12.9062     9.71175  8.84983    300         9.84475     120         
1 1 1 38 0  36 o 15 9.31474 4.65169 -9.96587    8.76093  -9.96587    8.76093  2.2014     180         6.48102     180         
1 1 1 38 0  37 f 0  11.4792 5.48955 -3.69657    9.2894   -3.69657    9.2894   10.055     60          0           0           
1 1 1 38 0  38 o 8  45.6107 5.60123 41.5811     11.6469  41.5811     11.6469  36.3286    120         6.49227     120         
1 1 1 38 0  39 o 15 59.8972 4.27065 67.3618     12.4968  67.3618     12.4968  43.8366    180         0.964432    180         
1 1 1 38 0  40 o 10 48.1737 5.09888 45.4588     11.4973  45.4588     11.4973  25.1596    60          19.2661     240         
1 1 1 38 0  41 o 1  13.5809 6.21112 0.888958    9.92453  0.888958    9.92453  0.0481795  300         0.873609    120         
1 1 1 38 0  42 o 4  30.873  7.77628 23.9304     10.9663  23.9304     10.9663  18.5528    360         7.02518     180         
1 1 1 38 0  43 f 0  17.8769 7.23908 8.67669     10.2631  8.67669     10.2631  2.84785    60.0001     0           0           
1 1 1 38 0  44 o 8  12.4682 5.88039 -1.89549    9.99976  -1.89549    9.99976  6.59115    120         26.3686     120         
1 1 1 38 0  45 o 3  35.9154 7.20286 29.6027     11.2278  29.6027     11.2278  26.3399    180         1.60094     180         
1 1 1 38 0  46 o 13 35.0858 7.60722 29.2536     11.6904  29.2536     11.6904  19.0341    240         11.8228     60          
1 1 1 38 0  47 o 6  51.4262 6.00781 53.6964     14.2143  53.6964     14.2143  41.6724    120         10.3036     120         
1 1 1 38 0  48 o 7  12.267  5.85825 -3.2998     10.5087  -3.2998     10.5087  2.59484    180         11.0937     180         
1 1 1 38 0  49 o 4  95.9827 4.08942 171.051     19.5053  171.051     19.5053  75.2456    240         14.8827     240         
1 1 1 38 0  50 o 9  28.8954 8.67947 23.5517     12.75    23.5517     12.75    21.6783    300         5.28758     300         
1 1 1 38 0  51 o 17 89.1974 3.96304 147.541     17.5528  147.541     17.5528  85.0196    180         44.7119     180         
1 1 1 38 0  52 o 11 64.4998 4.92396 80.2187     15.4471  80.2187     15.4471  52.6775    240         14.9868     240         
1 1 1 38 0  53 o 12 14.5449 6.73628 0.762184    12.2029  0.762184    12.2029  0.580871   120         1.65751     300         
1 1 1 38 0  54 o 17 20.2603 8.19207 12.4716     13.1153  12.4716     13.1153  8.94922    180         1.10334     360         
1 1 1 38 0  55 o 7  21.7224 8.45945 15.1141     13.3395  15.1141     13.3395  4.6393     60          1.3355      60          
1 1 1 38 0  56 o 18 34.9998 10.9208 40.0323     20.108   40.0323     20.108   17.1627    120         14.0175     300         
1 1 1 38 0  57 o 3  22.2848 9.35105 17.2331     18.1475  17.2331     18.1475  6.28978    180         15.0592     8.66242e-06 
1 1 1 38 0  58 o 9  18.4392 8.39832 7.7818      17.8997  7.7818      17.8997  1.04202    60          1.73322     240         
1 1 1 38 0  59 o 10 30.9619 10.6276 34.4327     19.3024  34.4327     19.3024  17.4271    300         5.35299     120         
1 1 1 38 0  60 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 1  0  o 19 15.8979 6.93428 3.93687     10.82    3.93687     10.82    5.55847    0.000104272 24.4969     0.000104272 
1 1 1 38 1  1  o 12 64.6388 3.97862 66.5013     12.5403  86.982      12.8132  49.3267    311.396     5.00424     311.396     
1 1 1 38 1  2  f 0  64.3549 3.7283  77.2217     11.8717  73.7244     11.9576  62.6973    309.774     0           0           
1 1 1 38 1  3  o 10 26.7381 5.66902 1.95268     9.37195  22.3869     9.36661  10.2802    293.523     6.05194     113.523     
1 1 1 38 1  4  o 8  108.323 3.16253 198.563     17.5043  224.97      16.6346  80.1469    354.207     1.26971     174.207     
1 1 1 38 1  5  o 15 50.0805 4.61619 40.3809     10.9919  53.3508     11.4901  42.8965    180.714     17.5816     180.714     
1 1 1 38 1  6  o 16 67.5544 3.64322 91.2771     12.8568  75.2114     11.6254  35.6753    299.986     27.925      119.986     
1 1 1 38 1  7  o 4  82.3194 3.22203 115.429     13.1563  129.707     13.2958  70.7464    70.2912     20.6547     70.2912     
1 1 1 38 1  8  o 18 119.75  2.86445 260.26      17.1801  255.4       17.1497  98.0438    153.965     17.463      153.965     
1 1 1 38 1  9  o 10 24.0147 5.77178 4.95441     8.63781  14.4505     8.67257  2.16595    343.45      23.7291     163.45      
1 1 1 38 1  10 o 15 60.5751 3.62008 68.0663     10.8076  65.7558     10.959   50.1604    171.421     13.745      171.421     
1 1 1 38 1  11 o 11 51.0559 4.09823 51.1433     10.275   45.1037     10.2839  41.4428    99.6973     11.9353     99.6973     
1 1 1 38 1  12 o 13 43.7996 4.56301 32.5834     9.68699  39.3563     9.6644   37.9899    14.7058     23.346      14.7058     
1 1 1 38 1  13 o 3  23.9647 5.86316 6.93492     8.68037  12.7918     8.74364  6.06233    54.0954     12.3815     234.095     
1 1 1 38 1  14 f 0  42.6852 4.65202 30.9583     9.61736  37.6603     9.56512  36.5109    168.265     0           0           
1 1 1 38 1  15 o 5  77.659  3.15729 106.4       12.2537  111.977     12.2101  53.4355    83.5242     7.168       263.524     
1 1 1 38 1  16 o 8  54.518  3.88763 53.9736     10.4035  55.3539     10.5496  49.7149    109.782     24.0684     109.782     
1 1 1 38 1  17 o 10 68.8631 3.41501 84.6492     11.7896  87.9499     11.6236  43.0214    268.045     14.5097     88.0448     
1 1 1 38 1  18 o 4  74.2312 3.3894  106.618     12.8944  93.9815     12.1846  69.1201    23.7525     31.1025     23.7525     
1 1 1 38 1  19 f 0  79.3433 3.3521  113.155     13.2796  115.65      13.2546  46.4008    263.514     0           0           
1 1 1 38 1  20 o 9  99.259  3.01232 184.409     15.3326  171.834     14.5692  67.1742    295.97      12.2098     115.97      
1 1 1 38 1  21 o 5  32.4162 6.34382 17.6495     10.0505  24.1385     11.3392  20.5709    145.273     6.15756     145.273     
1 1 1 38 1  22 o 13 57.3054 4.23403 56.088      12.1541  65.968      11.6695  32.4501    26.2652     17.5967     206.265     
1 1 1 38 1  23 o 14 74.5853 3.61973 106.44      13.7856  97.1442     13.111   66.4691    296.703     25.3187     296.703     
1 1 1 38 1  24 o 11 25.7405 6.2324  7.31984     10.1503  16.0245     9.8055   2.36698    359.663     28.0023     179.663     
1 1 1 38 1  25 o 15 31.6752 6.19525 17.2482     10.2589  22.5165     10.1944  5.67705    137.105     31.4261     317.105     
1 1 1 38 1  26 o 15 81.5978 3.42392 121.758     14.0485  121.121     13.8274  65.4856    201.236     12.4404     201.236     
1 1 1 38 1  27 o 7  48.0654 5.41526 42.8883     12.3358  46.1832     12.8794  36.6299    145.093     6.96842     145.093     
1 1 1 38 1  28 f 0  22.3901 6.15839 9.38929     9.77146  3.98319     10.3535  35.8897    317.904     0           0           
1 1 1 38 1  29 o 17 56.3852 4.23115 63.3402     11.2133  55.4013     12.1683  53.9866    331.509     30.0208     331.509     
1 1 1 38 1  30 f 0  112.708 3.00334 219.879     16.4733  241.19      17.3961  91.5569    46.6612     0           0           
1 1 1 38 1  31 o 16 59.7902 3.95257 72.7659     11.8128  60.2814     11.5312  41.2422    127.37      3.0096      307.37      
1 1 1 38 1  32 o 14 35.9241 5.90085 22.3838     10.2665  29.497      10.641   25.2034    125.72      3.12496     125.72      
1 1 1 38 1  33 o 2  19.7075 5.80875 1.23398     9.94411  4.56187     9.22284  5.86187    151.512     36.8483     151.512     
1 1 1 38 1  34 o 12 44.7164 5.0349  42.6614     10.8192  35.1149     10.8994  32.4222    40.2567     2.90264     40.2567     
1 1 1 38 1  35 o 10 19.9756 5.84312 4.7141      9.48568  2.70482     9.61647  5.1018     299.914     0.538773    119.914     
1 1 1 38 1  36 f 0  17.8726 5.52241 -0.473114   9.34166  0.226585    9.39727  5.4961     312.982     0           0           
1 1 1 38 1  37 o 18 19.9435 5.89518 5.31907     10.1125  1.46318     9.66162  6.05242    131.811     8.96278     311.811     
1 1 1 38 1  38 o 9  54.8301 4.89285 74.1488     11.9357  44.2989     13.0329  41.685     69.7038     6.39114     69.7038     
1 1 1 38 1  39 o 18 16.5462 5.38201 -1.40221    10.9453  -9.352      9.59546  2.31821    116.395     9.53771     296.395     
1 1 1 38 1  40 o 18 33.9976 6.27294 26.6308     10.8366  22.3601     10.8168  18.609     217.243     7.90939     37.2431     
1 1 1 38 1  41 o 8  24.5791 6.3509  7.15019     10.4052  15.2851     10.4377  9.27354    44.3186     11.3253     224.319     
1 1 1 38 1  42 o 8  21.4824 6.16874 6.22632     10.3762  6.37851     10.3842  1.09984    82.8828     29.1222     82.8828     
1 1 1 38 1  43 o 2  27.4507 6.3369  22.9968     10.7412  7.34997     10.7639  16.0685    314.931     0.960775    314.931     
1 1 1 38 1  44 o 2  38.6779 6.10105 28.4608     11.5873  34.9597     11.5013  18.9364    137.504     14.112      317.504     
1 1 1 38 1  45 o 17 28.6536 6.3061  27.6455     11.1875  5.30998     11.4547  17.2442    275.941     6.50532     275.941     
1 1 1 38 1  46 o 2  28.5018 7.02917 16.5476     12.275   18.7034     12.4129  13.7734    143.222     6.12769     323.222     
1 1 1 38 1  47 o 19 26.4625 6.95962 15.5359     12.1701  12.9045     12.5479  13.6717    52.7971     1.07015     232.797     
1 1 1 38 1  48 o 5  23.4618 6.74496 7.89862     12.289   9.31411     12.5697  5.12028    258.882     1.78401     258.882     
1 1 1 38 1  49 o 11 69.2745 4.57284 97.1401     15.8117  90.2278     15.5609  60.8009    38.7918     26.0855     38.7918     
1 1 1 38 1  50 o 10 40.5736 7.257   42.6539     15.2683  32.5773     14.387   33.9936    69.3035     16.6437     69.3035     
1 1 1 38 1  51 o 15 75.7704 4.53332 116.014     17.5543  109.083     16.5538  61.4408    354.887     18.1519     354.887     
1 1 1 38 1  52 o 4  59.4546 5.30013 64.2184     15.2332  80.8992     15.4319  46.4667    81.5171     12.0056     81.5171     
1 1 1 38 1  53 o 6  19.5937 6.32591 -7.42562    14.0176  2.21674     13.9148  4.37262    329.858     0.175525    149.858     
1 1 1 38 1  54 o 4  24.4151 7.17982 5.53998     14.7198  15.4891     14.7358  10.8924    315.159     4.15296     135.159     
1 1 1 38 1  55 o 12 33.0712 7.92719 25.2921     16.0293  32.7272     15.6029  17.0428    181.288     6.596       1.28832     
1 1 1 38 1  56 o 6  25.2652 7.42474 -1.57331    19.0035  22.0775     15.3009  8.60546    340.26      10.5054     160.26      
1 1 1 38 1  57 o 18 20.6456 6.87266 -12.5127    18.359   3.69296     18.6263  3.53102    97.5881     3.31403     277.588     
1 1 1 38 1  58 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 1  59 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 2  0  o 9  53.7785 4.54248 54.2852     11.7813  54.2852     11.7813  57.717     180         34.4957     180         
1 1 1 38 2  1  o 10 21.8218 6.10568 7.18697     9.99214  4.10417     9.8699   4.0273     111.407     9.02209     291.408     
1 1 1 38 2  2  o 14 45.5322 4.90802 34.2416     10.5397  44.2305     11.0726  37.5441    123.072     13.8261     123.072     
1 1 1 38 2  3  o 3  34.3222 5.87833 27.4985     9.89594  18.5584     10.3124  18.4718    154.951     7.6284      334.951     
1 1 1 38 2  4  o 3  116.763 2.92766 253.479     16.2619  237.924     17.8403  96.608     156.13      18.5879     156.13      
1 1 1 38 2  5  o 9  94.5279 3.19147 163.76      15.1198  159.526     15.029   76.7647    130.616     13.0617     130.616     
1 1 1 38 2  6  o 5  60.2189 3.80575 70.7395     11.1111  62.2946     11.5373  43.4478    154.887     0.399067    334.887     
1 1 1 38 2  7  o 18 69.7604 3.50033 88.2141     12.3556  89.0023     11.9535  36.9985    273.439     29.0187     93.4386     
1 1 1 38 2  8  o 6  92.4764 3.14698 149.211     14.1583  160.264     14.9281  76.7717    19.8697     16.4268     19.8697     
1 1 1 38 2  9  o 17 48.4472 4.34626 40.8063     10.2149  46.6576     10.3813  38.7543    289.36      31.5117     289.36      
1 1 1 38 2  10 o 7  31.2998 5.81727 23.2224     9.40085  15.0956     9.32707  16.7168    352.833     6.98621     352.833     
1 1 1 38 2  11 o 17 116.536 2.97632 250.16      17.4232  240.016     17.2807  122.758    227.167     72.7719     227.167     
1 1 1 38 2  12 o 17 30.763  5.94174 20.1828     9.68221  16.9063     9.17927  10.406     22.3744     19.5155     202.374     
1 1 1 38 2  13 o 10 40.0093 5.20744 34.5113     9.98609  27.0254     10.0693  32.8847    124.034     17.1151     124.034     
1 1 1 38 2  14 o 12 31.0385 5.68839 25.7786     9.27675  11.8758     9.27615  15.6825    5.89299     7.59469     185.893     
1 1 1 38 2  15 o 10 92.1894 3.01915 157.27      13.8498  150.132     13.9622  75.5852    315.745     14.9059     315.745     
1 1 1 38 2  16 o 6  36.4856 5.43768 33.8074     9.63778  18.5091     9.73201  14.9961    305.407     20.1794     125.407     
1 1 1 38 2  17 o 9  21.9104 5.86081 4.48411     8.88825  9.44474     8.95412  4.27946    326.931     13.7016     146.931     
1 1 1 38 2  18 o 15 87.3784 3.2757  140.992     14.1105  136.46      14.4629  77.4627    151.59      26.656      151.59      
1 1 1 38 2  19 o 9  86.4078 3.08331 138.148     13.218   132.5       13.3894  62.7206    55.4148     1.89117     235.415     
1 1 1 38 2  20 o 9  74.3696 3.43607 104.117     13.1236  97.732      12.3514  38.9693    142.15      31.4176     322.15      
1 1 1 38 2  21 o 3  21.3116 5.75468 10.6627     8.80358  0.362565    9.20743  4.27346    216.63      12.5272     36.6297     
1 1 1 38 2  22 o 14 80.8914 3.42218 126.366     13.6391  112.522     13.9208  61.0161    199.565     3.56819     199.565     
1 1 1 38 2  23 o 4  93.8488 3.34447 173.958     15.7057  147.365     15.5749  78.2762    163.421     18.7771     163.421     
1 1 1 38 2  24 o 15 27.3957 6.02717 23.9196     10.4869  2.53532     10.2197  7.88459    188.359     19.2382     8.35932     
1 1 1 38 2  25 o 16 62.6824 3.95343 73.4658     12.476   71.9487     12.101   18.9018    347.144     53.6981     167.144     
1 1 1 38 2  26 o 12 90.7864 3.42863 128.953     16.0268  173.768     14.472   84.9793    28.2609     37.6171     28.2609     
1 1 1 38 2  27 o 3  31.785  6.40298 20.0241     11.5836  20.5785     9.86363  22.1918    267.326     8.17824     267.326     
1 1 1 38 2  28 o 6  50.4814 5.23356 50.015      12.6035  48.251      13.069   34.7129    208.415     2.08219     28.4145     
1 1 1 38 2  29 o 7  74.9712 3.88818 98.0063     13.7156  110.472     15.31    73.7845    85.6758     39.8288     85.6758     
1 1 1 38 2  30 o 7  61.1123 4.25621 77.1582     12.8512  63.3851     12.7676  47.7593    257.438     7.84859     257.438     
1 1 1 38 2  31 o 16 43.0554 5.58788 28.7272     11.4967  45.424      11.5303  34.5273    346.636     10.0716     346.636     
1 1 1 38 2  32 o 12 33.5677 6.41389 24.9213     11.0572  21.642      11.0686  20.4086    132.217     3.82281     312.217     
1 1 1 38 2  33 f 0  18.7388 5.69189 4.3483      9.41751  -3.48236    10.2805  19.0143    222.516     0           0           
1 1 1 38 2  34 o 19 23.8679 6.35234 11.3446     9.8838   8.01791     10.9483  3.18223    173.502     1.50877     173.502     
1 1 1 38 2  35 o 4  31.7095 6.65551 24.9895     10.5803  16.8115     12.8251  6.68333    14.1333     30.1001     194.133     
1 1 1 38 2  36 o 8  93.1862 3.43981 159.77      15.806   162.178     16.2098  73.1422    210.838     11.5827     210.838     
1 1 1 38 2  37 o 3  21.766  6.22031 0.610592    9.93913  11.4358     11.5177  0.375283   352.457     28.5919     352.457     
1 1 1 38 2  38 o 9  34.5273 6.32694 21.6086     11.398   29.1348     10.8897  27.4671    31.7425     12.0985     31.7425     
1 1 1 38 2  39 o 12 15.7673 5.18539 -4.57655    9.78981  -8.38803    10.1091  0.350747   289.769     16.1088     289.769     
1 1 1 38 2  40 o 19 22.2463 5.87967 -6.86594    10.4125  17.2325     10.3327  9.92862    62.6993     0.831655    242.699     
1 1 1 38 2  41 o 10 53.9843 4.71717 49.2506     12.3293  65.551      12.3707  47.9761    208.261     21.8066     208.261     
1 1 1 38 2  42 o 13 19.3753 5.89472 3.62184     10.3421  0.785312    10.3937  3.93097    114.366     1.82023     294.366     
1 1 1 38 2  43 o 5  16.9097 5.51684 -5.48367    10.2849  -4.49999    11.4516  1.79027    21.9143     7.76164     201.914     
1 1 1 38 2  44 o 2  65.9754 4.51359 86.4289     14.7618  83.3532     14.7086  53.5484    0.0318653   15.2934     0.0318653   
1 1 1 38 2  45 o 4  28.9112 7.05661 19.4736     12.4758  17.2173     12.3789  17.2258    187.918     2.12664     187.918     
1 1 1 38 2  46 o 14 40.9397 6.95855 43.2438     15.0324  31.902      13.26    26.5496    6.66536     1.27844     186.665     
1 1 1 38 2  47 o 19 20.6104 6.33541 -1.64151    12.7409  5.60633     11.981   7.12214    175.615     6.48356     355.615     
1 1 1 38 2  48 f 0  19.3909 6.15605 -2.27314    12.4097  0.156374    12.4966  21.8962    44.2168     0           0           
1 1 1 38 2  49 o 10 18.5081 5.96422 -6.41693    11.7804  0.239466    12.6933  3.54582    268.372     12.7532     88.3717     
1 1 1 38 2  50 o 7  31.9732 7.46854 9.06819     13.4958  39.5392     16.6519  20.1412    236.086     0.488484    236.086     
1 1 1 38 2  51 o 16 22.9675 6.91061 15.4306     14.9607  -4.71156    14.2536  10.8294    249.941     1.11721     249.941     
1 1 1 38 2  52 o 16 30.7831 7.75295 16.8829     15.7507  29.7628     15.2925  13.5666    193.233     11.701      13.2332     
1 1 1 38 2  53 o 11 24.1402 7.18007 1.76873     15.4769  17.1803     15.0948  7.89076    62.6673     11.8007     242.667     
1 1 1 38 2  54 o 2  20.6829 6.55204 12.7321     15.2241  -13.7788    14.3857  4.36374    186.82      1.45021     6.81961     
1 1 1 38 2  55 o 2  22.7472 7.15859 4.78439     16.4757  8.94166     16.4578  3.00606    94.9699     0.00118319  94.9679     
1 1 1 38 2  56 o 5  29.5827 8.6352  17.6608     22.4721  33.4526     20.4894  12.6942    182.17      4.46897     182.17      
1 1 1 38 2  57 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 3  0  o 11 16.2924 6.67872 6.27195     8.898    6.27195     8.898    12.6439    180         46.8079     180         
1 1 1 38 3  1  o 1  24.6363 5.61565 21.1977     9.96646  -2.54835    8.6685   8.37274    109.316     1.25686     289.316     
1 1 1 38 3  2  f 0  26.1205 6.03083 11.1716     9.43764  14.1922     8.82968  22.8166    49.8816     0           0           
1 1 1 38 3  3  o 6  64.3852 3.75069 76.4402     11.9164  75.5559     12.071   35.4203    241.243     24.1622     61.243      
1 1 1 38 3  4  o 1  79.6912 3.57259 102.54      14.2089  129.933     13.9806  63.1892    324.14      8.39729     324.14      
1 1 1 38 3  5  o 17 46.7853 4.87648 45.8619     11.3194  37.124      10.8081  16.3653    9.21316     35.0305     189.213     
1 1 1 38 3  6  o 2  27.5271 6.12964 19.4575     9.84552  8.96618     9.70193  9.14026    346.771     2.87642     346.771     
1 1 1 38 3  7  o 12 117.757 2.98095 265.56      16.6364  235.801     18.2932  86.3957    35.5217     3.87448     215.522     
1 1 1 38 3  8  o 19 64.8206 3.79077 82.7313     11.7718  71.706      12.504   54.2309    252.199     14.1527     252.199     
1 1 1 38 3  9  o 11 35.4266 5.70617 21.8592     9.58009  27.407      10.2598  10.4788    16.1704     28.3628     196.17      
1 1 1 38 3  10 o 13 22.1175 5.81331 3.7906      8.66113  10.8472     8.92048  0.613518   247.516     25.0625     67.5161     
1 1 1 38 3  11 o 13 30.0359 5.66121 26.9672     9.42913  7.77977     9.46947  8.10671    127.473     23.9405     307.473     
1 1 1 38 3  12 o 5  30.2976 5.78936 25.0512     9.3513   10.6671     9.57877  15.4783    148.781     7.01835     328.781     
1 1 1 38 3  13 f 0  27.8106 6.02712 18.2293     9.3174   11.514      9.36247  17.5895    31.8536     0           0           
1 1 1 38 3  14 o 8  64.3791 3.6873  68.1639     11.7987  84.3578     11.6517  56.3964    230.525     19.6563     230.525     
1 1 1 38 3  15 o 11 77.3974 3.41895 105.828     13.0328  112.729     13.355   53.8603    120.243     6.57035     300.243     
1 1 1 38 3  16 o 16 15.4644 4.98902 -3.01197    8.65119  -6.5272     8.55369  3.61656    223.905     19.8993     223.905     
1 1 1 38 3  17 f 0  33.4036 5.87214 13.0056     10.7464  30.9773     9.86499  34.0477    161.699     0           0           
1 1 1 38 3  18 o 7  51.6339 4.46549 44.4814     10.9472  55.8181     11.6186  42.7203    329.937     12.6304     329.937     
1 1 1 38 3  19 o 3  89.9703 3.25524 131.938     14.4358  163.45      14.7147  74.8348    179.844     16.9093     179.844     
1 1 1 38 3  20 o 2  65.1608 3.92287 73.292      13.1202  83.7557     12.0947  57.1855    24.0881     20.3256     24.0881     
1 1 1 38 3  21 o 1  20.8402 5.88566 4.89869     8.93725  5.44324     9.62024  5.09305    351.914     36.4756     351.914     
1 1 1 38 3  22 o 13 48.1588 4.99493 46.1757     12.2793  42.5312     11.1166  29.7834    303.983     9.06586     123.983     
1 1 1 38 3  23 o 4  99.861  3.15909 179.481     15.5931  183.393     15.9462  83.042     350.69      18.6955     350.69      
1 1 1 38 3  24 o 6  25.3817 6.29285 10.2499     9.58224  13.3373     10.2371  10.7047    190.796     9.00805     10.796      
1 1 1 38 3  25 o 2  38.2895 5.54518 28.2105     10.3255  29.6108     10.238   14.5781    202.891     24.8054     22.8905     
1 1 1 38 3  26 o 9  44.5034 5.1557  32.3357     10.6183  44.9674     11.502   37.0232    58.292      12.5425     58.292      
1 1 1 38 3  27 o 10 57.8769 4.48234 60.9859     13.6487  65.765      11.695   59.5971    132.153     38.1009     132.153     
1 1 1 38 3  28 o 9  51.9628 4.75776 44.8294     12.4136  58.9789     11.288   34.7402    305.065     5.02581     125.065     
1 1 1 38 3  29 o 10 87.0702 3.34366 150.913     14.9278  128.228     14.1223  68.2607    221.322     9.12565     221.322     
1 1 1 38 3  30 o 4  47.2801 5.17774 39.0045     12.0929  48.7222     11.4191  22.5919    60.8933     22.4858     240.893     
1 1 1 38 3  31 f 0  23.6004 6.31389 10.5898     10.6558  8.425       9.82094  28.2225    295.599     0           0           
1 1 1 38 3  32 o 5  60.5832 4.23003 79.4019     13.1904  60.5566     12.0901  43.4273    232.633     0.32488     52.6325     
1 1 1 38 3  33 o 18 41.7598 6.2142  34.0127     13.227   38.3751     11.9419  37.7483    142.647     20.1074     142.647     
1 1 1 38 3  34 o 11 23.8457 6.39624 9.07721     10.9668  10.8282     10.1388  12.6832    269.124     0.473002    269.124     
1 1 1 38 3  35 o 10 16.1425 5.2758  -12.342     10.8969  -1.67047    9.70616  2.00057    21.721      21.9758     21.721      
1 1 1 38 3  36 o 11 63.3881 4.3593  75.8593     12.7986  78.7378     14.5052  46.4734    0.906368    2.33924     0.90637     
1 1 1 38 3  37 o 9  46.4543 5.54456 31.9564     11.7508  57.4126     12.7708  28.0545    296.669     8.96333     116.669     
1 1 1 38 3  38 o 19 57.9552 4.67624 70.2995     12.6901  61.1536     13.7634  43.4393    197.91      4.98114     197.91      
1 1 1 38 3  39 o 7  29.9237 7.09776 20.8776     11.2762  18.0403     14.2254  17.616     38.4009     1.76043     218.401     
1 1 1 38 3  40 o 12 49.601  6.10079 52.5521     14.0701  50.6735     15.1126  41.9221    73.7791     16.3701     73.7791     
1 1 1 38 3  41 o 9  47.7432 6.32382 44.6238     13.3677  52.7345     15.7972  46.4153    66.5619     34.951      66.5619     
1 1 1 38 3  42 o 14 24.835  6.88948 18.7762     13.2405  0.253071    13.5584  3.59845    235.816     23.7768     55.8163     
1 1 1 38 3  43 o 15 53.5357 5.77845 58.8144     14.2263  59.9399     15.7506  44.1824    293.295     15.1121     293.295     
1 1 1 38 3  44 o 18 23.1695 6.62662 14.2294     11.9156  -1.2036     13.5571  7.67355    109.889     2.00206     109.889     
1 1 1 38 3  45 o 6  22.4241 6.58438 12.1161     12.0762  -2.40942    13.6396  10.022     322.212     0.309554    142.212     
1 1 1 38 3  46 o 11 35.9146 6.93524 13.6436     13.1325  45.7478     14.949   22.9317    199.434     1.41661     19.4336     
1 1 1 38 3  47 o 5  30.1772 7.39134 18.6282     13.6354  23.0282     13.7124  16.5205    67.0694     5.16688     247.069     
1 1 1 38 3  48 o 15 21.3622 6.63266 8.54711     13.8279  -5.21943    14.2959  2.84493    81.3701     32.7772     81.3701     
1 1 1 38 3  49 o 8  28.1534 6.99289 -4.48947    14.9412  32.6554     14.6699  17.0551    270.143     0.614363    270.143     
1 1 1 38 3  50 o 18 33.6741 8.02119 31.0003     16.268   27.3998     15.8066  22.064     20.8377     2.18752     20.8377     
1 1 1 38 3  51 o 18 26.8434 7.55784 8.0862      16.0253  23.2695     15.6253  14.5157    252.025     0.164474    72.0252     
1 1 1 38 3  52 o 17 20.1956 6.57484 -11.5339    15.0167  7.01304     16.1809  3.32447    132.786     0.929177    312.786     
1 1 1 38 3  53 o 7  30.4595 8.04998 32.6764     16.6439  18.0163     17.7115  17.9998    66.817      5.42659     66.817      
1 1 1 38 3  54 o 10 32.1149 8.25226 20.9915     17.1696  39.3118     18.1657  18.8282    63.8425     7.91672     63.8425     
1 1 1 38 3  55 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 3  56 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 4  0  o 11 48.7337 4.60506 45.1668     10.6847  45.1668     10.6847  42.213     180         10.458      180         
1 1 1 38 4  1  o 2  19.8508 5.65156 6.5402      8.73976  1.23556     8.75284  0.487315   231.467     22.9623     231.467     
1 1 1 38 4  2  f 0  49.1612 4.30611 44.0379     10.3286  46.2846     10.4322  30.2732    52.142      0           0           
1 1 1 38 4  3  o 16 15.0844 4.91075 -6.5431     8.31487  -4.63457    8.80625  1.96942    280.281     12.676      280.281     
1 1 1 38 4  4  o 3  21.1185 5.84419 8.34175     9.27821  2.93378     8.8865   4.6619     163.048     4.6581      343.048     
1 1 1 38 4  5  o 8  33.4608 6.02595 24.7223     10.1562  19.7176     10.18    20.7529    216.204     1.65584     36.2042     
1 1 1 38 4  6  o 18 42.9531 4.9553  37.717      10.6542  32.7764     9.94557  37.4384    148.378     17.8369     148.378     
1 1 1 38 4  7  f 0  74.7277 3.51447 105.315     13.0034  98.882      13.1528  40.2044    216.705     0           0           
1 1 1 38 4  8  o 19 22.4358 6.06484 3.47366     9.65974  10.5919     9.73334  9.5156     272.948     48.8432     272.948     
1 1 1 38 4  9  o 15 44.1365 5.35399 33.6754     11.2433  41.6426     11.5414  26.8905    100.25      8.82049     280.25      
1 1 1 38 4  10 o 2  28.9853 6.36295 16.3885     10.1207  16.4989     10.2951  16.3744    8.13538     4.32281     8.13538     
1 1 1 38 4  11 o 2  79.9888 3.32292 113.632     12.7997  119.581     13.7237  67.4976    239.861     16.6221     239.861     
1 1 1 38 4  12 o 6  45.1523 5.41526 48.101      10.3291  31.2757     12.5031  32.6524    312.476     1.89967     312.476     
1 1 1 38 4  13 o 5  57.8257 4.12039 58.4338     11.1429  65.9449     12.4228  42.347     164.263     0.621414    164.263     
1 1 1 38 4  14 o 14 58.6763 4.01427 75.5827     11.3102  53.0134     11.5884  27.9958    104.411     30.2937     284.411     
1 1 1 38 4  15 o 14 46.5139 4.91763 33.9596     10.444   49.26       11.6724  27.1522    246.782     12.3286     66.782      
1 1 1 38 4  16 o 17 72.2235 3.61885 91.719      13.2074  99.9281     12.7722  61.3008    103.261     16.5906     103.261     
1 1 1 38 4  17 o 8  83.793  3.32948 134.428     13.5528  122.049     14.2244  61.3926    343.463     1.47295     163.463     
1 1 1 38 4  18 o 14 17.2524 5.38372 1.98016     8.88626  -7.39646    9.92322  1.12154    266.694     11.8144     86.6937     
1 1 1 38 4  19 o 12 53.4544 4.40903 50.2358     11.3004  57.3524     11.8663  44.9779    316.355     13.5228     316.355     
1 1 1 38 4  20 o 17 22.8865 6.13418 10.6267     10.1588  5.72089     9.29713  8.3931     216.155     8.8484      36.1554     
1 1 1 38 4  21 o 2  68.4074 3.95673 93.7112     13.6538  80.3097     13.2022  52.0392    132.247     3.77289     132.247     
1 1 1 38 4  22 o 16 71.3572 3.62957 89.9105     13.0062  98.0442     12.7427  64.8445    213.808     25.4668     213.808     
1 1 1 38 4  23 o 8  30.6983 6.32853 17.9391     10.0176  20.4101     10.6554  15.7001    186.917     9.6999      6.91672     
1 1 1 38 4  24 o 5  20.5802 5.93203 -1.58248    9.7414   9.04288     10.2166  7.70157    356.238     3.89866     176.238     
1 1 1 38 4  25 o 2  43.7797 5.26015 39.7148     11.3272  35.5326     10.925   40.4381    294.437     21.1794     294.437     
1 1 1 38 4  26 o 5  33.6954 6.17869 20.588      10.5653  26.1535     10.5708  25.4018    223.577     6.87377     223.577     
1 1 1 38 4  27 o 7  44.9528 5.32045 46.9715     12.0089  33.3754     11.0367  24.6802    66.8682     14.9486     246.868     
1 1 1 38 4  28 o 17 46.6259 5.03115 48.0754     11.3393  37.3279     11.2751  45.9713    162.548     28.5006     162.549     
1 1 1 38 4  29 o 8  30.4465 6.4406  7.29984     10.8828  30.9583     12.3488  16.0717    340.737     8.52382     160.737     
1 1 1 38 4  30 o 11 17.7593 5.53088 2.01115     9.52702  -3.85646    9.82768  2.99402    317.628     27.9696     317.628     
1 1 1 38 4  31 o 12 80.1774 3.45314 119.152     13.7437  119.818     13.8743  67.7098    45.2416     18.6448     45.2416     
1 1 1 38 4  32 o 3  50.0363 5.01154 49.7605     12.6388  49.0938     11.7744  46.9978    14.9913     24.4854     14.9913     
1 1 1 38 4  33 o 11 41.1659 5.87074 31.3472     12.0249  38.9387     11.3239  27.3154    308.287     2.55056     128.287     
1 1 1 38 4  34 o 10 22.8694 6.27602 14.4282     11.1722  1.90195     10.2163  8.95866    109.129     9.1343      289.129     
1 1 1 38 4  35 o 11 24.7085 6.37992 1.09148     11.7579  18.8627     10.9128  1.61078    243.989     36.2933     243.989     
1 1 1 38 4  36 o 3  25.7007 6.83011 11.2312     12.0797  14.5107     11.8727  10.022     148.38      12.0902     328.38      
1 1 1 38 4  37 o 2  79.6086 4.1511  136.259     17.1082  107.44      15.7303  65.6869    82.7092     17.008      82.7092     
1 1 1 38 4  38 o 15 26.3092 7.04545 14.7294     13.4206  13.1142     12.0827  11.8245    301.765     8.00146     121.765     
1 1 1 38 4  39 o 8  54.5244 5.93334 48.7704     15.5498  76.1179     14.9368  42.7038    282.823     9.53672     282.823     
1 1 1 38 4  40 f 0  25.2201 6.90396 10.8294     12.6367  13.4788     12.2824  12.8735    13.4084     0           0           
1 1 1 38 4  41 o 16 29.4991 7.00978 23.2718     12.3654  15.2086     12.5044  18.3933    298.535     8.6801      298.535     
1 1 1 38 4  42 o 6  21.0869 6.32863 -2.09422    11.9149  9.30736     11.9988  7.77714    71.6179     2.15301     251.618     
1 1 1 38 4  43 o 16 72.2918 4.39371 98.6363     15.6138  104.454     15.9094  61.7927    152.161     21.4674     152.161     
1 1 1 38 4  44 o 2  40.5536 6.69579 30.187      13.3817  42.8592     13.5335  28.911     343.527     3.21764     343.527     
1 1 1 38 4  45 o 3  19.1524 6.22825 -10.4973    13.7347  0.850923    14.0257  6.16287    121.767     6.66052     301.767     
1 1 1 38 4  46 o 7  24.2478 7.51966 5.70433     16.1746  7.8689      18.8031  11.6762    168.942     3.86458     168.942     
1 1 1 38 4  47 o 5  23.4263 7.21315 -12.7403    14.7137  20.6945     18.5801  9.41641    277.393     8.48113     97.393      
1 1 1 38 4  48 o 7  26.0832 7.45423 -7.77508    15.4219  29.7603     17.9969  9.14796    132.464     14.2292     312.464     
1 1 1 38 4  49 o 7  22.7121 7.23758 -8.48111    15.2005  15.9208     19.6368  9.58782    112.526     1.33653     292.526     
1 1 1 38 4  50 o 13 27.3726 8.03458 7.77897     16.3094  29.2689     20.2966  14.6096    303.551     3.86022     303.551     
1 1 1 38 4  51 o 14 24.062  7.43966 18.5988     16.6643  -5.14427    20.0965  8.71837    125.369     7.95207     305.369     
1 1 1 38 4  52 o 11 30.3254 7.97641 38.6404     16.8688  6.61862     21.5364  17.361     248.102     5.42081     248.102     
1 1 1 38 4  53 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 4  54 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 5  0  o 3  12.8511 5.8633  0.465271    8.77399  0.465271    8.77399  8.12389    360         28.4921     360         
1 1 1 38 5  1  o 4  35.1593 5.73549 28.1691     9.73812  20.7932     10.1561  9.11013    290.096     31.5684     110.096     
1 1 1 38 5  2  o 3  44.6207 4.79338 40.87       10.4022  35.0361     10.3153  35.9623    142.816     9.55383     142.816     
1 1 1 38 5  3  o 6  31.6746 6.05831 20.0418     9.61715  19.9677     10.0805  15.3751    83.9326     11.5626     263.933     
1 1 1 38 5  4  o 6  23.3022 6.09282 7.78537     9.54433  9.98911     9.34707  4.66497    170.832     19.0137     350.832     
1 1 1 38 5  5  o 19 47.649  4.54433 47.5575     10.6356  38.4005     10.4199  39.7106    254.538     12.1269     254.538     
1 1 1 38 5  6  o 14 34.1163 5.58128 13.7539     9.66828  32.8363     9.71884  7.72572    45.9611     32.7687     225.961     
1 1 1 38 5  7  o 1  26.9212 5.91331 20.1257     9.39635  7.1188      9.2836   7.78988    247.396     19.6614     67.3958     
1 1 1 38 5  8  o 3  21.0893 5.68191 -1.55133    8.89071  11.7827     9.04732  4.36167    288.103     14.4544     108.103     
1 1 1 38 5  9  o 19 45.4964 5.11765 42.9566     12.1209  36.7936     10.4505  36.4261    345.13      8.85376     345.13      
1 1 1 38 5  10 o 11 52.7953 4.52693 65.9755     11.4934  40.5108     11.3205  37.1341    14.9983     2.50013     194.998     
1 1 1 38 5  11 o 3  49.3714 4.68136 42.0971     11.549   50.5216     10.8287  44.0109    359.606     18.3176     359.606     
1 1 1 38 5  12 o 1  92.1655 3.29496 162.285     15.0978  147.945     15.2082  73.3899    230.304     9.00622     230.304     
1 1 1 38 5  13 o 10 73.0406 3.71995 100.23      13.4896  96.4952     13.5549  76.1731    355.85      45.705      355.85      
1 1 1 38 5  14 o 10 25.7337 6.42385 12.8034     10.1239  11.433      10.5474  13.4984    332.711     1.61752     152.711     
1 1 1 38 5  15 o 15 36.7956 6.18928 22.5122     11.1778  32.4052     11.4704  25.6197    277.271     1.05814     277.271     
1 1 1 38 5  16 o 3  100.724 3.24681 195.654     15.178   175.111     17.2679  86.9648    326.439     23.508      326.439     
1 1 1 38 5  17 o 2  19.3046 5.78672 3.22269     9.2319   0.449582    10.2706  4.47822    7.82292     11.0286     187.823     
1 1 1 38 5  18 o 3  47.57   5.10365 48.4137     10.8314  39.3719     12.3642  31.9774    301.115     4.70733     121.114     
1 1 1 38 5  19 o 14 22.0325 5.97793 -1.09218    10.3927  12.548      9.56773  5.36102    53.1185     16.8445     233.118     
1 1 1 38 5  20 o 15 45.1243 5.511   45.0361     12.5285  35.6673     11.4882  43.2606    327.252     24.6544     327.252     
1 1 1 38 5  21 o 7  41.0252 5.55415 38.1651     10.7281  29.0544     11.1967  28         348.536     2.02183     168.536     
1 1 1 38 5  22 o 6  25.0793 6.3078  10.8299     9.78119  12.719      10.1671  3.78579    129.646     26.2031     309.646     
1 1 1 38 5  23 o 9  51.0909 4.72069 59.8354     11.4086  41.4704     11.6948  31.9178    83.9586     10.3975     263.959     
1 1 1 38 5  24 o 19 22.083  6.30199 7.13962     9.80777  5.58203     11.799   6.83516    90.5367     13.4881     270.537     
1 1 1 38 5  25 o 17 67.464  3.90311 90.9579     13.3009  80.1949     12.8427  51.901     121.507     4.90083     121.507     
1 1 1 38 5  26 o 12 22.0949 6.0975  10.8994     9.93767  3.4209      9.99406  5.08068    6.05447     17.9666     186.054     
1 1 1 38 5  27 o 10 29.9953 6.35014 21.1073     10.3421  16.726      10.3401  16.7792    272.46      6.46663     92.4598     
1 1 1 38 5  28 o 9  56.6304 4.46538 74.548      12.3074  50.0924     12.1281  39.3958    77.2467     3.32245     257.247     
1 1 1 38 5  29 o 18 54.2206 4.8494  43.0181     12.4495  73.8832     12.252   33.0634    245.757     12.3435     65.7565     
1 1 1 38 5  30 o 7  40.0447 6.48974 28.7906     11.347   40.4357     14.2131  24.7653    285.917     6.39743     105.917     
1 1 1 38 5  31 f 0  27.3654 6.53068 14.3044     10.4603  17.1491     10.8163  17.9439    177.038     0           0           
1 1 1 38 5  32 o 7  23.2635 6.45029 9.04049     10.5874  9.34921     11.3312  9.31603    89.113      9.24646     269.113     
1 1 1 38 5  33 o 4  50.7483 5.47606 47.3647     13.2832  57.6093     13.603   25.2123    216.022     22.3076     36.0218     
1 1 1 38 5  34 o 7  30.4173 7.11008 21.2749     12.6014  19.9449     12.6094  21.2046    273.447     6.95891     273.447     
1 1 1 38 5  35 o 11 25.5659 6.84114 14.6959     12.0719  10.9298     12.0552  7.78428    234.197     16.8795     54.1968     
1 1 1 38 5  36 o 2  19.6033 6.1615  -2.17425    12.9874  1.94925     11.4463  1.52329    226.913     19.3338     46.9133     
1 1 1 38 5  37 o 8  21.126  6.45208 2.52789     13.1239  4.48915     11.9001  5.75507    148.16      10.7715     328.16      
1 1 1 38 5  38 o 7  54.7978 5.86525 52.0098     16.0048  73.5879     14.2275  50.5918    92.0986     25.8264     92.0986     
1 1 1 38 5  39 o 1  35.763  7.42546 20.8514     14.6441  38.9709     14.8342  24.2845    156.105     2.09106     156.105     
1 1 1 38 5  40 o 12 19.8874 6.36307 2.1147      14.5689  -5.12292    12.5565  6.49384    244.564     3.67876     64.5644     
1 1 1 38 5  41 o 15 28.5564 7.51309 23.1644     14.3563  11.275      15.3166  13.2416    0.182537    10.1401     180.183     
1 1 1 38 5  42 f 0  22.5185 6.99418 -2.14848    16.6451  7.58506     14.3955  1.0377     302.583     0           0           
1 1 1 38 5  43 o 14 39.9007 7.8263  43.5132     16.4963  33.491      16.1185  33.8002    222.276     16.0833     222.276     
1 1 1 38 5  44 o 7  23.3636 7.06827 13.1113     14.9995  -0.827344   15.2514  12.0197    129.089     0.0495835   309.09      
1 1 1 38 5  45 o 3  21.1916 6.75408 2.68973     15.0445  -0.998897   15.3004  8.71845    330.723     4.47964     150.723     
1 1 1 38 5  46 o 16 21.0701 6.76132 -6.7196     15.9675  5.8112      15.5211  8.6311     62.435      2.10398     242.435     
1 1 1 38 5  47 o 4  20.9355 6.72131 5.99254     15.3308  -5.8217     15.795   5.45285    64.251      12.3725     244.251     
1 1 1 38 5  48 o 12 25.8858 7.60434 21.4433     16.7162  7.52506     16.4868  10.5074    310.931     4.03542     310.931     
1 1 1 38 5  49 o 15 27.5506 7.38571 35.2994     16.5011  -5.97237    17.1598  14.3689    256.541     1.81828     76.5407     
1 1 1 38 5  50 o 10 20.9245 6.79363 -4.43485    15.7542  7.12935     16.8539  5.27636    116.027     7.22739     296.027     
1 1 1 38 5  51 o 5  32.2895 8.62793 29.3934     20.0916  36.1045     18.6016  16.2953    2.37774     5.89638     182.378     
1 1 1 38 5  52 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 6  0  o 2  54.2992 4.3036  55.3881     11.3335  55.3881     11.3335  63.9327    180         45.3106     180         
1 1 1 38 6  1  o 6  43.2728 5.00809 40.5099     10.4693  31.9399     10.4042  31.3214    247.626     0.834474    247.626     
1 1 1 38 6  2  o 3  48.1258 4.65009 45.5939     10.7566  42.5275     11.056   32.6334    292.1       4.79103     112.1       
1 1 1 38 6  3  o 3  50.5777 4.56297 45.1973     11.5906  51.8439     10.8709  31.8495    56.2787     10.497      236.279     
1 1 1 38 6  4  o 17 24.9409 6.11671 8.45213     9.47152  14.2183     9.45331  0.593298   156.464     35.2772     156.465     
1 1 1 38 6  5  o 10 21.7074 5.94097 6.19289     9.26418  7.47681     9.15342  8.3045     36.605      2.46895     216.605     
1 1 1 38 6  6  o 8  23.3854 6.00827 5.06792     9.44304  12.9641     9.27665  10.7433    228.101     3.89341     48.1014     
1 1 1 38 6  7  o 11 23.0661 6.04501 5.50771     9.37785  11.7637     9.48891  7.17615    67.6185     14.1825     247.618     
1 1 1 38 6  8  o 8  71.6314 3.60815 86.1334     12.6015  103.493     13.0848  59.3126    209.831     11.993      209.831     
1 1 1 38 6  9  o 2  32.7633 5.89741 12.5221     10.3257  30.8113     10.1675  15.1412    154.289     15.4481     334.289     
1 1 1 38 6  10 o 18 49.7675 4.60306 50.2694     11.3399  44.1632     11.0444  33.0849    130.389     6.6402      310.389     
1 1 1 38 6  11 o 8  89.5246 3.25549 149.598     14.1734  143.891     14.9083  62.0568    99.4585     10.4251     279.459     
1 1 1 38 6  12 o 12 29.2502 6.02746 14.5271     8.80334  20.1483     10.0148  20.9807    211.504     6.94162     211.504     
1 1 1 38 6  13 o 10 39.3994 5.45027 37.8955     10.0907  24.1297     10.553   33.907     206.048     13.6682     206.048     
1 1 1 38 6  14 o 13 27.6458 6.13117 12.2671     9.22441  18.3376     9.84604  18.4206    108.252     3.53166     108.252     
1 1 1 38 6  15 o 8  42.4484 5.13594 28.4661     10.1467  42.7441     10.7778  42.7152    107.059     30.3584     107.059     
1 1 1 38 6  16 o 18 119.921 2.95656 257.587     17.3766  266.94      18.1066  109.924    142.478     39.7523     142.478     
1 1 1 38 6  17 o 12 24.1183 6.04667 15.4029     9.05857  3.61808     10.6258  12.8759    175.738     2.63196     355.738     
1 1 1 38 6  18 o 10 24.012  6.0658  15.7961     9.05985  1.42765     11.4138  4.52503    76.8671     23.072      256.867     
1 1 1 38 6  19 o 15 50.3684 4.96507 53.0709     11.3422  45.8881     12.7628  38.0625    195.65      3.01066     195.65      
1 1 1 38 6  20 o 6  21.3281 5.80706 12.528      8.87849  -4.65293    11.0315  4.598      38.6009     17.8849     218.601     
1 1 1 38 6  21 o 16 25.6984 6.33176 12.1797     8.75593  13.7828     11.2974  9.58008    333.35      14.9192     153.35      
1 1 1 38 6  22 o 7  18.7521 5.70081 2.01117     8.29038  1.22099     11.0255  5.53092    267.199     8.76055     87.199      
1 1 1 38 6  23 o 13 77.2682 3.64444 110.558     12.7154  112.683     15.2295  61.9704    290.391     9.60843     290.391     
1 1 1 38 6  24 o 7  33.6262 6.14495 28.4327     9.60404  18.8626     11.8543  25.7276    18.2486     6.79308     18.2486     
1 1 1 38 6  25 o 18 29.8721 6.45033 15.399      9.28139  22.997      11.8548  22.5309    299.825     11.1755     299.825     
1 1 1 38 6  26 o 12 28.3827 6.41704 18.497      9.90057  15.4534     10.8678  17.1327    196.521     2.27567     16.521      
1 1 1 38 6  27 o 6  26.5412 6.47133 16.8502     10.3692  12.0289     10.7145  17.0022    354.522     3.73603     354.522     
1 1 1 38 6  28 o 17 23.9299 6.76203 7.76067     12.9854  10.8987     11.6825  12.1826    210.715     3.01857     210.715     
1 1 1 38 6  29 o 5  37.7067 6.52821 23.5079     12.2773  38.8436     12.62    28.8504    39.7293     6.66531     39.7293     
1 1 1 38 6  30 o 2  20.9354 6.33973 2.76824     11.3034  4.76199     12.3979  6.14991    184.05      11.8106     4.05013     
1 1 1 38 6  31 o 6  21.7688 6.4143  5.76451     11.3041  6.10374     11.9095  0.384998   9.56776     27.1371     189.568     
1 1 1 38 6  32 o 4  36.6099 6.86661 24.2119     12.408   36.1507     13.4619  15.2449    26.3819     20.3412     206.382     
1 1 1 38 6  33 o 5  55.5721 5.27046 63.4579     14.4066  61.6879     14.2096  40.9058    70.4345     2.53864     70.4345     
1 1 1 38 6  34 o 18 18.7387 5.95429 0.874551    11.1738  -3.95056    12.337   1.42214    187.199     17.5473     7.1991      
1 1 1 38 6  35 o 8  36.391  7.0732  29.2212     12.8057  31.3465     13.791   22.3991    49.4255     3.80824     229.426     
1 1 1 38 6  36 o 13 21.6903 6.61794 7.74463     13.7252  0.521468    12.604   7.3749     92.8353     0.433145    272.835     
1 1 1 38 6  37 o 15 32.9981 7.11164 31.4891     12.9103  18.0858     13.7435  21.6762    329.167     0.695213    329.168     
1 1 1 38 6  38 o 9  30.5563 7.50897 23.006      12.8935  19.514      15.6772  21.9444    349.354     10.827      349.354     
1 1 1 38 6  39 o 18 32.0458 7.7382  25.3396     14.5287  23.1661     15.3848  15.6311    287.59      11.5096     107.59      
1 1 1 38 6  40 o 12 30.8513 8.43172 23.0292     20.3957  22.4508     16.8156  16.9741    325.215     5.99674     145.215     
1 1 1 38 6  41 o 3  26.2879 7.61671 3.22954     18.7443  19.1678     15.1956  16.2184    215.404     4.38114     215.404     
1 1 1 38 6  42 o 2  29.5823 7.9596  7.93803     19.1336  29.7559     16.4108  20.5271    309.042     10.2264     309.042     
1 1 1 38 6  43 f 0  27.9749 7.9308  32.8617     19.5596  -0.320027   16.6464  9.32968    38.8534     0           0           
1 1 1 38 6  44 o 7  30.4648 8.23386 37.8268     19.8908  10.2274     16.6071  19.2638    128.695     11.4329     128.695     
1 1 1 38 6  45 o 12 20.1105 6.76006 -15.6297    22.1299  -3.20827    15.7804  5.61822    182.764     9.48039     2.76385     
1 1 1 38 6  46 o 2  28.5486 7.54664 -17.9107    22.43    38.2385     16.8582  10.8687    233.531     14.3307     53.5313     
1 1 1 38 6  47 o 9  24.2098 7.30349 -7.14559    17.3792  23.3841     16.8143  4.90923    84.8595     1.46242     84.8595     
1 1 1 38 6  48 o 9  20.243  6.66023 -7.03764    17.0395  3.64902     16.1141  4.62371    275.117     7.52898     95.1171     
1 1 1 38 6  49 o 9  35.2044 8.73017 45.8444     19.6845  32.7123     18.8091  20.3627    229.555     12.3659     229.555     
1 1 1 38 6  50 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 7  0  o 4  27.6334 7.60682 19.6388     10.0393  19.6388     10.0393  21.2508    180         2.16941     180         
1 1 1 38 7  1  o 7  38.0577 5.88944 21.1888     11.4422  38.0078     10.6459  25.3981    62.6346     3.34389     242.635     
1 1 1 38 7  2  o 13 28.106  6.28076 21.7127     10.3693  9.45794     10.3239  16.3947    327.531     4.14492     147.531     
1 1 1 38 7  3  o 17 29.1164 6.12552 18.0517     8.77174  16.2456     10.5719  21.5455    259.696     9.3521      259.696     
1 1 1 38 7  4  o 8  59.9582 3.89545 65.3496     10.7374  69.1651     12.3818  54.0755    63.1336     19.5471     63.1336     
1 1 1 38 7  5  o 18 25.7045 6.02514 14.8676     8.66159  10.5887     9.69637  15.8714    123.599     5.93958     123.599     
1 1 1 38 7  6  f 0  57.4412 4.06088 69.0542     10.5434  55.3608     12.0842  30.2415    315.788     0           0           
1 1 1 38 7  7  o 16 26.7074 6.07553 16.4097     8.76407  11.5826     10.0355  14.5255    304.558     5.74331     124.558     
1 1 1 38 7  8  o 7  27.3466 6.15179 15.6156     8.99061  14.3888     10.0421  13.3194    357.381     9.97832     177.381     
1 1 1 38 7  9  o 18 63.0309 3.79107 70.8892     11.2621  77.5864     12.4654  50.1551    253.86      6.52636     253.86      
1 1 1 38 7  10 o 10 39.445  5.31173 25.246      9.47159  37.1381     10.7809  36.4758    129.15      19.2399     129.15      
1 1 1 38 7  11 o 7  60.6548 3.98472 65.6684     11.2648  72.8658     12.6881  58.3336    348.843     27.5272     348.843     
1 1 1 38 7  12 o 18 59.9745 3.87881 68.041      10.9383  67.0311     12.0698  68.5359    55.7155     51.6092     55.7155     
1 1 1 38 7  13 o 6  50.7994 4.4792  51.2997     10.6978  47.8203     11.5309  45.2511    209.145     16.7649     209.145     
1 1 1 38 7  14 o 3  45.2305 4.92919 46.0129     10.5502  34.4783     10.8316  21.2635    325.939     23.948      145.939     
1 1 1 38 7  15 o 7  47.64   4.68259 40.4065     10.2115  47.8979     11.5579  37.9441    179.273     6.7405      179.273     
1 1 1 38 7  16 o 5  21.1862 5.96746 5.89748     9.08994  6.82936     9.93472  9.73425    298.157     2.86392     118.157     
1 1 1 38 7  17 o 3  26.9372 6.10665 4.26817     9.38379  24.4927     11.0734  18.7387    24.4312     6.38755     24.4312     
1 1 1 38 7  18 o 9  57.4487 4.36078 63.1309     12.2948  63.6304     12.4218  48.6041    264.541     12.8921     264.541     
1 1 1 38 7  19 o 18 40.0427 5.53668 35.6231     10.3885  29.7172     10.9913  33.7044    267.1       11.5009     267.1       
1 1 1 38 7  20 o 14 22.7721 6.17188 5.11938     9.65554  12.2591     10.3475  7.42539    245.298     14.3058     65.2982     
1 1 1 38 7  21 o 8  40.5154 5.47315 34.0403     10.2867  32.8412     11.1081  29.6419    121.11      1.85314     121.11      
1 1 1 38 7  22 o 10 34.1172 6.30579 27.7216     9.96062  21.9992     12.1706  28.4315    288.299     12.8234     288.299     
1 1 1 38 7  23 o 3  70.6266 3.8494  97.7317     12.1653  91.3278     14.6021  58.2055    129.238     12.173      129.238     
1 1 1 38 7  24 o 3  40.693  6.94992 39.4271     12.5203  33.85       15.7414  24.5613    144.405     8.57721     324.405     
1 1 1 38 7  25 o 11 48.4701 5.90084 50.2306     12.8931  47.5019     14.6133  41.4932    144.599     14.157      144.599     
1 1 1 38 7  26 o 3  22.4228 6.67487 7.38361     12.109   4.43424     13.5498  10.0396    192.997     4.47765     12.9972     
1 1 1 38 7  27 o 19 30.9082 7.37754 21.5792     12.0036  21.6507     15.3467  10.0773    204.204     22.2747     24.204      
1 1 1 38 7  28 o 17 30.6852 7.58226 19.0742     13.6737  24.1154     15.0591  16.2577    321.271     7.91485     141.271     
1 1 1 38 7  29 o 13 17.3439 5.73131 -19.6364    10.7493  2.78292     13.8816  1.56342    38.0943     1.59331     218.094     
1 1 1 38 7  30 o 19 46.1286 6.40309 48.5916     13.7599  43.4044     14.7399  30.2806    19.77       4.67799     199.77      
1 1 1 38 7  31 o 19 32.529  7.63387 18.9041     14.2491  31.1451     15.2638  22.3188    240.774     4.28227     240.774     
1 1 1 38 7  32 o 15 32.1705 7.1745  30.0921     12.9924  17.1227     13.8859  21.503     238.918     2.55989     238.918     
1 1 1 38 7  33 o 18 19.9804 6.23904 -4.5538     11.6815  6.10349     13.0663  3.40071    12.782      16.016      192.782     
1 1 1 38 7  34 o 3  29.3835 7.1427  24.2886     12.6927  13.9633     13.5176  11.0624    233.283     17.037      53.2832     
1 1 1 38 7  35 o 13 36.8711 7.40889 33.5248     13.1322  29.9445     15.881   17.0037    216.435     17.0644     36.4346     
1 1 1 38 7  36 o 17 22.9722 6.94513 12.5404     14.6477  -2.7182     14.6684  6.90791    332.919     14.9567     152.919     
1 1 1 38 7  37 o 19 28.0209 7.71416 14.4334     14.9073  19.6785     16.2815  18.2106    246.016     2.7035      246.016     
1 1 1 38 7  38 o 17 26.0872 7.17352 25.8377     15.1312  -7.3855     16.0845  15.5435    184.556     7.34177     184.556     
1 1 1 38 7  39 o 9  55.7679 7.12692 75.4747     19.0236  66.4702     19.2839  39.7827    93.2066     0.475568    93.2066     
1 1 1 38 7  40 o 9  34.6573 7.99745 47.0987     17.7956  12.2372     18.5466  22.7574    155.722     0.299214    335.722     
1 1 1 38 7  41 o 17 25.1402 7.53763 1.45757     18.2153  18.1467     16.2373  11.2935    59.6075     8.35289     239.607     
1 1 1 38 7  42 o 5  34.5784 8.49341 37.6205     18.5262  29.1063     17.618   20.976     70.1527     3.33693     250.153     
1 1 1 38 7  43 o 15 36.3854 8.62175 40.8067     18.7703  35.5947     18.317   27.8332    185.546     10.689      185.546     
1 1 1 38 7  44 o 7  27.1395 8.24308 27.8995     22.4081  10.3313     17.7986  10.5198    13.2605     4.75991     13.2605     
1 1 1 38 7  45 o 1  20.7854 6.92117 -20.9637    24.3337  4.62668     15.9513  5.90132    30.2494     4.36244     210.249     
1 1 1 38 7  46 o 14 25.1413 7.92083 12.5784     24.0557  14.5673     17.174   10.6676    275.733     2.63751     95.7327     
1 1 1 38 7  47 x 14 ?       ?       ?           ?        ?           ?        16.0494    25.189      0           0           
1 1 1 38 7  48 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 8  0  o 5  19.0165 7.07822 10.3109     8.95221  10.3109     8.95221  0.170659   0.00167848  0.0252333   0.00167848  
1 1 1 38 8  1  o 9  21.8054 5.81892 9.9886      8.76061  5.73805     8.76102  8.21264    181.912     10.8143     1.91238     
1 1 1 38 8  2  o 12 52.5817 4.16563 52.5426     11.0378  52.7917     10.5276  49.1588    106.551     21.3319     106.551     
1 1 1 38 8  3  o 2  19.3208 5.56279 3.83372     8.47567  4.75792     8.467    2.93794    46.0362     0.345542    46.0363     
1 1 1 38 8  4  o 15 37.915  5.5037  21.5218     9.59512  37.6411     10.7159  30.4297    298.54      7.45254     298.54      
1 1 1 38 8  5  o 9  45.149  4.80908 39.8182     9.83996  39.9574     11.1868  31.8234    295.535     2.49999     115.535     
1 1 1 38 8  6  o 17 36.8852 5.64142 24.5173     9.65321  31.268      10.6266  29.1377    121.535     6.58522     121.535     
1 1 1 38 8  7  o 9  69.8269 3.55338 96.3912     11.862   85.6723     12.7213  49.9502    111.987     5.10157     291.987     
1 1 1 38 8  8  o 6  19.7406 5.71509 5.94606     8.4582   2.46233     9.72689  8.04036    200.322     3.80075     20.3217     
1 1 1 38 8  9  o 10 54.5311 4.21764 60.7917     10.7341  53.0304     11.751   47.9621    96.177      15.5782     96.177      
1 1 1 38 8  10 o 12 46.0055 4.79635 40.3586     10.1648  42.7197     11.2789  44.0973    190.189     22.5169     190.189     
1 1 1 38 8  11 o 5  28.6501 6.36749 17.5453     9.32315  16.8824     11.1622  9.16913    310.921     21.8245     130.921     
1 1 1 38 8  12 o 17 33.2416 6.11193 24.2937     9.58405  22.2845     11.0489  12.2462    131.666     23.1586     311.666     
1 1 1 38 8  13 o 5  28.0627 6.17875 21.0215     9.63556  11.401      10.3179  20.5232    341.711     7.43551     341.711     
1 1 1 38 8  14 o 11 22.7935 6.12015 10.0415     9.05159  7.98274     10.3449  9.11184    130.717     3.58643     130.717     
1 1 1 38 8  15 o 11 55.2315 4.49327 59.4992     10.9223  58.9028     13.2897  46.7889    340.098     12.4008     340.098     
1 1 1 38 8  16 o 11 27.5229 6.44538 15.497      9.18502  16.4062     11.6065  19.2279    253.558     5.89816     253.558     
1 1 1 38 8  17 o 9  29.9924 6.14043 11.18       9.92725  27.2258     10.6466  18.4876    163.582     3.46284     343.582     
1 1 1 38 8  18 o 16 34.8574 5.94169 20.6592     9.65107  31.1931     11.0052  26.7149    69.4074     5.81767     69.4074     
1 1 1 38 8  19 o 9  19.1998 5.64866 -5.0941     8.98429  9.72401     10.0511  6.6678     288.635     6.07876     108.635     
1 1 1 38 8  20 o 17 20.6527 6.21937 -2.86363    11.026   9.05615     12.1064  8.55505    284.204     3.14029     104.204     
1 1 1 38 8  21 o 14 22.6385 6.56173 1.75995     12.1914  11.8199     12.1433  6.55242    34.8428     15.6654     214.843     
1 1 1 38 8  22 o 3  39.7373 7.40087 34.8744     16.5791  37.7287     13.5512  24.4333    92.8678     7.26923     272.868     
1 1 1 38 8  23 o 14 48.7346 5.97128 50.1514     14.1157  49.5999     13.9953  38.8992    335.138     7.93722     335.139     
1 1 1 38 8  24 o 10 35.9893 7.40012 27.8504     13.5122  32.4642     14.7864  28.1237    349.37      8.8547      349.37      
1 1 1 38 8  25 o 14 28.4047 6.81457 4.46734     12.9027  28.1612     12.9409  18.8656    331.289     5.13652     331.289     
1 1 1 38 8  26 o 7  27.4623 6.98622 10.512      11.9799  21.8496     13.0606  8.73593    155.177     4.99789     155.177     
1 1 1 38 8  27 o 10 25.8017 6.91032 6.90495     12.1278  19.4363     13.092   11.587     356.013     8.63698     176.013     
1 1 1 38 8  28 o 18 31.6327 7.41193 31.6913     13.9378  13.4175     15.5184  22.4329    89.5664     7.6746      89.5664     
1 1 1 38 8  29 o 9  19.5199 6.16763 4.30724     11.3875  -8.34383    14.3238  4.1416     337.3       1.44434     157.3       
1 1 1 38 8  30 o 14 41.1439 7.3424  41.4629     13.9525  37.1124     16.5402  36.7083    219.779     19.5075     219.779     
1 1 1 38 8  31 o 6  23.1447 6.86324 15.194      12.9794  -13.5334    18.1772  10.1713    46.5406     2.2624      46.5406     
1 1 1 38 8  32 o 13 27.8338 8.08538 13.5144     16.2987  18.1923     19.8319  14.0093    199.142     7.49867     19.1417     
1 1 1 38 8  33 o 19 19.8892 6.62026 -13.2878    16.1252  -3.98359    17.7722  7.38422    65.8831     1.08854     245.883     
1 1 1 38 8  34 o 12 28.5408 8.30177 12.0271     16.5597  23.719      21.5101  15.953     17.2177     4.65552     197.218     
1 1 1 38 8  35 o 16 25.9587 7.61222 16.8862     16.4432  7.43117     16.3972  12.3556    154.269     6.69335     154.269     
1 1 1 38 8  36 o 19 20.7442 6.72019 -3.30698    16.1221  -0.417432   15.463   7.2937     199.777     9.43131     19.7767     
1 1 1 38 8  37 o 10 19.6664 6.48277 -7.09529    15.5327  -3.21611    15.7655  7.1165     88.7704     0.599265    268.77      
1 1 1 38 8  38 o 1  22.5982 7.03085 15.5081     16.7551  -9.23339    15.4674  11.4623    4.28098     0.532442    4.28098     
1 1 1 38 8  39 o 16 21.4747 6.93651 6.68012     16.8323  -6.91872    16.919   8.33115    223.267     7.31713     43.2669     
1 1 1 38 8  40 o 16 20.3727 6.71472 -8.38221    16.9463  1.56665     16.8125  7.30025    140.272     2.80309     320.272     
1 1 1 38 8  41 o 11 29.841  8.32194 36.8577     19.6846  12.4438     18.6496  18.8381    287.393     3.04213     287.393     
1 1 1 38 8  42 o 5  22.0374 7.1146  9.05698     17.5128  -2.24846    17.7962  5.36338    166.64      0.301619    166.64      
1 1 1 38 8  43 o 5  26.715  8.04098 10.1068     18.7897  26.8847     19.6188  11.0623    324.539     9.34757     144.539     
1 1 1 38 8  44 o 2  22.8449 7.27499 -8.6061     19.0947  18.0339     17.9488  7.58861    69.7523     2.4217      249.752     
1 1 1 38 8  45 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 8  46 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 9  0  o 2  36.0335 6.35289 28.369      9.92566  28.369      9.92566  19.5823    180         16.0328     3.59722e-05 
1 1 1 38 9  1  o 18 29.6546 6.07637 15.8688     9.77837  21.3807     9.51462  12.1201    14.7154     17.5582     194.715     
1 1 1 38 9  2  o 14 47.3947 4.49266 41.4456     10.2729  46.2277     10.5142  28.2334    294.938     13.8822     114.938     
1 1 1 38 9  3  o 3  32.157  5.82566 25.7617     9.62099  17.8536     9.42382  27.3727    314.939     14.0614     314.939     
1 1 1 38 9  4  f 0  22.359  5.78139 14.3854     9.00878  2.16676     9.03389  19.4296    74.4788     0           0           
1 1 1 38 9  5  o 4  33.4398 5.7868  24.5299     9.61064  22.3978     9.63572  19.8649    253.616     7.62315     73.6165     
1 1 1 38 9  6  o 17 35.4862 5.67886 17.3691     9.75892  36.1338     10.4296  14.3389    247.793     22.8506     67.7929     
1 1 1 38 9  7  f 0  37.2653 5.45075 19.281      9.90596  38.9485     9.92195  29.4128    297.632     0           0           
1 1 1 38 9  8  o 11 24.4471 5.99151 14.7231     9.1012   8.98991     9.06538  1.08438    28.326      31.935      208.326     
1 1 1 38 9  9  o 15 38.6217 5.91017 30.6452     9.88913  32.0865     12.3104  29.2849    278.149     3.70989     278.149     
1 1 1 38 9  10 o 8  18.094  5.55812 2.01767     8.63304  0.0189928   10.178   4.77869    119.743     1.74504     299.743     
1 1 1 38 9  11 o 8  28.1315 6.25259 20.5901     9.36517  12.4731     11.0632  16.4149    96.2731     4.72059     276.273     
1 1 1 38 9  12 f 0  42.5355 5.61377 38.7208     11.0311  36.101      11.9774  47.3853    314.974     0           0           
1 1 1 38 9  13 o 6  43.1174 5.52272 28.947      10.8104  48.7436     12.0785  38.6583    207.33      16.2637     207.33      
1 1 1 38 9  14 o 3  40.1736 5.85166 40.0871     10.7129  28.033      12.0155  26.6366    57.6041     4.51426     237.604     
1 1 1 38 9  15 o 19 29.4005 6.78321 19.5284     10.8116  18.5401     12.2429  19.0885    61.5196     0.345973    241.52      
1 1 1 38 9  16 o 3  25.1108 7.15683 13.0683     13.4725  9.00092     14.4023  13.3412    73.1537     3.78832     253.154     
1 1 1 38 9  17 o 3  34.4428 6.99758 30.9513     12.7333  22.9179     12.9845  25.6676    52.544      4.94471     52.544      
1 1 1 38 9  18 o 5  30.5236 7.12702 18.0802     12.7005  24.0942     12.8051  19.4027    326.394     12.2504     326.394     
1 1 1 38 9  19 o 8  25.2345 6.7756  18.1862     12.1796  5.34325     12.4917  6.73125    122.892     20.1436     302.892     
1 1 1 38 9  20 o 9  37.2727 7.22478 35.8989     13.2555  28.2251     14.9435  24.8138    169.515     2.11232     349.515     
1 1 1 38 9  21 o 2  24.8216 6.83704 7.80737     12.2797  15.3622     12.5202  10.9864    305.383     4.00559     305.383     
1 1 1 38 9  22 o 7  19.7405 6.18428 0.192406    12.0387  1.556       12.2241  5.92841    230.374     6.86089     50.3738     
1 1 1 38 9  23 o 2  33.3725 7.29853 16.6516     13.215   35.8908     14.7446  24.0101    186.795     5.01045     186.795     
1 1 1 38 9  24 o 10 21.4452 6.63306 3.85538     12.1987  2.87388     14.9354  3.03863    272.142     0.280422    272.142     
1 1 1 38 9  25 o 14 30.306  7.58031 22.2431     14.3825  20.7746     14.3843  20.2901    93.4708     3.4348      93.4708     
1 1 1 38 9  26 o 4  18.4062 6.03179 -8.3136     13.326   -2.69501    13.2374  4.68289    143.043     4.8058      323.043     
1 1 1 38 9  27 o 1  34.183  7.62287 35.1032     15.145   20.9974     14.774   25.58      218.203     6.54203     218.203     
1 1 1 38 9  28 o 13 31.7456 8.22914 34.6314     19.6302  15.7379     14.8904  20.6125    300.493     0.195177    120.493     
1 1 1 38 9  29 o 18 36.9538 8.81884 39.1007     20.5201  32.8921     18.2184  26.7671    213.608     3.69633     213.608     
1 1 1 38 9  30 o 14 25.4686 7.70795 13.05       17.9356  6.95892     17.1534  13.9919    55.2067     3.27379     235.207     
1 1 1 38 9  31 o 16 26.7271 7.84259 12.2261     16.6143  15.5604     17.8764  17.4439    316.087     6.55938     316.087     
1 1 1 38 9  32 o 18 40.5683 8.3637  38.7312     17.6791  45.6859     18.476   31.2478    110.779     6.72272     110.779     
1 1 1 38 9  33 o 3  28.6112 8.03368 11.8232     17.7097  25.3574     17.4844  19.1922    271.848     3.48295     271.848     
1 1 1 38 9  34 o 7  25.3995 7.65611 14.0175     17.3552  9.21828     17.0084  14.5107    144.592     1.1108      324.592     
1 1 1 38 9  35 o 5  22.059  7.36936 -9.76398    17.0186  3.90411     24.4653  4.53564    269.293     1.68157     269.293     
1 1 1 38 9  36 o 16 26.8524 8.31253 5.49541     17.3999  27.3273     24.7103  15.2831    227.596     6.79818     227.596     
1 1 1 38 9  37 o 1  20.6443 6.99743 -18.7187    16.3301  5.38696     23.1858  6.67774    203.617     9.15205     23.617      
1 1 1 38 9  38 o 16 18.3723 6.37611 -24.2548    16.2455  -9.46309    21.9761  4.44833    325.897     5.88096     145.897     
1 1 1 38 9  39 o 10 22.7633 7.11462 24.0849     17.705   -51.2905    23.6206  9.43847    270.393     1.17436     90.3932     
1 1 1 38 9  40 o 2  21.3821 7.2291  -2.83381    17.6492  -4.28343    26.0534  3.51639    284.381     0.253777    104.381     
1 1 1 38 9  41 o 2  40.0358 9.27115 51.4854     21.7916  54.8858     21.1935  29.0995    121.664     6.75494     121.664     
1 1 1 38 9  42 o 11 28.8175 8.61973 24.7701     19.5536  29.7554     23.4462  6.42127    66.0844     3.09726     66.0844     
1 1 1 38 9  43 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 9  44 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 10 0  o 12 13.8777 6.23711 2.44567     9.47476  2.44567     9.47476  10.9001    180         41.7684     180         
1 1 1 38 10 1  o 15 30.3092 6.22472 23.9372     9.95242  15.8608     10.4948  23.9353    8.88051     13.1774     8.88051     
1 1 1 38 10 2  o 17 24.3961 6.14162 7.84191     9.64711  15.6433     9.70846  3.35642    94.1992     27.0015     274.199     
1 1 1 38 10 3  o 18 27.3316 6.32917 18.752      9.86362  13.0668     10.4273  8.9168     40.4364     20.1771     220.436     
1 1 1 38 10 4  o 13 63.7273 3.99019 79.7308     12.0844  76.1085     13.0722  48.1556    206.528     0.540579    206.528     
1 1 1 38 10 5  o 2  24.5461 6.23491 12.9799     9.61156  11.2893     9.95556  14.0076    141.056     1.58537     321.056     
1 1 1 38 10 6  o 4  18.4777 5.63644 4.08473     9.6025   -0.718485   9.54826  1.61635    287.732     19.3726     107.732     
1 1 1 38 10 7  o 4  43.7662 5.50191 39.0877     11.7303  40.0837     11.5155  39.1973    207.088     15.9687     207.088     
1 1 1 38 10 8  o 16 40.4164 5.71181 46.508      11.594   23.5374     10.8001  27.4455    123.909     3.49577     303.909     
1 1 1 38 10 9  o 3  35.5063 6.09188 26.4656     10.8928  27.9393     10.5725  26.4988    54.461      3.68878     54.461      
1 1 1 38 10 10 o 17 35.7542 6.13843 27.1189     11.0343  28.211      10.7458  24.0911    219.29      2.13003     39.29       
1 1 1 38 10 11 o 6  18.8295 5.9376  -1.12795    10.1617  0.989171    12.4666  5.72751    89.8698     4.72587     269.87      
1 1 1 38 10 12 o 6  17.5319 5.62705 -1.95681    11.4031  -2.89511    10.0134  3.84365    292.175     4.31697     112.175     
1 1 1 38 10 13 o 14 29.4985 7.21954 24.1582     13.1219  15.0098     13.3888  20.3552    198.706     4.33608     198.706     
1 1 1 38 10 14 o 19 20.2397 6.34774 -2.38401    13.0061  3.96555     12.8091  5.02679    226.734     13.4399     46.7337     
1 1 1 38 10 15 o 3  32.3002 7.33695 38.6216     14.7412  4.20088     17.8518  16.3235    204.614     11.9452     24.6136     
1 1 1 38 10 16 o 12 24.7579 6.92762 10.9516     12.1915  12.3169     13.2896  13.0042    134.79      1.90334     314.79      
1 1 1 38 10 17 o 2  38.7467 6.65364 50.717      13.4321  17.7172     14.5979  27.3492    229.215     0.451522    229.215     
1 1 1 38 10 18 o 19 29.3173 7.0972  28.4174     13.0389  7.69743     14.7905  6.50824    230.228     27.6718     50.2279     
1 1 1 38 10 19 o 9  45.3406 6.60072 56.6942     13.9639  35.146      15.0398  28.1408    296.477     9.29968     116.477     
1 1 1 38 10 20 o 3  20.0181 6.32018 2.68803     12.3292  -2.34201    13.7107  0.961203   262.795     22.9947     82.7949     
1 1 1 38 10 21 o 7  38.6958 7.13879 27.7654     13.6295  42.1565     14.6863  35.3263    139.457     23.6615     139.457     
1 1 1 38 10 22 o 7  27.3633 7.19541 8.69319     13.0937  23.2944     14.1128  11.8531    72.0362     12.6396     252.036     
1 1 1 38 10 23 o 12 38.0857 7.30297 38.2403     13.941   29.8353     14.966   29.9342    50.0922     7.5782      50.0922     
1 1 1 38 10 24 f 0  26.082  7.52218 16.0305     16.1898  10.0227     14.8859  18.6804    345.747     0           0           
1 1 1 38 10 25 o 4  41.0285 8.06167 57.7544     18.3309  26.4554     18.4502  35.6605    261.1       15.153      261.1       
1 1 1 38 10 26 o 12 23.9164 7.31871 1.80145     16.7789  11.3385     15.9263  7.18439    348.728     17.2051     168.728     
1 1 1 38 10 27 o 10 60.7547 6.90052 78.4951     20.3016  86.7422     20.2379  57.7637    62.8778     27.388      62.8778     
1 1 1 38 10 28 o 2  25.7672 7.58176 0.33304     17.1498  20.9219     16.846   14.6713    296.662     2.73981     116.662     
1 1 1 38 10 29 o 3  37.5837 9.20855 53.8499     24.2925  28.467      18.2386  16.1322    54.5557     20.8007     234.556     
1 1 1 38 10 30 o 8  25.837  7.91599 16.7348     20.0098  7.04414     17.827   6.31987    171.252     3.73994     171.252     
1 1 1 38 10 31 o 1  21.6581 7.06603 0.132311    19.2463  -1.48696    16.3994  8.82931    239.555     2.19909     239.555     
1 1 1 38 10 32 o 3  39.0161 9.07924 57.5165     22.6574  32.8362     19.0748  30.1854    2.64707     7.60675     2.64707     
1 1 1 38 10 33 o 17 24.1365 7.637   10.7924     20.2505  5.75463     17.6122  5.32907    33.7313     20.8444     213.731     
1 1 1 38 10 34 o 16 33.9801 8.63798 33.4824     18.693   34.9152     18.8     26.6679    327.266     13.3985     327.266     
1 1 1 38 10 35 o 17 24.9386 7.6563  13.5093     17.8928  12.6738     17.6327  13.0939    48.3515     0.0824157   228.352     
1 1 1 38 10 36 o 5  23.4614 7.39365 5.33155     18.1046  12.5473     17.3441  9.15575    254.941     1.44625     254.941     
1 1 1 38 10 37 o 2  28.059  7.70226 42.8489     18.9858  -10.4491    18.7465  14.3548    250.528     6.48261     250.528     
1 1 1 38 10 38 o 15 19.4232 6.52109 -0.111692   17.5327  -9.79856    16.8271  1.89336    157.713     1.10304     337.713     
1 1 1 38 10 39 o 18 26.9237 8.13396 26.6155     19.7184  15.1272     19.5425  12.647     71.2824     2.44159     71.2824     
1 1 1 38 10 40 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 10 41 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 11 0  o 12 34.5953 7.72523 29.2192     11.7702  29.2192     11.7702  28.4539    1.13384e-05 4.01875     1.13384e-05 
1 1 1 38 11 1  o 16 46.58   5.58041 46.164      12.4399  44.4171     12.6737  31.924     156.818     4.63267     336.818     
1 1 1 38 11 2  o 14 13.605  4.6025  -2.79705    9.33715  -21.921     8.90833  1.50517    198.488     13.6571     198.488     
1 1 1 38 11 3  o 5  27.579  6.7596  5.44339     10.7035  27.8748     13.6434  17.2248    51.4841     0.227662    51.4844     
1 1 1 38 11 4  o 1  22.7542 6.27266 9.79394     10.5272  8.99719     10.0996  10.5936    37.3946     0.825619    37.3946     
1 1 1 38 11 5  o 11 28.499  6.55085 18.9688     10.9965  17.2183     10.4371  12.7264    37.8515     13.3964     217.852     
1 1 1 38 11 6  o 10 18.1205 5.69679 -0.503777   10.1214  0.34556     10.6385  1.04084    88.7351     0.495406    268.735     
1 1 1 38 11 7  o 10 23.7711 6.63363 11.8232     12.3336  9.18183     10.9674  11.8701    297.447     2.7252      117.447     
1 1 1 38 11 8  o 19 48.0085 5.9817  49.8756     14.8222  48.4661     12.8471  38.3943    356.865     6.94333     356.865     
1 1 1 38 11 9  o 10 24.7574 6.84531 10.4764     13.6558  13.0437     11.2324  12.6055    57.4942     3.79126     237.494     
1 1 1 38 11 10 o 9  24.2699 7.01394 3.99348     14.0549  15.1963     13.6877  11.9167    57.9406     1.82767     57.9406     
1 1 1 38 11 11 o 5  27.5078 6.54703 31.4707     13.6877  -0.643427   11.0799  17.4854    85.8268     7.27729     85.8268     
1 1 1 38 11 12 o 4  21.3695 6.36448 6.25774     12.5246  5.33244     10.6949  4.61913    23.6962     0.74094     23.6962     
1 1 1 38 11 13 o 15 32.6721 7.10661 29.5954     13.8558  20.6405     11.7694  24.3757    317.251     6.05283     317.251     
1 1 1 38 11 14 o 13 22.2564 6.4384  -8.66916    14.8744  14.4582     11.3076  10.4464    57.022      1.02498     237.022     
1 1 1 38 11 15 o 3  26.6101 6.89838 23.0931     12.8101  5.10942     13.0657  17.1025    322.252     4.04479     322.252     
1 1 1 38 11 16 f 0  43.7526 6.21119 47.6122     13.9945  35.9825     12.3363  19.3303    17.976      0           0           
1 1 1 38 11 17 o 13 40.3616 6.73973 55.4848     14.2155  20.0269     14.7685  25.5698    78.3086     7.00203     258.309     
1 1 1 38 11 18 o 8  36.2444 7.6175  32.7788     14.231   30.6374     15.5763  19.8747    58.0991     11.7898     238.099     
1 1 1 38 11 19 o 13 23.7621 7.15381 12.0145     16.0165  4.09915     13.8873  13.4503    97.2439     0.626374    97.2439     
1 1 1 38 11 20 o 10 20.0951 6.5297  -4.58944    16.1172  -1.64948    14.0369  7.21408    73.6096     9.11217     253.61      
1 1 1 38 11 21 o 18 35.1435 8.07578 44.453      17.7802  17.353      17.1715  28.477     278.835     9.71387     278.835     
1 1 1 38 11 22 o 18 25.2622 7.50072 -2.71414    16.6467  20.851      17.1978  11.7276    136.67      9.64905     316.67      
1 1 1 38 11 23 o 11 26.5688 8.00092 9.29158     17.5239  17.4596     19.8603  13.5939    140.701     7.56166     320.701     
1 1 1 38 11 24 o 4  21.342  6.84482 -10.6458    16.4506  7.76477     16.1716  10.4972    105.624     0.42166     105.623     
1 1 1 38 11 25 o 12 30.5297 8.14744 34.7554     18.3589  11.1789     17.504   21.2673    330.66      2.79449     330.66      
1 1 1 38 11 26 f 0  52.649  7.94741 59.9668     21.0171  77.7612     19.718   28.7917    220.246     0           0           
1 1 1 38 11 27 o 5  55.8239 7.73984 65.7021     20.942   87.2416     20.7132  53.6367    242.007     27.182      242.007     
1 1 1 38 11 28 o 5  47.2056 8.63483 46.2391     22.2282  76.6656     20.8566  43.0744    120.16      20.2489     120.16      
1 1 1 38 11 29 o 3  44.8228 10.4481 61.1307     25.5653  76.7367     28.8909  30.5177    221.665     1.97402     41.6648     
1 1 1 38 11 30 o 9  23.006  7.27    7.07741     17.4658  6.4959      16.8056  8.9349     68.2685     10.1742     248.269     
1 1 1 38 11 31 o 8  24.0449 7.78233 -6.73775    18.6899  22.0084     23.368   10.868     33.2184     2.73494     33.2184     
1 1 1 38 11 32 o 5  30.4288 8.45811 35.7362     19.9908  20.9406     18.1068  16.6078    213.599     6.16077     33.5993     
1 1 1 38 11 33 o 2  18.2022 6.24364 -37.4021    21.5352  -2.8576     16.4763  3.8435     200.893     6.19656     20.8926     
1 1 1 38 11 34 o 1  24.3357 7.83731 14.2661     22.8975  9.44355     19.1121  4.06845    255.895     1.27601     255.895     
1 1 1 38 11 35 o 19 27.8239 8.5146  25.8163     24.2633  23.7056     19.7146  10.4513    224.861     14.0217     44.8611     
1 1 1 38 11 36 o 6  26.6391 8.2248  7.03705     24.9007  29.2103     19.8519  12.4656    78.0008     1.90238     78.0008     
1 1 1 38 11 37 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 11 38 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 12 0  o 14 11.6515 5.70604 -7.16064    11.4573  -7.16064    11.4573  8.39659    180         30.8807     180         
1 1 1 38 12 1  o 3  42.934  6.56052 45.4682     13.1996  36.8089     14.2377  30.3384    253.901     1.94509     73.9007     
1 1 1 38 12 2  o 3  39.7437 6.52336 29.7485     12.1261  41.2731     13.4637  26.3289    157.891     4.93033     337.891     
1 1 1 38 12 3  o 3  26.6541 7.0863  12.567      13.9529  17.634      12.159   16.7215    111.574     0.487218    111.574     
1 1 1 38 12 4  o 5  28.0751 7.16556 23.961      13.7405  11.4361     12.6969  12.6016    281.959     7.9781      281.959     
1 1 1 38 12 5  o 8  19.4903 6.26336 -1.08683    15.5756  -1.06888    10.9339  5.28218    311.249     12.271      131.249     
1 1 1 38 12 6  o 6  25.9347 7.03673 7.16389     14.1484  19.0672     12.6595  16.6355    117.627     5.30749     117.627     
1 1 1 38 12 7  o 9  69.3313 4.8687  104.164     17.1217  89.2378     16.2357  71.1442    246.559     38.559      246.559     
1 1 1 38 12 8  o 3  51.8362 6.10121 59.7455     15.6748  55.7746     14.9133  46.0037    175.574     15.7226     175.574     
1 1 1 38 12 9  o 16 25.4466 6.99668 10.8081     13.5194  15.1133     12.3349  15.1889    209.497     1.23751     29.4969     
1 1 1 38 12 10 o 6  25.8023 7.66606 16.5248     15.505   4.04967     19.5167  16.1984    35.1096     5.54901     35.1096     
1 1 1 38 12 11 o 12 30.9303 7.23042 12.4027     14.5983  31.0609     13.5004  25.1087    37.004      13.8939     37.004      
1 1 1 38 12 12 o 1  19.8419 6.27496 4.04471     13.3949  -3.54444    12.2788  4.8444     147.164     1.08134     147.164     
1 1 1 38 12 13 o 8  31.6956 8.127   24.774      19.8227  24.9664     14.1795  24.7505    331.319     8.38351     331.319     
1 1 1 38 12 14 o 3  35.0565 8.46245 32.3772     19.6482  31.8389     16.2834  26.6184    269.025     5.00993     269.025     
1 1 1 38 12 15 o 4  33.9979 8.15147 25.6671     20.7196  32.1553     14.3097  28.143     143.028     11.2492     143.028     
1 1 1 38 12 16 o 1  27.436  7.4425  4.77254     19.764   22.2588     12.7825  19.8984    186.62      8.62727     186.62      
1 1 1 38 12 17 o 6  25.4047 7.41993 1.64783     20.1277  16.9776     13.3877  15.7225    234.389     0.0662616   234.388     
1 1 1 38 12 18 o 17 26.4468 7.768   16.57       21.243   12.7417     13.0232  11.8195    232.934     11.9985     52.9337     
1 1 1 38 12 19 o 6  25.768  7.66259 15.6715     20.1813  11.0383     13.4756  12.0699    300.045     10.0489     120.045     
1 1 1 38 12 20 o 5  35.5562 8.90329 29.9885     21.8217  41.6414     19.1493  16.4068    259.324     17.8652     79.3238     
1 1 1 38 12 21 o 5  25.9821 7.85955 5.65603     20.3245  18.4704     17.2829  16.5355    102.824     1.97002     102.824     
1 1 1 38 12 22 o 3  26.2213 7.78    -3.47848    20.4294  24.844      17.5504  17.3133    298.99      6.36355     298.99      
1 1 1 38 12 23 o 4  23.8085 7.67165 5.90407     20.3323  4.94709     20.0551  10.8105    222.325     4.64226     222.325     
1 1 1 38 12 24 o 7  18.9943 6.37521 -23.4399    18.2901  0.26937     15.8708  4.92859    15.9261     0.0847403   15.9261     
1 1 1 38 12 25 o 7  23.7703 7.51197 22.0581     20.2509  -10.0431    17.6038  9.00846    19.3813     3.77664     19.3813     
1 1 1 38 12 26 o 13 21.831  7.16604 4.53504     19.3671  -2.48783    18.2066  7.86701    293.748     10.2675     113.748     
1 1 1 38 12 27 o 18 22.0467 7.212   -1.8117     19.9864  6.04993     17.9648  9.72042    136.237     1.60888     316.237     
1 1 1 38 12 28 o 19 20.9949 6.97641 8.00568     19.7665  -11.2373    17.7052  1.82131    248.599     0.236368    248.599     
1 1 1 38 12 29 o 10 31.052  8.29127 3.78121     22.8941  48.1819     19.6877  21.6056    52.6844     9.66245     52.6844     
1 1 1 38 12 30 o 8  23.6413 7.57352 6.70013     20.5125  12.9569     18.4909  10.3354    155.808     0.70881     335.808     
1 1 1 38 12 31 o 14 21.3161 7.03367 -5.08479    19.8981  7.35475     17.7486  4.7051     48.8754     0.59889     228.875     
1 1 1 38 12 32 o 9  25.4734 8.39925 24.7152     34.5352  12.3686     19.1333  10.2497    294.232     1.49485     294.232     
1 1 1 38 12 33 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 12 34 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 12 35 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 13 0  o 18 12.1242 6.08336 -16.0583    15.5948  -16.0583    15.5948  0.700185   180         12.4587     180         
1 1 1 38 13 1  o 13 45.2263 8.73995 54.6834     19.925   53.3538     20.8501  46.6571    334.812     31.9255     334.812     
1 1 1 38 13 2  o 13 24.4455 7.53802 11.7722     18.0306  4.98836     16.7607  12.9373    17.4129     6.15462     17.4129     
1 1 1 38 13 3  o 12 48.4074 7.97375 56.5462     20.8997  58.9403     17.184   45.9807    255.686     21.8375     255.686     
1 1 1 38 13 4  o 1  28.843  7.72245 16.9931     17.8778  21.6613     13.6382  22.2023    153.738     10.2237     153.738     
1 1 1 38 13 5  o 14 19.8616 6.41585 -5.55215    16.6365  1.14062     12.2599  6.84388    108.724     1.46814     108.724     
1 1 1 38 13 6  o 14 22.3057 6.67248 -2.96897    14.3791  12.9775     12.8313  12.7703    330.213     1.88257     330.213     
1 1 1 38 13 7  o 5  67.9735 5.61618 98.9985     19.5284  95.8693     17.982   60.382     133.009     18.0355     133.009     
1 1 1 38 13 8  o 10 24.8961 6.99058 -0.243464   14.944   20.4565     13.503   8.3465     337.087     17.6193     157.087     
1 1 1 38 13 9  o 10 29.8591 9.00927 20.7326     22.7433  24.9325     24.8188  15.3906    312.535     10.2437     312.535     
1 1 1 38 13 10 o 9  24.2161 7.32492 5.5518      19.4572  11.7238     13.2222  13.5637    170.961     3.30024     350.961     
1 1 1 38 13 11 o 7  27.762  8.16123 25.4398     23.8826  12.9107     13.505   18.525     284.752     10.0092     284.752     
1 1 1 38 13 12 o 16 27.1741 8.54325 27.9427     30.7105  8.31641     15.1133  17.0092    169.598     0.462427    349.598     
1 1 1 38 13 13 o 12 30.8106 8.46495 32.3797     21.3129  20.0714     16.0744  23.8111    106.529     8.64936     106.529     
1 1 1 38 13 14 o 15 36.7937 9.02872 53.271      21.8494  27.0486     20.4565  33.1949    135.799     20.4216     135.799     
1 1 1 38 13 15 o 13 32.7918 8.52193 44.0342     21.4841  18.3226     15.6558  25.5694    5.20385     7.75684     5.20385     
1 1 1 38 13 16 o 15 33.4418 8.33236 56.6274     21.5935  1.88119     19.6308  25.3415    29.7086     5.39577     29.7086     
1 1 1 38 13 17 o 1  25.9385 7.6876  7.06609     20.7599  18.9922     14.9776  16.9044    185.172     2.73628     185.172     
1 1 1 38 13 18 o 1  26.8136 7.92093 21.4514     20.4218  14.0899     15.0599  10.4118    98.2112     15.7124     278.211     
1 1 1 38 13 19 o 18 20.4912 6.73874 2.56157     19.3777  -3.16678    13.5134  5.09424    122.569     1.13596     122.569     
1 1 1 38 13 20 o 13 25.9831 7.85004 24.0659     20.8655  9.24111     15.0507  16.1045    110.249     4.585       110.249     
1 1 1 38 13 21 o 19 20.4579 6.70421 -4.58547    19.796   2.51507     13.5869  8.23019    67.0459     2.25135     247.046     
1 1 1 38 13 22 o 13 26.0561 7.85594 18.5512     21.3271  15.9538     15.2229  15.2266    357.953     0.241281    357.953     
1 1 1 38 13 23 o 10 27.8031 8.53584 19.5306     22.6113  26.6541     21.8027  17.2508    96.1444     3.73154     96.1444     
1 1 1 38 13 24 o 15 28.5638 8.68051 25.0951     22.0431  28.0522     22.7138  10.8732    198.057     6.03894     198.057     
1 1 1 38 13 25 o 3  24.1945 7.86053 15.7582     21.6434  5.82163     22.2018  2.95058    311.013     1.05705     311.013     
1 1 1 38 13 26 o 5  28.9023 8.78594 29.3569     22.1592  29.3045     23.7951  17.2296    73.1393     5.55492     73.1393     
1 1 1 38 13 27 o 10 21.0878 7.13887 -11.8005    21.5001  5.36708     21.6807  2.71129    200.17      0.288811    20.1702     
1 1 1 38 13 28 o 9  19.7383 6.70054 4.33338     19.2115  -20.8155    20.0345  4.56986    126.488     8.33192     306.488     
1 1 1 38 13 29 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 13 30 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 13 31 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 14 0  o 2  14.122  6.90469 -7.03254    16.6071  -7.03254    16.6071  0.727568   2.39147e-05 15.7059     180         
1 1 1 38 14 1  o 19 21.9612 7.16022 -1.51883    17.5269  3.87147     19.0267  8.71571    320.168     3.22236     320.168     
1 1 1 38 14 2  o 15 22.2554 7.21906 3.90643     19.0761  0.926515    17.4285  8.6571     226.877     3.45402     226.877     
1 1 1 38 14 3  o 16 38.3563 10.0682 56.5443     31.7403  48.1925     21.6822  22.505     112.836     10.1756     292.836     
1 1 1 38 14 4  o 18 39.7255 10.1817 71.8089     30.6165  41.642      21.5398  33.7393    180.819     12.7715     180.819     
1 1 1 38 14 5  o 12 30.0415 9.29325 34.9678     33.9688  22.6894     20.4134  22.0747    90.1121     11.0325     90.1121     
1 1 1 38 14 6  o 19 28.3035 9.0216  43.5159     33.2558  6.55422     18.9068  17.1661    26.1806     9.56009     26.1806     
1 1 1 38 14 7  o 16 25.3855 8.08283 4.4031      34.6611  13.0977     14.2926  8.70226    352.492     17.2052     172.492     
1 1 1 38 14 8  o 6  28.2323 9.58845 -21.6919    119.96   19.344      22.4629  18.1437    264.139     7.81264     264.139     
1 1 1 38 14 9  o 11 29.2288 8.5173  10.5016     32.731   28.5261     16.3418  19.3225    288.913     11.2277     288.913     
1 1 1 38 14 10 o 10 54.4416 10.2762 119.964     36.0597  76.664      21.6825  51.342     262.733     23.8827     262.733     
1 1 1 38 14 11 o 17 28.1312 8.60624 18.3815     30.3589  23.2282     17.7986  17.6635    152.498     0.537912    332.498     
1 1 1 38 14 12 o 17 20.0896 6.63435 -9.36622    20.1213  1.99378     13.9498  7.67884    46.3443     6.95537     226.344     
1 1 1 38 14 13 o 13 23.3604 7.35999 8.61646     19.6367  9.1505      15.4222  11.6622    340.805     4.39773     160.805     
1 1 1 38 14 14 o 16 30.5958 8.25707 15.6724     22.1116  36.8998     17.1904  18.2373    329.191     4.85513     149.191     
1 1 1 38 14 15 o 13 21.0762 6.88068 -0.914545   19.8017  4.00343     14.6462  8.91332    74.9372     2.18006     254.937     
1 1 1 38 14 16 o 6  21.0438 6.82679 -9.03207    20.1961  8.48454     14.6001  8.63005    278.098     2.16732     98.0981     
1 1 1 38 14 17 o 14 21.3662 6.97863 6.65321     19.7409  0.960788    14.9599  3.97038    329.497     0.69949     329.497     
1 1 1 38 14 18 o 3  21.9825 7.09466 2.9861      20.2957  7.70658     15.0659  9.34762    250.692     3.06756     70.6921     
1 1 1 38 14 19 o 16 25.8395 7.82994 15.8162     22.6144  19.2998     15.2573  14.4048    253.569     1.41578     253.569     
1 1 1 38 14 20 o 9  21.1101 6.92712 9.91115     20.0275  -1.37124    14.3911  7.3691     326.056     6.6899      146.056     
1 1 1 38 14 21 o 9  24.6515 7.6566  31.3771     21.3263  1.00626     14.9578  12.0486    259.064     1.70399     79.0638     
1 1 1 38 14 22 o 11 19.9515 6.78082 2.49068     24.3594  -5.04264    13.6333  4.15435    97.021      12.9276     277.021     
1 1 1 38 14 23 o 16 24.7383 7.70099 17.8629     22.1476  14.7218     15.4198  7.89572    308.858     2.01489     308.858     
1 1 1 38 14 24 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 14 25 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 14 26 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 15 0  o 11 13.6965 7.10837 -58.0975    32.4464  -58.0975    32.4464  0.229515   180         2.61944     7.87616e-05 
1 1 1 38 15 1  o 8  25.1554 8.61048 14.513      38.2363  6.0525      28.4484  9.84724    226.178     3.70605     226.178     
1 1 1 38 15 2  o 16 25.2467 8.55602 0.246078    34.2932  18.6661     29.1741  11.5848    55.3164     3.8746      55.3164     
1 1 1 38 15 3  o 18 30.9389 10.5358 13.772      37.4995  114.728     54.3311  18.6328    351.605     9.15064     351.605     
1 1 1 38 15 4  o 18 27.4439 9.38275 42.8309     35.859   -13.8913    52.3733  16.0891    55.1241     0.412779    55.1239     
1 1 1 38 15 5  o 13 29.4704 8.88064 -30.4498    36.9394  55.059      25.1753  16.015     276.129     8.91456     276.129     
1 1 1 38 15 6  o 8  35.1285 10.257  53.3422     39.1535  63.0917     26.7171  25.2693    6.96535     4.1314      6.96535     
1 1 1 38 15 7  o 5  27.0912 9.47937 388.671     234.82   16.0283     22.9708  15.2823    231.513     0.123449    231.513     
1 1 1 38 15 8  o 15 35.4543 10.6535 74.3806     39.8104  60.388      28.6893  26.4439    145.229     14.9409     145.229     
1 1 1 38 15 9  o 12 31.3435 9.92024 67.9539     38.2832  31.8015     25.5087  21.2855    3.46058     8.39034     3.46058     
1 1 1 38 15 10 o 9  22.5194 7.70998 -19.6949    35.5836  6.49915     22.1838  9.55797    63.5473     2.77395     243.547     
1 1 1 38 15 11 o 18 25.3163 8.5285  42.5733     33.9471  -5.25246    22.8929  7.44302    359.401     2.75951     359.401     
1 1 1 38 15 12 o 5  24.3204 8.32682 29.7936     36.1194  -3.60539    23.6326  10.199     134.841     1.45933     134.841     
1 1 1 38 15 13 o 9  23.6942 8.04938 25.5514     34.7407  0.480911    18.7788  10.5536    122.406     2.47793     302.406     
1 1 1 38 15 14 o 1  25.6668 8.41947 35.6522     36.8905  12.6741     16.5297  12.9756    171.673     2.04055     351.673     
1 1 1 38 15 15 o 1  30.8032 8.83437 26.7951     36.639   40.7885     18.3006  20.1008    266.97      8.44553     266.97      
1 1 1 38 15 16 o 12 18.5643 6.50419 -40.9085    34.8852  -6.6358     13.8108  3.45271    152.534     5.00503     332.534     
1 1 1 38 15 17 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 15 18 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 15 19 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 15 20 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 15 21 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 0  x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 1  x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 2  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 3  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 4  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 5  x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 6  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 7  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 8  x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 9  x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 10 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 11 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 12 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 38 16 13 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 0  0  o 15 20.164  8.35054 9.00926     14.1421  9.00926     14.1421  2.22432    180         9.41375     180         
1 1 1 39 0  1  o 8  12.8618 5.96505 -1.00795    9.61802  -1.00795    9.61802  3.66797    240         11.9264     240         
1 1 1 39 0  2  o 9  13.304  6.08282 0.206384    9.50993  0.206384    9.50993  11.551     300         35.5371     300         
1 1 1 39 0  3  o 6  42.9742 5.2913  36.2333     10.3615  36.2333     10.3615  18.4729    2.68512e-07 28.0783     180         
1 1 1 39 0  4  f 0  14.6811 6.29842 3.94322     8.60077  3.94322     8.60077  13.4526    240         0           0           
1 1 1 39 0  5  o 11 61.3911 3.71787 69.049      11.2375  69.049      11.2375  49.6943    120         6.52081     120         
1 1 1 39 0  6  o 1  11.152  5.31509 -3.43444    8.56722  -3.43444    8.56722  8.60242    360         23.3483     360         
1 1 1 39 0  7  o 8  181.131 3.07381 587.385     27.8654  587.385     27.8654  162.35     240         50.8787     240         
1 1 1 39 0  8  o 5  36.2296 6.14038 27.5091     9.66984  27.5091     9.66984  22.8284    300         8.51374     120         
1 1 1 39 0  9  o 14 84.8014 3.19361 129.708     13.4836  129.708     13.4836  70.6421    180         13.2005     180         
1 1 1 39 0  10 f 0  23.0681 7.38377 14.2423     9.19378  14.2423     9.19378  5.01601    60          0           0           
1 1 1 39 0  11 o 11 16.0217 6.60292 5.92781     8.77161  5.92781     8.77161  1.08138    300         9.68325     300         
1 1 1 39 0  12 o 14 90.1356 2.99367 146.145     13.4544  146.145     13.4544  98.9125    180         61.9213     180         
1 1 1 39 0  13 o 5  10.93   5.21953 -3.5248     8.34029  -3.5248     8.34029  21.7081    60          55.1862     60          
1 1 1 39 0  14 o 18 53.9642 4.04394 54.1074     10.6279  54.1074     10.6279  51.8022    120         22.4088     120         
1 1 1 39 0  15 o 10 13.4709 6.00417 1.88452     8.57463  1.88452     8.57463  7.21015    360         25.3341     360         
1 1 1 39 0  16 o 6  130.583 2.83083 305.444     18.4856  305.444     18.4856  98.0535    240         0.173369    60.0027     
1 1 1 39 0  17 o 15 18.1546 6.95576 8.80851     8.86737  8.80851     8.86737  3.59482    120         29.588      120         
1 1 1 39 0  18 o 6  96.3624 3.13506 167.258     15.0664  167.258     15.0664  91.6821    180         38.7929     180         
1 1 1 39 0  19 o 2  118.751 2.81042 252.795     16.6826  252.795     16.6826  84.1386    60          9.70143     240         
1 1 1 39 0  20 o 3  25.2045 7.4241  16.5116     9.36332  16.5116     9.36332  11.0404    300         1.24076     300         
1 1 1 39 0  21 o 16 25.5451 7.67697 17.17       9.974    17.17       9.974    13.5962    3.19664e-06 1.34014     180         
1 1 1 39 0  22 o 1  52.2045 4.44536 51.328      11.183   51.328      11.183   51.9994    240         45.2237     240         
1 1 1 39 0  23 o 1  138.515 2.89765 344.049     20.0743  344.049     20.0743  112.607    120         18.5766     120         
1 1 1 39 0  24 o 9  101.302 3.16124 184.971     15.9773  184.971     15.9773  80.8271    180         10.7267     180         
1 1 1 39 0  25 o 9  21.1549 7.63033 12.4775     10.1814  12.4775     10.1814  6.81828    240         9.88089     60          
1 1 1 39 0  26 o 10 12.7344 5.93032 -1.18533    9.65661  -1.18533    9.65661  5.39924    120         20.716      120         
1 1 1 39 0  27 o 12 31.4538 7.85165 24.14       11.2404  24.14       11.2404  23.8       1.38449e-05 13.9232     1.38449e-05 
1 1 1 39 0  28 o 16 27.5697 7.82758 19.6739     10.5128  19.6739     10.5128  11.8419    60.0001     6.54817     60.0001     
1 1 1 39 0  29 o 10 128.962 3.10064 299.463     19.9863  299.463     19.9863  121.424    120         52.113      120         
1 1 1 39 0  30 o 14 55.9662 4.51266 59.1078     12.2316  59.1078     12.2316  45.6403    180         8.64132     180         
1 1 1 39 0  31 o 19 33.4001 7.60939 26.3658     11.2431  26.3658     11.2431  22.6388    60          3.75904     240         
1 1 1 39 0  32 o 18 51.507  4.99182 51.1895     12.1988  51.1895     12.1988  55.2901    120         34.8247     120         
1 1 1 39 0  33 o 15 24.2954 8.1228  16.7465     11.1926  16.7465     11.1926  13.3339    360         62.3406     360         
1 1 1 39 0  34 o 18 30.245  7.51421 22.5222     10.3249  22.5222     10.3249  22.3925    60          1.17676     60          
1 1 1 39 0  35 o 4  15.1131 6.69218 3.50053     10.4656  3.50053     10.4656  18.0161    300         57.7574     300         
1 1 1 39 0  36 o 8  11.3541 5.46297 -4.31174    9.48842  -4.31174    9.48842  2.49754    180         11.8845     180         
1 1 1 39 0  37 o 6  42.5007 6.02191 37.3398     11.3774  37.3398     11.3774  32.872     240         3.80187     240         
1 1 1 39 0  38 o 2  14.2843 6.43576 2.25641     10.1622  2.25641     10.1622  0.349102   300         10.8776     120         
1 1 1 39 0  39 o 16 16.4593 6.95208 6.48028     10.1545  6.48028     10.1545  14.3837    180         52.243      180         
1 1 1 39 0  40 o 7  8.49654 4.33034 -15.5416    9.24879  -15.5416    9.24879  10.807     60          28.2854     60          
1 1 1 39 0  41 o 13 11.3262 5.49895 -5.57665    10.1004  -5.57665    10.1004  2.07846    300         8.77794     300         
1 1 1 39 0  42 o 1  12.1318 5.78817 -3.17617    10.2117  -3.17617    10.2117  2.07256    8.82026e-06 10.1377     8.82026e-06 
1 1 1 39 0  43 o 13 43.1344 6.92184 40.3286     13.0449  40.3286     13.0449  37.3498    240         12.7493     240         
1 1 1 39 0  44 o 19 15.1946 6.85071 3.00333     11.5393  3.00333     11.5393  0.1073     300         9.46097     120         
1 1 1 39 0  45 o 17 18.813  7.76897 9.80104     12.1833  9.80104     12.1833  2.13074    1.06167e-06 19.027      180         
1 1 1 39 0  46 o 8  19.8956 8.01737 11.5522     12.5019  11.5522     12.5019  7.43192    60          5.19166     240         
1 1 1 39 0  47 o 1  40.2009 7.72372 37.1884     13.4485  37.1884     13.4485  29.4123    300         1.59534     300         
1 1 1 39 0  48 o 7  9.39031 4.77722 -17.3392    11.0269  -17.3392    11.0269  0.361321   2.27529e-05 1.23233     2.27529e-05 
1 1 1 39 0  49 o 19 14.7376 6.87546 0.00552573  13.0707  0.00552573  13.0707  1.73222    60          5.30512     240         
1 1 1 39 0  50 o 3  43.2234 7.64189 42.4018     14.32    42.4018     14.32    35.6307    300         10.2118     300         
1 1 1 39 0  51 o 3  11.8888 5.90412 -11.4365    13.5084  -11.4365    13.5084  2.34992    8.77249e-06 13.6902     8.77248e-06 
1 1 1 39 0  52 o 16 18.6483 8.13899 9.02617     14.9281  9.02617     14.9281  4.22248    60          1.02395     240         
1 1 1 39 0  53 o 18 12.3211 6.09068 -9.80849    13.8987  -9.80849    13.8987  3.84342    300         17.5373     300         
1 1 1 39 0  54 f 0  12.1003 6.0364  -12.5429    14.6278  -12.5429    14.6278  8.40361    180         0           0           
1 1 1 39 0  55 o 17 23.1764 9.28866 19.3184     16.6561  19.3184     16.6561  2.91813    60          0.444653    60          
1 1 1 39 0  56 o 3  23.3676 9.79244 20.7381     19.8533  20.7381     19.8533  7.85679    300         1.49809     120         
1 1 1 39 0  57 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 1  0  o 16 16.7405 6.71324 6.99398     8.70719  6.99398     8.70719  4.70363    180         27.8345     180         
1 1 1 39 1  1  o 17 29.2308 5.88896 22.832      9.59595  10.2068     9.2386   8.76122    114.413     3.91323     114.413     
1 1 1 39 1  2  o 13 35.9647 5.68285 20.2741     9.96687  30.4652     10.1147  15.7419    131.359     17.8414     311.359     
1 1 1 39 1  3  o 1  20.0276 5.67869 -2.65475    9.28004  8.57143     9.024    1.07106    65.1838     17.3308     245.184     
1 1 1 39 1  4  o 2  22.9448 6.01886 5.71076     9.28861  10.5719     9.31746  0.158047   43.6915     28.3375     43.6916     
1 1 1 39 1  5  o 19 58.0573 4.49983 66.0683     12.5137  59.5756     13.1515  34.9806    342.675     14.7808     162.675     
1 1 1 39 1  6  o 14 15.1028 4.90298 0.517794    9.2675   -17.4554    8.55452  1.63936    280.744     9.64736     280.744     
1 1 1 39 1  7  o 1  111.342 3.06863 225.116     16.4951  223.223     17.657   93.8962    33.3542     21.3008     33.3542     
1 1 1 39 1  8  o 6  87.8789 3.09257 131.575     13.3502  148.331     13.7883  78.1407    300.535     26.1793     300.535     
1 1 1 39 1  9  o 1  54.845  4.11098 45.1866     10.8174  67.2381     11.0669  54.609     57.2372     33.9951     57.2372     
1 1 1 39 1  10 o 10 29.8903 6.05495 17.7726     9.57195  17.2642     9.49816  16.7852    77.4075     0.859785    257.408     
1 1 1 39 1  11 o 6  90.6031 3.12789 150.85      14.1274  146.682     14.1879  94.5687    45.3844     56.0694     45.3844     
1 1 1 39 1  12 o 18 125.403 2.89886 288.874     18.2618  278.927     18.1227  130.913    358.828     75.0625     358.828     
1 1 1 39 1  13 o 19 19.0126 5.58965 -0.422097   8.7748   4.81967     8.99097  1.92367    178.546     10.0373     358.546     
1 1 1 39 1  14 o 4  76.596  3.37826 102.855     12.9124  111.009     12.8763  49.2795    289.484     14.6826     109.484     
1 1 1 39 1  15 o 7  53.6948 4.2084  56.9683     11.0642  50.3605     11.1534  55.0853    189.754     38.7655     189.754     
1 1 1 39 1  16 o 7  126.749 2.93668 281.252     18.9437  299.546     18.2692  104.768    61.3603     20.3892     61.3603     
1 1 1 39 1  17 o 11 24.9417 6.08884 16.7463     10.0483  4.68842     9.31963  4.88609    110.314     21.1781     290.314     
1 1 1 39 1  18 o 1  136.98  3.02996 342.058     19.4976  337.169     21.9512  125.928    348.27      47.7859     348.27      
1 1 1 39 1  19 o 2  102.679 3.09608 186.978     16.3005  195.471     15.4497  87.4273    201.871     22.8172     201.871     
1 1 1 39 1  20 o 5  57.4932 3.93642 62.2356     11.0634  60.1201     11.3255  42.166     73.5734     1.49879     73.5733     
1 1 1 39 1  21 o 14 33.436  6.1516  28.846      11.3878  16.3493     9.72934  15.1575    356.349     14.647      176.349     
1 1 1 39 1  22 o 7  19.3415 5.52574 -10.1408    8.85176  10.9048     9.87026  3.27639    274.071     10.6384     94.0708     
1 1 1 39 1  23 o 14 122.205 3.22632 282.931     20.1982  260.788     19.2525  109.566    326.576     38.2509     326.576     
1 1 1 39 1  24 o 1  53.5142 4.38776 51.1559     11.1041  56.5159     12.0003  37.2502    347.878     2.25528     167.878     
1 1 1 39 1  25 o 11 26.9376 6.20407 12.8893     9.64478  15.1861     9.61107  12.9122    222.638     7.36518     42.6382     
1 1 1 39 1  26 o 9  27.2749 6.18234 15.927      9.56731  13.167      9.61833  13.9071    88.7898     6.04113     268.79      
1 1 1 39 1  27 o 5  29.8367 6.25842 20.2952     10.3116  15.6615     9.82711  20.5119    310.139     10.1746     310.139     
1 1 1 39 1  28 o 7  31.187  6.11994 8.45279     10.8713  30.254      10.8862  4.09533    311.836     52.0957     311.836     
1 1 1 39 1  29 o 18 75.5776 3.68872 107.772     14.4334  103.931     13.3295  66.2467    280.555     22.7725     280.555     
1 1 1 39 1  30 o 15 56.8053 4.35136 58.3345     12.5891  64.0537     11.6769  20.4323    233.906     41.5602     53.906      
1 1 1 39 1  31 o 9  29.3508 6.49711 16.3545     11.0915  19.0024     10.2484  17.8821    277.63      1.51307     97.6298     
1 1 1 39 1  32 o 2  46.9226 5.34969 44.3586     12.1731  42.8986     12.1289  32.193     322.943     1.81512     142.943     
1 1 1 39 1  33 o 6  32.2105 6.5779  26.117      11.4299  17.8172     11.2732  15.6292    130.294     12.2143     310.294     
1 1 1 39 1  34 o 10 33.5024 6.46699 15.5967     11.6258  32.1032     11.6684  25.1177    208.428     7.30194     208.428     
1 1 1 39 1  35 o 2  16.7777 5.44083 -8.73016    10.4637  -1.63073    10.4767  0.499912   86.0528     19.5803     86.0528     
1 1 1 39 1  36 o 19 37.9129 6.41462 25.9963     12.1147  35.4785     12.088   28.3117    6.60933     6.10206     6.60933     
1 1 1 39 1  37 o 1  33.3399 7.02282 21.2924     13.264   27.7372     12.2687  20.6452    333.591     2.31709     153.591     
1 1 1 39 1  38 o 2  66.8843 4.45831 82.736      13.3376  90.45       16.1348  45.0228    234.007     5.49113     54.0066     
1 1 1 39 1  39 o 6  18.8114 5.86438 2.47593     10.4641  -2.80185    11.3009  3.905      196.627     11.0334     16.6266     
1 1 1 39 1  40 o 8  18.2944 5.88312 -3.6714     11.3274  -2.4723     12.2515  1.80474    41.5993     15.3263     221.599     
1 1 1 39 1  41 o 6  29.616  6.85421 6.72259     12.2173  30.5233     13.4546  18.8848    320.711     4.42003     320.711     
1 1 1 39 1  42 o 15 40.5564 6.64593 36.4444     12.9538  35.6462     13.5364  26.2972    72.9091     1.44689     252.909     
1 1 1 39 1  43 o 14 34.5492 6.76572 37.5712     12.8335  15.6542     13.1425  23.3829    80.94       3.41723     80.94       
1 1 1 39 1  44 o 4  44.561  6.61072 35.4023     13.7513  51.7618     14.9172  38.5849    248.638     19.0711     248.638     
1 1 1 39 1  45 o 12 21.8804 6.44396 11.4147     11.995   -2.07358    12.4486  8.50159    136.147     0.434127    136.147     
1 1 1 39 1  46 o 12 34.4657 6.71319 39.2376     13.0111  13.5021     13.2028  23.91      261.779     17.9396     261.779     
1 1 1 39 1  47 o 12 17.8304 5.80404 -4.45718    11.775   -4.55576    12.1395  4.46937    144.684     2.33181     324.684     
1 1 1 39 1  48 o 4  29.3813 7.66584 26.6228     15.5732  12.2104     15.0983  19.6854    168.298     5.92918     168.298     
1 1 1 39 1  49 o 16 24.5095 7.24334 3.81775     14.9606  15.213      15.2816  8.71517    154.823     12.2525     334.823     
1 1 1 39 1  50 o 9  48.2821 7.177   55.6052     16.5459  52.8832     17.0787  36.5138    113.816     8.25925     113.816     
1 1 1 39 1  51 o 14 28.2438 7.74546 24.5904     16.2181  13.6336     15.5232  13.2719    190.769     7.58975     10.7687     
1 1 1 39 1  52 o 13 29.497  7.93364 20.6931     16.197   24.9637     16.3072  17.3858    338.212     2.32687     338.212     
1 1 1 39 1  53 f 0  15.1162 5.2684  -15.4578    14.2951  -27.6535    14.1707  11.1959    237.809     0           0           
1 1 1 39 1  54 o 9  22.8738 7.07604 -5.95143    16.2819  17.9157     16.2678  5.09553    138.935     0.446153    318.935     
1 1 1 39 1  55 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 1  56 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 2  0  o 18 15.3412 6.44735 5.04724     8.65151  5.04724     8.65151  0.356593   360         4.11949     360         
1 1 1 39 2  1  o 10 28.6247 5.92557 18.6632     9.10708  13.2675     9.14704  14.7653    152.934     4.5023      152.934     
1 1 1 39 2  2  o 1  51.1595 4.16296 43.0494     10.348   54.617      10.4767  28.2026    306.68      18.008      126.679     
1 1 1 39 2  3  o 3  19.2776 5.63792 3.74309     9.04373  1.92331     8.71958  1.90826    213.827     3.75647     33.8269     
1 1 1 39 2  4  o 5  23.7619 6.00152 13.201      9.38232  5.63442     9.09753  7.74145    357.797     9.75559     177.797     
1 1 1 39 2  5  o 11 96.4485 3.2049  171.939     15.9036  165.825     14.9898  82.6909    266.437     21.3935     266.437     
1 1 1 39 2  6  o 12 70.4897 3.62481 89.4377     12.6561  92.5935     12.7771  68.1603    69.6398     33.6325     69.6398     
1 1 1 39 2  7  o 10 156.039 2.99068 433.284     23.9057  447.171     22.7859  125.084    174.27      14.881      174.27      
1 1 1 39 2  8  o 9  41.9252 5.4939  36.6931     10.7458  31.5132     11.4286  14.059     141.605     32.0484     321.605     
1 1 1 39 2  9  o 1  30.0443 5.89671 8.05804     9.90302  26.7915     10.0271  11.6162    200.513     16.3471     20.5134     
1 1 1 39 2  10 o 16 17.871  5.50818 -2.12212    9.29793  0.746575    9.29523  2.30624    294.53      22.8522     294.53      
1 1 1 39 2  11 o 17 53.3792 4.35158 61.8897     10.7255  45.1357     11.6254  47.902     239.279     20.3708     239.279     
1 1 1 39 2  12 o 11 82.0488 3.48305 132.512     13.9303  113.728     14.4599  73.6501    194.473     26.1466     194.473     
1 1 1 39 2  13 o 8  24.6977 6.08484 13.5924     9.13866  7.79117     9.67625  7.33792    10.898      14.874      190.898     
1 1 1 39 2  14 o 4  91.2574 3.11871 159.785     13.9945  142.838     14.3834  72.0943    140.201     8.50142     140.201     
1 1 1 39 2  15 o 11 21.1799 5.88807 7.28359     9.18294  4.21723     9.20003  5.05026    156.252     10.4389     336.252     
1 1 1 39 2  16 o 17 72.2411 3.52834 87.5103     12.5341  104.07      12.7988  52.0237    184.191     2.41745     4.19123     
1 1 1 39 2  17 o 17 27.6343 6.30423 7.15532     10.5649  21.1228     10.5001  9.63903    74.4497     4.36404     74.4497     
1 1 1 39 2  18 o 15 57.4987 4.07308 63.7697     11.6268  59.2534     11.5199  33.5946    213.108     16.7749     33.1077     
1 1 1 39 2  19 o 16 35.5039 5.80573 20.2667     10.1969  30.0392     10.1985  15.4503    306.605     18.3832     126.605     
1 1 1 39 2  20 o 14 74.1172 3.61187 112.778     13.2306  89.8207     13.2804  50.0306    277.572     9.23018     97.572      
1 1 1 39 2  21 o 3  29.179  6.34701 17.8668     10.6225  16.0781     9.74759  19.0054    323.094     5.74483     323.094     
1 1 1 39 2  22 o 18 39.2345 6.14465 32.2619     12.5403  29.7183     10.9879  18.4406    71.4176     18.4725     251.418     
1 1 1 39 2  23 o 15 93.1346 3.38375 153.244     15.5982  164.784     15.8747  92.8404    153.663     48.7017     153.663     
1 1 1 39 2  24 o 7  32.1371 6.2829  19.5091     10.7011  22.5978     10.2759  24.8873    115.975     12.2278     115.975     
1 1 1 39 2  25 o 14 60.8424 3.96203 63.1986     11.8551  75.3731     11.9566  39.8368    160.379     9.083       340.379     
1 1 1 39 2  26 o 15 58.8256 4.05019 67.6146     11.7668  62.3037     11.7901  60.0165    270.245     36.6295     270.245     
1 1 1 39 2  27 f 0  57.0901 4.2498  73.7952     11.8366  50.463      11.7071  38.4242    347.264     0           0           
1 1 1 39 2  28 o 5  23.0703 6.2935  9.38551     10.7381  7.7496      9.85937  9.11908    6.28033     2.89703     6.28033     
1 1 1 39 2  29 o 4  62.0732 4.18728 71.327      12.5065  74.6325     13.2298  40.1132    67.4755     9.97667     247.476     
1 1 1 39 2  30 o 17 35.0503 6.08517 24.1816     10.5354  26.8704     10.6953  21.4366    51.9584     5.0338      231.958     
1 1 1 39 2  31 o 8  19.4371 5.67258 -7.02712    9.75769  9.73551     9.76472  4.57576    206.712     13.1626     26.7118     
1 1 1 39 2  32 o 5  62.0821 4.10856 77.9019     12.5295  68.7285     12.6759  55.3037    35.6213     21.7122     35.6213     
1 1 1 39 2  33 o 1  81.3797 3.60757 121.048     15.0278  126.767     14.2047  72.4366    354.315     26.9611     354.315     
1 1 1 39 2  34 o 4  19.0353 5.85356 2.71754     10.9809  -0.203001   9.84092  5.669      107.741     2.80791     287.741     
1 1 1 39 2  35 o 15 22.4821 6.23138 -0.969159   11.4984  13.8244     10.5185  9.88541    149.727     4.82639     329.727     
1 1 1 39 2  36 o 2  25.9512 6.59045 7.37041     12.3198  18.05       10.6344  6.79326    75.1767     20.1461     255.177     
1 1 1 39 2  37 o 16 22.6955 6.61943 7.82105     12.8136  6.48124     11.5489  8.86421    347.524     1.08619     347.524     
1 1 1 39 2  38 o 10 35.2519 7.24939 28.1737     14.0852  28.4167     13.0838  19.4928    57.3788     7.87951     237.379     
1 1 1 39 2  39 o 13 19.1216 5.98423 -15.8831    13.4625  6.87723     11.4299  4.07544    300.627     3.08289     120.627     
1 1 1 39 2  40 o 8  57.8316 5.88578 61.671      16.8964  77.559      15.7485  45.8715    269.824     11.1418     269.824     
1 1 1 39 2  41 o 2  27.3015 7.11778 3.81358     13.577   25.0113     14.1081  8.54738    205.807     4.41495     205.807     
1 1 1 39 2  42 o 10 20.5607 6.41082 -1.77426    12.1841  4.69683     13.6199  6.51724    300.19      6.61178     120.19      
1 1 1 39 2  43 o 19 62.6199 5.1148  75.2978     14.8838  82.0629     16.6256  59.5827    164.765     32.3624     164.765     
1 1 1 39 2  44 o 1  26.8521 7.21407 13.2103     12.6186  16.5698     14.1686  15.9957    130.386     1.03023     130.386     
1 1 1 39 2  45 o 19 22.4467 6.86959 2.38805     12.2198  8.062       16.0175  10.785     52.0894     0.227662    52.0894     
1 1 1 39 2  46 o 19 18.175  6.08042 -11.5677    13.4455  -7.26511    15.6781  4.88145    219.704     7.48348     39.7038     
1 1 1 39 2  47 o 16 22.7809 7.07697 -1.95064    14.463   11.2371     16.8407  10.9363    346.612     0.212284    166.612     
1 1 1 39 2  48 o 2  21.0289 6.7865  -3.74823    14.9845  2.61919     16.7193  7.44875    223.327     0.629323    223.327     
1 1 1 39 2  49 o 13 22.3402 6.92788 -7.41564    15.0904  14.2901     15.8928  9.21936    45.4051     4.49065     225.405     
1 1 1 39 2  50 o 4  23.4312 7.20665 -0.557985   16.1821  15.1576     16.2447  9.39887    302.101     0.871132    302.101     
1 1 1 39 2  51 o 4  22.5277 6.99489 15.4027     15.6176  -6.68912    16.5354  6.94419    50.4862     0.25747     230.486     
1 1 1 39 2  52 o 14 24.4735 7.42289 18.0269     16.1292  4.53636     17.4669  8.78101    307.552     0.380272    307.552     
1 1 1 39 2  53 o 8  31.1324 8.22463 19.6375     17.1135  37.3455     18.2671  17.4216    232.496     1.00231     232.496     
1 1 1 39 2  54 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 3  0  o 17 23.9659 7.44701 15.3337     9.35207  15.3337     9.35207  6.28285    180         21.8675     360         
1 1 1 39 3  1  o 10 15.0459 4.90152 -4.77852    8.43023  -6.51454    8.69344  0.54866    149.626     6.09946     149.626     
1 1 1 39 3  2  o 18 52.5922 4.19645 51.3764     10.9557  51.7675     10.7767  44.7486    231.374     14.2022     231.374     
1 1 1 39 3  3  o 1  67.121  3.54045 89.0866     11.8796  76.2925     11.7186  31.6108    38.3402     36.8144     218.34      
1 1 1 39 3  4  o 15 46.8856 4.67503 36.1399     10.4617  47.4217     10.7556  42.2734    156.539     19.8709     156.539     
1 1 1 39 3  5  o 16 40.0581 5.35643 40.8347     10.5131  22.5481     10.0814  16.4986    127.582     24.2341     307.582     
1 1 1 39 3  6  o 7  25.5376 5.97865 6.07981     9.48361  17.2517     9.26818  12.0581    306.055     1.99337     126.055     
1 1 1 39 3  7  f 0  72.6963 3.39332 91.6029     12.3106  101.688     12.2429  42.8361    350.783     0           0           
1 1 1 39 3  8  o 8  20.3531 5.85452 4.99163     9.85532  3.48417     8.87332  4.35818    109.25      4.54091     289.25      
1 1 1 39 3  9  o 11 86.365  3.32824 132.849     14.392   139.312     14.2997  80.0185    273.074     31.7402     273.074     
1 1 1 39 3  10 o 15 22.2501 6.09706 9.81811     9.77914  3.64714     9.92679  7.346      309.652     4.00933     129.652     
1 1 1 39 3  11 o 11 53.1064 4.52378 54.1823     11.7738  52.0469     11.8145  29.7504    357.323     18.1859     177.323     
1 1 1 39 3  12 o 9  39.8108 5.70675 28.9456     10.8707  33.5762     11.1228  28.1979    320.837     1.44894     320.837     
1 1 1 39 3  13 o 10 34.0628 6.21303 24.6128     10.7009  22.1111     10.6677  24.8878    9.26854     6.51534     9.26854     
1 1 1 39 3  14 o 8  81.0722 3.4333  119.169     12.9889  121.52      14.7346  65.9008    334.454     11.4052     334.454     
1 1 1 39 3  15 o 16 42.5303 5.48879 33.6227     10.4973  37.1756     12.0392  15.2773    280.498     30.9098     100.498     
1 1 1 39 3  16 o 8  92.2773 3.34009 156.311     15.1733  155.036     15.61    93.7614    290.81      50.86       290.81      
1 1 1 39 3  17 o 8  43.4559 5.41664 35.4512     10.9783  38.3913     11.7562  38.8042    243.525     18.1736     243.525     
1 1 1 39 3  18 o 13 24.4421 6.20545 9.18498     9.57831  12.1067     9.8145   2.98035    28.9221     26.4322     208.922     
1 1 1 39 3  19 o 15 59.3086 4.15497 72.8307     11.6844  59.2872     12.4433  51.6176    72.886      17.0655     72.886      
1 1 1 39 3  20 o 7  26.908  6.34844 9.88712     10.5236  17.7729     10.0557  8.49629    140.477     19.0172     320.477     
1 1 1 39 3  21 o 13 89.6037 3.63204 153.718     17.0164  143.082     15.4667  72.1651    349.349     11.3517     349.349     
1 1 1 39 3  22 o 15 45.1516 5.10064 43.7669     10.8078  35.8829     11.3435  36.7088    47.7473     9.59013     47.7473     
1 1 1 39 3  23 o 10 25.2445 6.69919 14.3158     10.0663  5.38305     14.1483  14.4895    39.3316     1.22398     39.3316     
1 1 1 39 3  24 o 4  72.9024 3.80309 97.6596     13.8968  100.632     13.6887  50.7063    0.00174998  6.01566     180.002     
1 1 1 39 3  25 o 4  29.0465 6.4017  14.8496     10.4573  19.8497     10.3459  12.5319    43.0421     14.0963     223.042     
1 1 1 39 3  26 o 7  27.5663 6.391   14.2379     10.1693  16.7025     10.2439  17.0669    179.636     0.195484    359.636     
1 1 1 39 3  27 o 5  34.464  6.16417 22.5377     10.5713  27.1489     10.7808  14.6251    227.638     18.968      47.6379     
1 1 1 39 3  28 o 19 22.8564 6.32626 9.8788      11.0296  6.85903     10.0339  10.4984    134.192     5.67418     314.192     
1 1 1 39 3  29 o 5  23.4742 6.48991 6.39286     10.5167  11.769      11.6991  12.378     114.762     0.00640058  114.77      
1 1 1 39 3  30 o 7  40.5786 5.7163  30.5231     11.1437  37.2405     11.2828  21.6806    270.469     13.9576     90.4689     
1 1 1 39 3  31 o 16 33.9971 6.27715 23.9648     10.9265  25.4069     10.7016  19.618     153.726     7.02151     333.726     
1 1 1 39 3  32 o 7  20.5874 6.01369 10.2705     10.2853  -4.65061    11.3539  7.03553    152.976     0.0534204   332.975     
1 1 1 39 3  33 o 18 28.5493 6.73638 19.8201     11.0001  14.9219     11.8696  16.6646    186.532     2.59534     6.53201     
1 1 1 39 3  34 o 5  20.158  6.09973 -4.12822    11.1875  8.08234     11.4549  2.55644    134.064     0.115452    134.064     
1 1 1 39 3  35 o 4  20.801  6.27569 7.54158     11.8473  -0.8799     11.5791  7.25246    1.75792     5.8508      181.758     
1 1 1 39 3  36 o 12 25.5785 6.82799 9.50587     11.8415  16.1097     12.2865  3.79463    204.901     25.6823     24.9013     
1 1 1 39 3  37 o 4  25.6848 6.98112 21.5392     14.2944  2.96769     12.1324  12.6723    183.044     3.43        3.04367     
1 1 1 39 3  38 o 3  19.218  6.20165 -1.94591    13.0469  -4.26536    13.5034  4.19535    43.0954     4.96177     223.095     
1 1 1 39 3  39 o 11 67.4296 4.9564  89.9573     17.539   91.2413     15.3101  66.6902    157.918     38.9794     157.918     
1 1 1 39 3  40 o 10 34.3858 7.36807 25.1066     14.946   29.6118     12.9737  26.5015    123.345     11.7989     123.345     
1 1 1 39 3  41 o 6  41.5085 6.91187 46.6556     14.9062  30.9702     13.5962  35.9612    12.7574     17.802      12.7574     
1 1 1 39 3  42 o 3  24.2907 7.08681 13.6549     14.2012  4.15798     14.1827  9.30834    51.4796     11.2219     231.48      
1 1 1 39 3  43 o 6  48.8234 7.44041 65.3615     18.5505  44.9832     16.9291  41.4321    347.844     16.4158     347.844     
1 1 1 39 3  44 o 10 26.1893 7.38496 -3.58742    17.2533  23.3163     15.3013  14.6276    188.264     1.60471     8.26447     
1 1 1 39 3  45 o 19 21.4365 6.71448 -7.44391    14.5241  9.69879     14.9398  7.09634    194.776     1.68842     194.776     
1 1 1 39 3  46 o 10 25.1279 6.88445 27.8839     15.1626  -18.1276    15.7526  5.77081    18.5172     20.6631     198.517     
1 1 1 39 3  47 o 13 24.9564 7.5643  13.5443     16.6218  8.10373     17.3864  13.1729    229.587     1.60078     229.587     
1 1 1 39 3  48 o 12 19.3842 6.50838 -8.21635    14.9892  -6.70436    18.9252  1.13399    43.606      19.5935     223.606     
1 1 1 39 3  49 o 9  27.4858 8.11481 15.1137     16.1208  24.2872     21.0344  14.752     11.8866     1.86388     11.8866     
1 1 1 39 3  50 o 16 25.3689 7.8744  13.4317     17.6739  14.1782     20.9066  10.6499    154.139     0.63619     154.139     
1 1 1 39 3  51 o 12 21.2399 6.99314 5.07375     16.7952  -7.07509    20.2868  4.56795    11.7134     2.83557     191.713     
1 1 1 39 3  52 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 3  53 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 4  0  o 6  55.7117 4.43277 58.3514     11.9736  58.3514     11.9736  46.8426    1.81513e-05 8.84938     1.81513e-05 
1 1 1 39 4  1  o 12 56.3532 4.13432 48.906      11.4156  70.5372     11.1484  42.9415    202.588     3.22153     202.588     
1 1 1 39 4  2  o 7  22.6468 5.55288 -6.42394    9.4546   17.5316     9.27261  7.11913    225.594     12.468      45.5941     
1 1 1 39 4  3  o 2  63.3252 3.80689 80.6191     11.9978  67.9832     11.8686  30.3361    245.812     33.8385     65.8116     
1 1 1 39 4  4  o 11 29.5366 6.20562 13.7143     10.1377  20.9107     9.8898   19.1278    332.926     8.29163     332.926     
1 1 1 39 4  5  o 16 14.8386 4.82733 -18.8106    9.37777  0.130161    8.50716  0.053216   173.597     3.67152     353.597     
1 1 1 39 4  6  o 1  21.0024 5.84873 7.50378     9.11424  3.91715     9.07774  5.55357    319.368     1.20308     139.368     
1 1 1 39 4  7  o 16 33.0671 6.01569 20.961      9.94709  23.008      10.1143  13.4304    119.231     19.2963     299.231     
1 1 1 39 4  8  o 11 20.1966 5.77451 2.10466     9.07683  6.51654     9.17275  0.742724   114.073     26.7128     114.073     
1 1 1 39 4  9  o 5  52.0296 4.54104 46.3561     11.4966  56.3463     11.5741  51.1748    140.012     28.6905     140.012     
1 1 1 39 4  10 o 16 31.9005 6.05726 18.8275     9.8412   22.2311     9.9718   23.1031    191.122     5.77224     191.122     
1 1 1 39 4  11 o 17 114.212 2.92116 240.531     16.5389  233.195     16.8356  91.6204    112.041     11.2241     112.041     
1 1 1 39 4  12 o 6  75.7077 3.69839 98.659      14.6687  113.323     12.9602  64.1431    76.2565     15.6784     76.2565     
1 1 1 39 4  13 o 4  29.4102 6.05814 26.9167     10.5017  6.61287     10.4125  15.9956    257.774     7.10197     77.7738     
1 1 1 39 4  14 o 8  34.4267 6.14354 22.8318     10.888   25.4327     10.3425  15.8824    273.92      16.6992     93.9198     
1 1 1 39 4  15 o 10 33.9422 6.21532 31.304      10.9125  15.9181     11.1685  1.36269    273.828     51.8004     273.828     
1 1 1 39 4  16 o 15 85.8095 3.49004 140.148     14.8491  131.368     15.0202  93.7559    114.068     60.713      114.068     
1 1 1 39 4  17 o 3  77.3164 3.69567 102.503     14.1234  119.56      14.2872  56.3658    122.153     2.42001     302.152     
1 1 1 39 4  18 o 6  30.7092 6.42475 18.5937     10.2047  20.3593     10.9605  12.7732    123.679     16.8789     303.679     
1 1 1 39 4  19 o 16 21.2557 5.98577 10.429      9.65141  -0.983867   10.5375  6.90808    263.195     11.5745     83.1948     
1 1 1 39 4  20 f 0  23.9797 6.56552 9.80685     11.4315  8.9982      11.0479  15.2031    193.683     0           0           
1 1 1 39 4  21 o 16 55.8797 4.53658 65.051      12.399   54.9219     12.4449  36.5146    252.161     8.90321     72.1614     
1 1 1 39 4  22 o 18 24.1353 6.29442 10.5772     9.92109  10.613      10.1664  13.6867    253.345     2.76232     253.345     
1 1 1 39 4  23 o 12 37.954  6.12787 34.2119     10.8056  25.7305     12.1147  26.4929    297.339     0.0539532   297.337     
1 1 1 39 4  24 o 15 70.9056 3.95424 93.8771     13.2447  95.861      14.6011  34.3646    198.916     36.2773     18.9155     
1 1 1 39 4  25 o 8  16.5408 5.339   -4.58791    9.9721   -3.45812    9.70682  3.04649    326.859     3.50731     146.859     
1 1 1 39 4  26 o 12 27.5606 6.48419 13.4329     10.4719  18.0757     10.6073  16.1684    189.072     9.26198     189.072     
1 1 1 39 4  27 o 7  22.9404 6.2651  10.8008     10.183   6.90777     10.3789  10.0934    338.23      7.15681     158.23      
1 1 1 39 4  28 o 16 53.0486 4.95302 58.4931     13.2079  52.9697     12.4857  50.1262    255.415     25.143      255.415     
1 1 1 39 4  29 o 17 22.5505 6.40693 1.69821     11.1682  12.5254     11.5973  7.65888    103.833     12.2312     283.833     
1 1 1 39 4  30 o 6  46.0189 6.18267 32.4003     12.7133  58.6972     14.769   34.0494    47.5819     3.23527     47.5818     
1 1 1 39 4  31 o 2  22.911  6.51358 12.4398     11.8017  3.07753     11.5826  3.5741     263.91      22.2241     83.9104     
1 1 1 39 4  32 o 7  19.1466 5.96229 4.87428     11.4082  -5.39419    11.2921  5.08251    32.8056     2.59631     212.806     
1 1 1 39 4  33 o 15 40.0217 6.59704 37.2847     12.9094  32.8929     13.0908  27.4528    71.7733     0.144913    71.773      
1 1 1 39 4  34 o 13 21.6269 6.05297 -17.6436    12.6825  17.2365     11.4986  6.65485    243.236     0.248845    243.236     
1 1 1 39 4  35 o 1  18.6961 5.9314  -6.13023    11.3153  2.92472     11.9865  2.67409    232.822     13.507      52.8222     
1 1 1 39 4  36 o 14 24.8347 6.45095 -2.55748    11.9014  22.0935     12.1177  1.49328    198.955     35.8133     198.955     
1 1 1 39 4  37 o 14 28.8579 6.70057 30.0497     12.7716  3.06124     13.0603  4.67358    278.844     29.4644     98.8439     
1 1 1 39 4  38 o 4  21.1319 6.17755 -15.9133    11.8556  16.24       12.7666  7.35191    171.81      0.132492    171.81      
1 1 1 39 4  39 o 10 22.4822 6.61316 15.346      12.9205  -12.7702    15.2304  10.6776    34.1835     0.171456    214.183     
1 1 1 39 4  40 o 18 23.3741 7.01822 1.64034     14.0029  11.7252     14.9331  9.72632    256.041     8.64701     76.0408     
1 1 1 39 4  41 o 10 35.6129 8.36942 45.8997     20.0187  19.3577     15.9407  19.2909    182.214     9.2739      2.21427     
1 1 1 39 4  42 o 15 22.5484 7.19064 4.85088     18.4324  -1.01515    15.8316  10.4891    236.131     3.36949     56.1311     
1 1 1 39 4  43 o 15 46.6985 8.06097 45.7457     20.0964  62.6181     17.9481  38.8029    35.9031     14.4926     35.9031     
1 1 1 39 4  44 o 2  24.456  7.48772 2.41064     18.6806  13.497      16.013   13.2077    230.254     0.424401    230.254     
1 1 1 39 4  45 f 0  22.146  7.19713 8.65756     20.1876  -6.39495    15.9978  7.47413    185.426     0           0           
1 1 1 39 4  46 o 13 28.2637 8.24734 13.4848     21.7596  25.0058     17.661   15.4276    227.314     6.91285     227.314     
1 1 1 39 4  47 f 0  22.8786 7.32566 -2.88878    21.4085  10.0913     16.1633  8.5863     187.537     0           0           
1 1 1 39 4  48 o 8  25.0653 7.64881 12.941      17.6882  14.4138     17.3589  9.4959     218.31      1.81529     218.31      
1 1 1 39 4  49 o 13 19.4013 6.42144 -18.443     16.4353  6.36324     15.9633  2.10475    196.789     2.03139     16.789      
1 1 1 39 4  50 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 4  51 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 5  0  o 5  64.6661 3.75895 77.0873     11.9857  77.0873     11.9857  44.0513    7.84661e-06 10.5318     180         
1 1 1 39 5  1  f 0  91.4283 3.15156 149.712     14.381   155.926     14.4075  67.9311    74.2985     0           0           
1 1 1 39 5  2  o 13 20.1796 5.88234 6.54673     9.76415  0.630543    9.71459  7.01004    23.628      2.12372     203.628     
1 1 1 39 5  3  o 9  22.2038 6.0394  11.1233     9.61203  2.79036     9.88701  10.0707    323.641     0.0121173   143.639     
1 1 1 39 5  4  o 4  23.7262 6.15266 5.02796     9.89393  13.6708     9.8274   12.6236    31.08       0.715181    31.08       
1 1 1 39 5  5  o 6  23.2231 5.99492 15.1922     9.78535  1.12534     9.73595  10.9077    106.41      2.76733     106.41      
1 1 1 39 5  6  o 13 19.3479 5.67862 -1.93709    9.23687  6.83224     9.37636  6.34987    204.975     3.00962     24.9748     
1 1 1 39 5  7  o 3  28.5126 6.12278 10.5288     9.95787  21.7881     9.83759  16.6521    44.0197     4.3487      224.02      
1 1 1 39 5  8  o 16 47.5887 4.7419  41.7131     10.9024  45.4763     11.0771  39.2897    57.522      9.66577     57.522      
1 1 1 39 5  9  o 9  22.4338 5.90995 14.8673     9.88527  -1.36318    9.5887   11.1163    291.438     0.80912     111.438     
1 1 1 39 5  10 o 16 69.8335 3.7365  83.2885     12.5416  98.4048     13.4041  53.9767    220.456     3.66195     220.456     
1 1 1 39 5  11 o 8  111.583 3.00509 226.95      16.7337  227.75      16.8131  77.6126    291.858     13.3805     111.858     
1 1 1 39 5  12 o 4  30.685  6.24061 21.9302     10.2167  16.8726     10.1178  18.8912    110.857     3.64371     290.857     
1 1 1 39 5  13 f 0  24.3418 6.16532 4.38064     10.3104  15.8242     9.81212  23.1158    71.5967     0           0           
1 1 1 39 5  14 o 15 22.5202 6.18399 4.19706     10.4752  10.7737     9.90604  6.00935    69.0895     16.9904     249.09      
1 1 1 39 5  15 o 19 19.9757 5.91033 5.59574     9.58208  0.627353    10.4926  7.44192    237.589     1.46916     57.5887     
1 1 1 39 5  16 o 11 47.3319 5.41379 47.6565     11.9852  41.5758     12.7045  39.5061    248.514     10.9335     248.514     
1 1 1 39 5  17 o 4  21.1954 6.08215 10.8169     10.9426  -1.10063    9.93091  9.58174    339.088     2.25557     159.088     
1 1 1 39 5  18 o 14 30.7944 6.47821 20.4531     11.1006  19.6062     10.3714  18.1929    240.43      5.4201      60.4297     
1 1 1 39 5  19 o 19 30.5042 6.78611 20.3905     12.3574  19.3238     10.8059  22.0551    46.3192     4.9055      46.3192     
1 1 1 39 5  20 o 2  20.8882 6.13411 7.35255     10.5029  1.38382     10.8958  9.26651    58.5008     1.31224     238.501     
1 1 1 39 5  21 o 17 44.691  5.7356  36.7342     11.9957  45.0636     12.7418  24.623     155.848     15.5804     335.848     
1 1 1 39 5  22 o 5  52.5544 4.81978 55.7344     11.7574  52.6195     12.9229  38.6376    25.9951     0.702433    25.9948     
1 1 1 39 5  23 o 15 48.8106 5.4547  44.6352     11.7565  51.8775     14.0479  34.6211    168.105     1.33865     348.105     
1 1 1 39 5  24 o 3  27.274  6.66651 14.8174     10.4754  16.3501     11.6894  2.95309    350.715     31.818      170.715     
1 1 1 39 5  25 o 16 16.8029 5.49902 -3.18658    9.9244   -9.01008    12.1696  3.42509    221.727     5.69834     41.7272     
1 1 1 39 5  26 o 18 45.4804 6.02446 35.0561     12.8593  52.3625     13.5061  39.3573    117.611     15.0413     117.611     
1 1 1 39 5  27 o 4  29.5007 6.70985 10.1405     11.7503  27.1107     12.1559  21.0608    165.946     6.78797     165.946     
1 1 1 39 5  28 o 15 31.3331 6.68264 7.13887     13.5835  33.6817     12.499   17.9588    322.479     5.88412     142.479     
1 1 1 39 5  29 o 5  43.4172 6.27737 35.9269     13.1584  44.9456     13.2386  38.8256    175.238     18.7435     175.238     
1 1 1 39 5  30 o 19 24.8843 7.01775 7.90745     12.0164  14.6605     14.3458  11.539     184.41      3.56867     184.41      
1 1 1 39 5  31 o 9  22.9449 6.43538 -5.16536    11.883   17.6111     12.4608  10.0584    322.785     3.85797     142.785     
1 1 1 39 5  32 o 15 39.8011 6.83314 38.9571     13.0448  32.0112     14.0772  23.6739    234.581     7.61764     54.5814     
1 1 1 39 5  33 o 3  40.8965 6.89459 31.6078     13.6959  43.9475     14.3391  23.696     0.509404    9.2724      180.509     
1 1 1 39 5  34 f 0  27.1669 7.04136 6.02412     12.4708  24.3575     13.9138  2.76665    211.297     0           0           
1 1 1 39 5  35 o 15 19.026  6.02321 4.94335     11.7869  -10.9826    13.012   3.25262    82.4378     0.811951    262.438     
1 1 1 39 5  36 o 11 24.7274 7.0368  7.31287     13.6078  13.9909     13.4027  8.06532    334.31      3.85932     334.31      
1 1 1 39 5  37 o 18 19.732  6.35615 -7.15128    13.5626  1.58075     14.2824  7.38867    290.613     3.34989     110.613     
1 1 1 39 5  38 o 8  39.7383 7.51848 52.1646     15.9319  22.9323     17.067   27.2039    250.447     0.00770442  70.4301     
1 1 1 39 5  39 o 17 35.9194 8.34518 26.1452     17.3461  39.6498     17.9462  24.3022    75.7867     0.919631    75.7867     
1 1 1 39 5  40 o 6  36.8643 8.44748 44.2183     18.7081  26.9161     17.7381  21.0734    82.2961     7.73331     262.296     
1 1 1 39 5  41 o 3  22.7975 7.05258 -2.19877    15.9718  11.3197     15.4166  8.43931    35.9605     3.11118     35.9605     
1 1 1 39 5  42 o 7  23.8413 7.3384  4.58959     16.8051  11.0642     16.2227  11.4034    29.1263     4.76784     209.126     
1 1 1 39 5  43 o 6  23.1772 7.03655 -11.4468    16.5996  18.8966     15.7512  5.05084    311.329     2.01031     311.329     
1 1 1 39 5  44 o 9  24.741  7.55298 17.8396     17.3274  3.87908     17.5712  11.5407    357.871     2.74704     357.871     
1 1 1 39 5  45 o 4  25.9699 8.0325  23.3072     21.961   7.86588     17.5931  6.27383    65.7607     2.68735     65.7607     
1 1 1 39 5  46 o 5  22.2621 7.32037 10.7152     22.3842  -3.2452     16.3233  7.17131    39.1754     2.16165     219.175     
1 1 1 39 5  47 o 18 20.7827 6.88444 -17.2495    22.4983  6.12935     16.0619  4.90946    267.197     4.11838     87.1968     
1 1 1 39 5  48 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 5  49 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 6  0  o 19 25.5593 7.7091  17.686      10.0521  17.686      10.0521  1.21245    180.004     0.766493    180.004     
1 1 1 39 6  1  o 2  53.932  4.39361 52.6517     11.6361  58.5408     11.6448  50.7284    245.241     22.5533     245.241     
1 1 1 39 6  2  o 18 28.7031 6.27553 14.879      10.0086  18.9814     9.9779   17.9753    119.998     2.01264     299.999     
1 1 1 39 6  3  o 15 20.0453 5.88787 3.85086     9.98147  3.88914     9.49148  4.36745    260.648     15.9887     80.6479     
1 1 1 39 6  4  o 19 60.1352 4.0626  66.9109     12.1295  69.7024     12.0522  50.1249    185.872     10.8417     185.872     
1 1 1 39 6  5  o 11 39.3465 5.60858 21.9196     10.5579  41.7852     10.8334  29.7232    349.096     3.42345     349.096     
1 1 1 39 6  6  o 19 29.8781 6.18578 24.7475     10.2105  11.9282     10.367   23.0206    140.217     12.5275     140.217     
1 1 1 39 6  7  o 1  44.2493 5.34522 52.3891     11.1933  27.2429     11.0786  37.6354    186.053     11.7557     186.053     
1 1 1 39 6  8  o 1  37.2292 5.81162 21.2398     10.5976  36.1509     10.7175  27.8059    45.1095     3.19296     45.1095     
1 1 1 39 6  9  o 3  44.8352 5.1497  43.5179     11.2133  36.1974     11.0754  41.707     5.01123     19.6891     5.01123     
1 1 1 39 6  10 o 8  60.6606 4.10848 70.9795     12.5154  68.6456     12.1596  59.9527    341.719     30.6749     341.719     
1 1 1 39 6  11 f 0  78.9526 3.57091 113.087     13.7467  119.307     14.3649  52.4062    209.496     0           0           
1 1 1 39 6  12 o 5  21.3837 6.11469 8.68131     10.1719  2.8865      10.3886  9.98771    237.114     3.25933     57.1138     
1 1 1 39 6  13 o 6  37.0802 6.12324 23.3011     11.7126  34.4522     10.8686  29.1277    76.3339     6.60579     76.3339     
1 1 1 39 6  14 o 18 20.4386 5.99214 4.80728     10.0799  4.24519     10.0371  8.03622    158.124     7.07924     338.124     
1 1 1 39 6  15 f 0  60.0045 4.19584 60.89       12.2452  77.1699     12.5216  29.0546    318.213     0           0           
1 1 1 39 6  16 o 12 41.8022 5.84569 48.4755     11.271   24.9001     12.2026  33.6228    2.51922     7.85722     2.51922     
1 1 1 39 6  17 o 6  34.3777 6.25345 26.8346     10.7769  23.5437     10.9302  19.2219    229.334     9.97748     49.334      
1 1 1 39 6  18 o 8  47.4874 5.32674 55.1729     12.4965  36.5245     11.7525  45.317     62.9844     23.3273     62.9844     
1 1 1 39 6  19 o 16 25.3126 6.25904 1.75036     11.0702  20.7419     10.7366  8.21272    52.925      17.5218     232.925     
1 1 1 39 6  20 o 15 14.9967 5.04147 -14.1558    11.175   -6.96875    9.70605  4.83743    10.8945     27.3133     10.8945     
1 1 1 39 6  21 o 9  39.2054 6.5825  29.0428     13.0801  38.0497     12.5489  31.8345    310.76      9.56227     310.76      
1 1 1 39 6  22 o 8  28.2793 6.84387 25.2167     12.7978  8.47271     11.775   10.4451    140.705     17.5908     320.705     
1 1 1 39 6  23 o 12 48.5712 6.45178 54.6577     14.6024  46.5977     15.5529  37.889     57.4495     6.11449     57.4495     
1 1 1 39 6  24 o 9  25.8763 7.16909 13.3186     12.7253  12.223      14.4102  13.525     274.971     4.70011     94.9707     
1 1 1 39 6  25 o 8  29.854  7.40191 18.7876     12.9248  21.4337     14.4478  12.8905    332.524     14.4213     152.524     
1 1 1 39 6  26 o 6  21.4044 6.55002 5.84892     11.8747  0.594767    14.2806  3.429      316.569     19.6711     136.569     
1 1 1 39 6  27 o 8  31.008  7.62688 21.1358     13.386   23.6628     15.6663  19.2074    43.5668     1.32915     223.567     
1 1 1 39 6  28 o 16 19.2965 6.25733 -8.16852    13.3718  0.371137    14.1758  4.50219    86.4661     2.6369      266.466     
1 1 1 39 6  29 o 5  24.8689 7.1553  9.5112      12.3457  12.6232     15.6193  11.7548    72.4652     2.16419     72.4652     
1 1 1 39 6  30 o 11 21.2581 6.43978 -11.9329    11.3729  15.6236     14.6957  7.63138    79.5543     4.10935     259.554     
1 1 1 39 6  31 f 0  48.8121 7.21184 55.6552     14.081   52.3914     19.83    35.3657    161.271     0           0           
1 1 1 39 6  32 o 15 39.9299 7.20485 43.9564     14.8838  29.9309     14.3891  33.6363    143.591     14.249      143.591     
1 1 1 39 6  33 o 10 32.3267 8.02463 21.4846     15.6315  29.1541     16.6803  16.2978    215.344     10.8244     35.3436     
1 1 1 39 6  34 o 16 38.7973 8.1964  33.5864     18.143   40.8877     16.5786  27.3696    26.1598     1.91312     26.1597     
1 1 1 39 6  35 o 8  50.2753 7.49677 71.5933     18.7248  46.4513     18.0205  50.4884    194.182     32.6042     194.182     
1 1 1 39 6  36 o 9  24.0108 7.34257 8.10499     16.1905  6.53791     16.2355  11.252     125.969     6.60234     305.969     
1 1 1 39 6  37 o 8  34.0204 8.33596 35.5473     17.3302  23.7257     18.1004  15.405     89.1943     15.62       269.194     
1 1 1 39 6  38 o 6  26.2761 7.6936  15.3267     16.5678  12.4038     16.5701  14.7346    84.7654     2.36728     264.765     
1 1 1 39 6  39 o 15 28.181  8.10808 18.9812     17.3144  18.2974     18.6842  17.7175    240.785     1.5528      240.786     
1 1 1 39 6  40 o 2  24.2848 7.50994 12.3367     17.824   5.71074     16.9494  12.6969    207.129     3.28251     207.129     
1 1 1 39 6  41 o 12 21.0724 6.79275 -4.65813    16.3909  5.52095     15.6978  6.22758    174.173     0.532216    174.173     
1 1 1 39 6  42 o 5  41.411  8.33734 61.1851     19.0163  35.337      18.9028  27.6803    213.282     0.359862    33.2816     
1 1 1 39 6  43 f 0  23.9717 7.25112 -7.34708    17.4477  22.5331     16.4944  5.16608    282.492     0           0           
1 1 1 39 6  44 o 3  23.1137 7.30378 9.3028      17.6183  7.74382     16.9649  8.18853    253.127     0.864248    73.1272     
1 1 1 39 6  45 o 16 18.7342 6.34242 -8.01842    17.1451  -8.10077    16.7621  2.71803    321.879     9.1344      141.879     
1 1 1 39 6  46 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 6  47 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 7  0  o 14 39.5753 6.44464 33.552      11.1261  33.552      11.1261  16.3034    9.16569e-06 27.9692     180         
1 1 1 39 7  1  o 17 20.4995 5.9515  6.07975     9.79119  3.86986     9.83194  8.59446    71.5185     5.86122     251.518     
1 1 1 39 7  2  o 1  55.7734 4.47194 54.383      12.0206  66.1689     12.4634  41.3333    156.401     0.466037    336.401     
1 1 1 39 7  3  o 10 28.1677 6.50269 16.6291     10.854   16.7414     10.2607  20.6823    216.01      7.48382     216.01      
1 1 1 39 7  4  o 11 27.8985 6.33366 11.3357     10.2677  20.9235     10.3622  20.3687    234.716     9.71162     234.716     
1 1 1 39 7  5  o 7  42.602  5.6054  39.0503     11.8838  35.0984     11.1754  29.1293    144.406     3.83172     324.406     
1 1 1 39 7  6  o 6  29.3763 6.45296 20.7238     10.422   15.9329     10.7404  20.8886    31.2329     3.50962     31.2329     
1 1 1 39 7  7  o 5  63.8129 4.00863 81.7221     12.5708  73.2475     12.7499  63.7323    345.309     32.8884     345.309     
1 1 1 39 7  8  o 9  47.4114 4.95823 48.7676     11.3304  40.4772     11.4115  38.7267    196.338     8.20502     196.338     
1 1 1 39 7  9  o 16 26.9711 6.27957 13.643      9.07116  16.7833     10.5952  16.9925    82.207      9.39728     82.207      
1 1 1 39 7  10 o 8  35.0534 6.29637 21.4462     11.5135  31.294      10.9672  19.7683    359.395     10.3762     179.395     
1 1 1 39 7  11 o 13 33.1733 6.33512 20.6238     10.676   26.8602     10.9927  22.7396    114.269     0.319109    294.269     
1 1 1 39 7  12 o 1  68.7908 3.78099 79.2945     12.063   100.403     13.8125  53.1459    316.58      3.23708     316.58      
1 1 1 39 7  13 o 17 30.4865 6.38563 19.5494     10.0796  20.6638     10.8186  21.8951    312.231     3.68586     312.231     
1 1 1 39 7  14 o 4  64.8884 3.81583 77.2927     11.7043  82.5858     12.8858  71.297     187.136     47.75       187.136     
1 1 1 39 7  15 o 10 50.143  5.1336  62.4968     11.4793  39.3314     12.5594  37.5175    62.7682     1.53596     62.7681     
1 1 1 39 7  16 o 10 17.0516 5.34224 3.8013      8.89615  -9.85822    10.3738  3.43463    291.757     2.62273     111.757     
1 1 1 39 7  17 o 19 21.7072 6.35914 4.00162     10.0651  8.65964     12.5104  9.80451    33.5318     4.21558     213.532     
1 1 1 39 7  18 o 11 45.849  5.98992 46.074      12.9157  42.4053     13.5594  44.3237    300.802     24.6779     300.802     
1 1 1 39 7  19 o 11 25.9277 6.85197 15.2434     11.5323  11.7014     12.6024  13.6677    3.20007     5.28178     183.2       
1 1 1 39 7  20 o 1  37.5614 6.64607 40.5935     12.5009  22.2682     13.3595  16.124     56.1167     21.5313     236.117     
1 1 1 39 7  21 o 6  19.5122 6.10883 -2.34203    11.1746  3.42219     12.4806  6.23092    258.458     3.20328     78.4581     
1 1 1 39 7  22 o 3  39.9119 6.73805 44.1622     13.4749  27.3387     13.5535  22.8302    253.96      11.0588     73.9598     
1 1 1 39 7  23 o 11 39.4266 7.40797 44.6568     15.2622  28.289      15.1433  29.0878    219.921     3.87539     219.921     
1 1 1 39 7  24 o 18 46.8932 6.65937 38.2055     15.6128  59.3389     14.484   38.4323    211.26      10.6999     211.26      
1 1 1 39 7  25 o 12 24.194  6.92817 13.8429     13.661   6.31232     12.6148  11.8128    274.858     1.37711     94.8583     
1 1 1 39 7  26 o 16 29.1976 7.00142 5.61854     14.0898  29.6751     13.3191  15.6764    55.4511     6.27932     235.451     
1 1 1 39 7  27 o 1  23.8223 6.86776 1.21077     14.2444  14.9259     12.8599  10.0341    297.89      2.43504     297.89      
1 1 1 39 7  28 o 9  21.6372 6.74938 -1.31003    16.0838  5.49162     12.9817  4.94789    155.623     16.4825     335.623     
1 1 1 39 7  29 o 3  26.0022 6.96132 20.5858     12.8904  4.9379      13.4929  11.4368    194.292     10.4773     14.2921     
1 1 1 39 7  30 o 4  49.8754 7.33279 58.3296     17.9438  55.4944     17.5176  36.957     188.964     2.6908      188.964     
1 1 1 39 7  31 o 11 58.6824 7.55096 72.4741     20.9673  86.319      21.7791  51.5282    1.14491     18.8783     1.14491     
1 1 1 39 7  32 o 2  21.7932 7.03812 4.37498     15.4675  -11.2506    20.0769  9.19998    26.1032     7.08936     206.103     
1 1 1 39 7  33 o 6  22.9336 7.29118 2.01312     15.5097  3.76175     19.4412  12.0904    306.272     0.921193    306.272     
1 1 1 39 7  34 o 9  24.4545 7.73356 0.714207    16.3739  12.8336     22.0436  13.016     67.6812     2.55082     247.681     
1 1 1 39 7  35 o 14 34.8291 8.57346 43.7702     17.8575  16.8244     24.7152  18.9717    3.2892      9.53581     183.289     
1 1 1 39 7  36 o 18 24.5941 7.81389 8.91261     16.4443  3.47041     24.6763  13.7228    266.813     3.5628      266.813     
1 1 1 39 7  37 o 5  21.8588 7.0978  8.27225     16.6774  -16.1675    21.1003  6.96405    293.315     2.08515     293.315     
1 1 1 39 7  38 o 8  21.1866 6.92451 2.77197     17.5049  -4.5139     17.1117  8.6009     278.216     4.06228     98.2155     
1 1 1 39 7  39 o 7  30.2918 8.42602 25.0055     18.4797  27.6028     19.027   20.2939    292.851     6.06326     292.851     
1 1 1 39 7  40 o 1  30.2132 8.78898 30.196      24.2526  26.7939     18.9594  19.2713    304.957     6.57327     304.957     
1 1 1 39 7  41 o 13 19.5507 6.54494 -8.93648    17.1362  -1.54166    17.0606  4.68955    226.007     4.2351      46.0066     
1 1 1 39 7  42 o 4  25.1658 7.76392 4.36091     18.3806  23.8854     19.3342  10.5682    11.3918     1.1248      11.3917     
1 1 1 39 7  43 o 7  18.6806 6.33131 -13.8007    17.0804  -3.3182     17.0502  2.70491    88.6913     5.88839     268.691     
1 1 1 39 7  44 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 7  45 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 8  0  o 7  19.4143 7.61522 11.0407     10.8981  11.0407     10.8981  9.28142    180         3.99701     360         
1 1 1 39 8  1  o 3  22.5739 6.28208 4.69073     10.6142  11.7226     10.5893  6.24166    307.922     17.1636     127.922     
1 1 1 39 8  2  o 10 29.0953 6.50078 17.4656     10.4801  19.3545     10.7455  21.8243    21.7494     7.90285     21.7494     
1 1 1 39 8  3  o 6  48.2201 4.93033 46.7895     10.7776  46.02       12.2612  41.0654    89.5447     11.5766     89.5447     
1 1 1 39 8  4  o 9  45.8853 5.04531 40.9695     10.8911  43.6825     11.5611  49.5088    283.359     37.4847     283.359     
1 1 1 39 8  5  o 2  27.7357 6.37927 13.8219     9.51598  19.3178     10.8644  18.0129    74.0843     0.172249    74.0843     
1 1 1 39 8  6  o 5  15.1443 4.93611 -0.0706388  8.39461  -14.2353    10.0093  1.90488    271.385     7.45842     91.3847     
1 1 1 39 8  7  o 7  17.189  5.35661 4.28294     8.84552  -9.37598    10.3251  3.2931     257.665     11.598      77.6652     
1 1 1 39 8  8  f 0  31.4731 6.51956 21.4559     10.0389  22.1236     11.9016  13.3514    181.113     0           0           
1 1 1 39 8  9  o 17 20.6706 6.11848 4.67501     9.11203  5.2582      12.1486  8.90309    260.592     1.53498     80.5925     
1 1 1 39 8  10 o 8  20.2694 5.99266 -1.0562     9.47776  9.51265     11.2448  8.38945    168.773     2.64385     348.773     
1 1 1 39 8  11 o 18 32.2184 6.61247 23.0058     10.6032  23.0483     12.0468  20.3686    189.378     3.6294      9.37749     
1 1 1 39 8  12 o 3  35.9352 6.73383 23.8444     12.2346  34.0395     12.6576  27.7647    134.206     6.15402     134.206     
1 1 1 39 8  13 o 5  47.9786 5.75058 50.8686     11.9085  44.9743     14.3969  44.8889    116.481     21.1794     116.481     
1 1 1 39 8  14 o 13 31.5239 7.04235 11.95       12.5238  33.1291     13.9197  23.8836    65.9226     14.0733     65.9226     
1 1 1 39 8  15 o 12 46.3149 6.7644  36.3435     13.6625  59.8524     16.8688  31.6312    205.639     3.98734     25.6394     
1 1 1 39 8  16 o 14 21.9528 6.6844  5.0124      13.8006  4.50688     12.8332  8.85051    117.455     6.93083     297.455     
1 1 1 39 8  17 o 7  20.2908 6.33044 0.809156    11.9298  2.44118     13.2085  6.71883    181.585     1.71886     1.58521     
1 1 1 39 8  18 o 8  64.9132 5.31138 69.9759     15.3489  103.353     18.5265  62.4684    173.996     29.6867     173.996     
1 1 1 39 8  19 o 1  22.504  6.71855 0.620003    11.9308  12.2667     14.284   8.34229    173.096     9.55636     353.096     
1 1 1 39 8  20 o 19 24.2141 6.93077 7.99589     12.5407  12.6655     13.6049  9.50015    304.631     2.87512     304.631     
1 1 1 39 8  21 o 3  39.2553 6.79012 13.943      13.7534  59.1982     15.9754  28.8493    222.724     3.37551     222.724     
1 1 1 39 8  22 o 12 23.6047 6.62566 -5.33824    12.4153  19.8946     13.4359  11.4873    350.783     1.88528     170.783     
1 1 1 39 8  23 o 2  27.0033 7.24618 3.03293     12.8143  26.8923     15.7627  15.6226    91.0539     1.36697     271.054     
1 1 1 39 8  24 o 12 54.2395 5.9184  60.9047     15.0257  63.4606     16.107   50.6513    59.0107     23.4962     59.0107     
1 1 1 39 8  25 o 17 24.8843 7.09462 9.99683     12.8349  12.9734     14.3886  8.7477     244.32      4.2345      244.32      
1 1 1 39 8  26 o 17 28.4851 7.70585 18.0808     16.6638  18.1426     14.1556  15.9055    301.809     5.24759     121.809     
1 1 1 39 8  27 o 1  39.3498 8.25204 59.3        20.2082  20.2357     17.6246  30.0438    100.83      5.856       100.83      
1 1 1 39 8  28 o 5  24.4578 7.48394 -2.26155    18.3536  14.3944     16.6461  14.0981    329.423     0.132368    149.423     
1 1 1 39 8  29 o 6  26.9112 7.86578 9.49815     18.376   18.1871     16.7078  9.88125    36.9776     16.29       216.978     
1 1 1 39 8  30 o 8  50.6378 9.1005  73.7112     26.7474  62.7023     19.7355  44.494     8.83817     17.7418     8.83817     
1 1 1 39 8  31 o 17 41.2359 9.28025 44.8997     23.3009  51.3498     20.5114  27.0475    197.717     3.46251     17.7173     
1 1 1 39 8  32 o 6  38.1204 8.94703 55.3017     22.2338  27.7589     18.6715  27.4246    329.886     2.95968     329.886     
1 1 1 39 8  33 o 5  21.4035 6.8914  -10.3644    16.6158  8.42163     16.7274  8.35106    151.979     2.01031     151.979     
1 1 1 39 8  34 o 19 37.5127 8.60642 29.7054     19.2757  49.5142     19.1231  29.3152    221.688     8.78596     221.688     
1 1 1 39 8  35 f 0  20.1076 6.65772 -0.0673857  16.766   -8.74237    17.0025  6.72605    65.0154     0           0           
1 1 1 39 8  36 o 16 23.3314 7.59583 0.560497    17.5734  10.6104     22.9578  10.4585    14.5146     4.55605     194.515     
1 1 1 39 8  37 o 19 29.5169 8.77232 24.0671     18.8484  30.2819     25.5168  5.55193    309.213     3.42219     309.213     
1 1 1 39 8  38 o 14 24.235  7.81308 9.45796     18.1966  10.7056     23.9744  6.89       91.7241     1.90524     91.7241     
1 1 1 39 8  39 o 2  27.6557 8.50639 29.7674     20.4813  11.3712     26.7333  14.287     78.1322     2.34365     258.132     
1 1 1 39 8  40 o 18 25.5262 8.24272 -0.686519   20.0708  33.1254     26.3886  6.67711    95.6859     1.80678     95.6859     
1 1 1 39 8  41 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 8  42 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 9  0  o 16 48.2792 5.15369 46.3957     11.6298  46.3957     11.6298  44.2992    2.15275e-05 14.4212     2.15275e-05 
1 1 1 39 9  1  o 7  42.536  5.49299 33.4604     11.2059  41.7697     11.2981  32.6022    197.009     3.67418     197.009     
1 1 1 39 9  2  o 17 51.6779 4.97489 49.9576     12.8421  57.5199     12.0797  34.3052    104.332     8.29943     284.332     
1 1 1 39 9  3  o 8  28.5208 6.50049 22.8752     11.3079  12.9806     10.1837  20.3965    194.214     6.96072     194.214     
1 1 1 39 9  4  o 16 44.1952 5.50372 45.3207     12.2768  35.9354     11.2111  36.1802    5.4696      8.51054     5.4696      
1 1 1 39 9  5  o 14 16.1304 5.30184 -3.24949    9.70726  -9.12916    11.1887  1.544      14.0505     12.2584     194.051     
1 1 1 39 9  6  o 15 48.1704 5.58432 51.5679     12.3958  44.845      13.4569  33.1455    53.6188     4.70173     233.619     
1 1 1 39 9  7  f 0  17.6812 5.66337 -3.0854     10.51    -1.29095    11.0898  18.3509    88.8738     0           0           
1 1 1 39 9  8  o 8  32.6848 6.86505 13.4863     11.9652  35.7444     13.6298  26.3396    18.4801     14.7988     18.4801     
1 1 1 39 9  9  o 6  18.9132 5.75164 7.99835     9.58679  -12.1775    12.5733  5.64393    107.93      6.38023     287.93      
1 1 1 39 9  10 o 10 29.604  7.1293  25.9653     12.8031  13.1031     13.6322  15.3463    8.2273      9.2769      188.227     
1 1 1 39 9  11 f 0  28.2228 7.14392 9.15051     13.5409  25.0516     13.4352  22.4724    358.451     0           0           
1 1 1 39 9  12 o 10 16.089  5.41459 -10.671     11.6323  -10.001     12.2979  0.0719915  168.703     15.9064     348.703     
1 1 1 39 9  13 o 2  58.1658 5.91519 69.6096     14.9614  73.2286     18.3199  48.0754    343.534     10.3532     343.534     
1 1 1 39 9  14 o 12 40.7058 7.02879 23.1341     14.3462  55.0473     15.5772  28.6732    236.104     0.319846    56.1037     
1 1 1 39 9  15 o 19 29.802  7.79022 26.4864     14.8746  13.3411     17.4706  18.7377    26.6558     9.53329     26.6558     
1 1 1 39 9  16 o 6  19.2082 6.11938 -8.8009     12.1297  4.9963      13.1605  2.84637    278.167     16.4684     98.1669     
1 1 1 39 9  17 o 7  37.8446 7.25071 34.2692     13.7825  32.8463     14.4243  32.3696    318.534     14.5348     318.534     
1 1 1 39 9  18 o 9  25.4696 7.09107 12.0385     12.8468  13.7976     13.7312  11.703     4.02174     8.96        184.022     
1 1 1 39 9  19 o 18 29.3616 7.20854 26.7443     13.2524  11.4815     14.1621  14.3831    336.813     10.9945     156.813     
1 1 1 39 9  20 o 10 31.7332 7.4471  19.9731     13.4008  27.9436     14.4044  11.587     49.4552     21.4036     229.455     
1 1 1 39 9  21 o 17 43.059  7.10098 32.6135     14.3579  53.5516     16.0734  36.9176    17.0415     13.2756     17.0415     
1 1 1 39 9  22 o 6  23.6725 7.16763 12.8853     15.8453  1.1357      14.84    13.0824    260.733     0.294099    80.7331     
1 1 1 39 9  23 o 2  40.3083 9.51268 9.49477     18.2111  92.5377     31.6463  34.3426    282.088     14.2769     282.088     
1 1 1 39 9  24 o 10 42.4912 8.38521 43.8477     18.3168  47.7464     18.7638  28.4098    184.771     3.92448     4.77058     
1 1 1 39 9  25 o 4  28.0839 7.95736 10.9036     17.0444  23.4324     17.5445  19.9419    109.647     7.97754     109.647     
1 1 1 39 9  26 o 7  35.2438 8.10086 13.7696     18.7127  48.1587     18.1997  29.7931    143.373     13.7775     143.373     
1 1 1 39 9  27 o 10 47.1596 8.24734 50.0266     19.6836  62.719      19.3252  38.8055    298.016     10.5721     298.016     
1 1 1 39 9  28 o 14 36.2041 8.63993 34.4635     18.7876  37.5811     18.457   20.7754    125.116     8.93714     305.116     
1 1 1 39 9  29 o 6  23.5951 7.41345 14.8197     18.8559  -2.95572    16.6136  13.0268    196.739     0.393935    16.7386     
1 1 1 39 9  30 o 18 27.7442 8.08053 9.66995     17.3793  26.8789     19.411   14.9047    216.942     6.25095     36.942      
1 1 1 39 9  31 o 10 19.782  6.58443 -22.7951    19.2051  2.95173     16.2114  7.54706    104.473     4.63942     284.473     
1 1 1 39 9  32 o 4  40.292  9.2516  58.0727     23.2861  42.4764     19.5001  33.8631    175.305     14.6483     175.305     
1 1 1 39 9  33 o 11 21.0233 7.00237 5.87449     20.8261  -9.93047    16.7252  7.82669    234.798     1.49303     54.7983     
1 1 1 39 9  34 o 18 24.8184 7.79393 17.9358     20.8854  7.91754     17.7502  12.5592    62.7595     0.237943    242.76      
1 1 1 39 9  35 o 4  24.7762 7.84185 22.1544     21.7494  4.02404     18.246   11.7073    215.646     2.87192     35.6462     
1 1 1 39 9  36 o 4  22.2905 7.24515 21.0579     20.4291  -16.0678    17.7314  6.11868    79.4193     0.0866692   259.419     
1 1 1 39 9  37 o 5  29.8181 8.4246  38.1199     19.3236  17.5424     20.8589  17.1606    25.1562     0.349869    205.156     
1 1 1 39 9  38 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 9  39 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 9  40 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 10 0  o 10 62.7326 4.80626 76.1982     14.661   76.1982     14.661   40.8434    180         14.8919     360         
1 1 1 39 10 1  o 3  39.9134 6.13144 31.661      11.9754  37.7845     11.8719  35.2076    8.00888     15.3463     8.00888     
1 1 1 39 10 2  o 7  46.1494 5.72184 41.026      12.7662  49.037      12.6648  30.2449    237.21      7.39759     57.2097     
1 1 1 39 10 3  o 1  35.1422 7.05559 32.677      13.1581  24.9948     13.0492  18.4872    217.22      12.9409     37.2203     
1 1 1 39 10 4  o 5  21.1919 6.03143 -5.60321    10.3198  15.0034     11.261   8.29139    97.2198     0.819501    277.22      
1 1 1 39 10 5  o 12 30.0796 7.22101 17.711      13.7669  24.155      12.6317  19.6899    281.314     0.281128    281.314     
1 1 1 39 10 6  o 2  20.4153 6.22739 -4.68354    13.3136  8.1348      11.0819  7.37328    185.234     6.13346     5.23381     
1 1 1 39 10 7  o 9  24.777  6.79023 19.6929     13.1227  2.70075     12.2195  12.4085    53.4697     4.30808     53.4697     
1 1 1 39 10 8  o 12 47.8276 6.76773 45.5555     15.9228  57.0837     15.3383  31.8514    225.399     6.64762     45.3985     
1 1 1 39 10 9  o 10 33.9118 7.56191 25.4869     14.096   30.1849     14.672   11.1962    234.26      26.2704     54.2598     
1 1 1 39 10 10 o 4  27.0704 7.52537 21.3298     14.6078  7.4289      16.7487  6.53956    137.706     3.87292     137.706     
1 1 1 39 10 11 o 18 25.4428 7.10576 17.1607     13.3334  7.49764     14.0803  14.263     268.829     2.48907     88.8286     
1 1 1 39 10 12 o 16 26.3268 7.19051 18.3465     13.2584  9.95602     14.2221  16.1801    119.572     6.49426     119.572     
1 1 1 39 10 13 o 1  45.0211 7.0475  42.4627     15.2674  50.3753     15.7257  39.5727    136.082     14.8679     136.082     
1 1 1 39 10 14 o 16 33.2674 8.06011 36.1677     16.4064  17.8631     17.8599  18.9924    28.1594     8.38554     208.159     
1 1 1 39 10 15 o 9  21.021  6.58102 3.2657      13.5161  1.04541     13.9442  8.53638    99.6579     1.18068     99.6579     
1 1 1 39 10 16 o 14 18.3691 6.00526 0.661117    12.8928  -13.1925    13.7818  6.05684    306.296     1.98928     126.296     
1 1 1 39 10 17 o 12 29.8816 7.89028 13.705      17.2832  27.2672     15.728   22.8301    97.828      9.49744     97.828      
1 1 1 39 10 18 o 15 19.7928 6.51245 -1.78981    17.314   -7.33061    13.6455  8.64956    65.7631     2.98325     245.763     
1 1 1 39 10 19 o 17 35.9721 7.84347 9.26481     19.723   51.6364     17.6671  20.5631    172.41      10.1318     352.41      
1 1 1 39 10 20 o 12 25.3025 7.50037 -4.41585    18.1789  20.6975     16.4799  16.2445    230.408     5.40634     230.408     
1 1 1 39 10 21 o 13 32.8553 8.4983  40.4441     19.5191  15.3236     19.0888  25.2255    135.282     7.30384     135.282     
1 1 1 39 10 22 o 2  32.9747 8.36025 17.1476     20.2147  38.1141     17.6172  23.4286    276.361     2.39923     276.361     
1 1 1 39 10 23 o 10 23.9051 7.37912 18.4169     17.9464  -7.19193    16.9864  13.7101    220.954     4.26594     220.954     
1 1 1 39 10 24 o 16 23.9228 7.48154 -0.288569   17.919   13.5803     17.9871  6.79886    190.764     3.52229     190.764     
1 1 1 39 10 25 o 2  21.1685 6.93319 -2.18407    17.9537  -1.10823    16.9563  10.144     108.856     0.212729    288.856     
1 1 1 39 10 26 o 8  37.5918 9.24129 51.3587     23.1152  35.5026     19.5858  33.3661    67.7229     20.5736     67.7229     
1 1 1 39 10 27 o 4  28.4529 8.11842 44.2521     22.062   -9.6831     18.3232  18.7549    80.2145     2.29295     80.2145     
1 1 1 39 10 28 o 11 27.139  8.06828 2.73569     21.6473  28.0719     18.649   15.4125    285.795     2.99001     105.795     
1 1 1 39 10 29 o 11 25.4081 7.96388 11.7076     21.0929  15.1277     19.353   8.58673    14.0624     4.03614     14.0624     
1 1 1 39 10 30 o 19 23.1349 7.45677 11.3032     20.1626  2.83487     17.94    1.01223    207.78      0.357385    207.78      
1 1 1 39 10 31 o 12 27.3919 8.22661 13.3269     21.6123  27.4854     19.1175  9.75197    212.565     4.98198     212.565     
1 1 1 39 10 32 f 0  26.1635 7.78241 -12.8205    21.5684  34.8484     19.2135  3.79554    358.291     0           0           
1 1 1 39 10 33 o 14 22.7708 7.43401 6.68712     20.6165  6.87201     19.0548  8.18315    136.818     1.09742     316.818     
1 1 1 39 10 34 o 17 18.8957 6.48864 -5.23082    20.1747  -16.8972    18.1612  1.61764    305.045     1.48702     125.045     
1 1 1 39 10 35 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 10 36 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 10 37 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 11 0  o 3  14.8495 6.84238 1.59492     12.3598  1.59492     12.3598  0.957252   180.001     1.24187     0.000492678 
1 1 1 39 11 1  o 5  36.5812 7.87317 43.4208     17.8977  24.137      13.8763  27.664     0.747869    3.94241     0.747869    
1 1 1 39 11 2  o 19 29.5487 7.59964 18.2267     16.8953  22.1787     12.9686  20.095     9.1793      0.949716    9.17934     
1 1 1 39 11 3  o 12 27.4051 7.30926 20.0114     14.4177  13.4113     13.0498  18.3498    321.054     1.74628     321.054     
1 1 1 39 11 4  o 2  36.8767 7.57623 33.7177     15.6258  32.1743     14.0573  34.4972    192.222     22.2032     192.222     
1 1 1 39 11 5  o 10 43.588  7.30038 55.7356     17.2517  34.4077     14.432   35.7373    183.087     8.28592     183.087     
1 1 1 39 11 6  o 4  22.1316 6.71017 5.19059     14.7012  6.29245     12.0133  8.02904    11.2125     12.6283     191.212     
1 1 1 39 11 7  o 7  51.3337 6.83587 60.6094     17.423   57.8574     16.4575  45.4449    92.6208     15.2088     92.6208     
1 1 1 39 11 8  o 15 22.661  6.76515 16.0094     14.4574  -6.16866    13.5363  6.43897    46.8078     17.5545     226.808     
1 1 1 39 11 9  o 12 35.5904 8.67877 33.8179     19.4104  33.8702     18.183   25.937     22.5686     2.20326     22.5686     
1 1 1 39 11 10 o 13 24.824  7.06977 4.93261     14.9158  16.4892     13.1665  13.4627    199.83      5.43141     19.83       
1 1 1 39 11 11 o 3  24.9412 6.93649 0.654099    14.7877  19.538      12.9211  10.4685    147.108     6.17998     147.108     
1 1 1 39 11 12 o 15 22.3458 6.9428  4.51768     17.5238  5.06687     12.5516  9.86971    2.36109     3.86866     2.36109     
1 1 1 39 11 13 o 1  24.3607 8.02345 22.3203     28.3102  -12.8979    16.6139  3.69229    258.742     2.01581     258.742     
1 1 1 39 11 14 o 16 29.2751 8.63218 31.5005     20.7784  1.39463     25.5451  19.8263    204.102     1.72206     204.102     
1 1 1 39 11 15 f 0  28.6393 8.59161 17.4918     20.7916  20.7479     22.0411  16.0228    16.3449     0           0           
1 1 1 39 11 16 o 8  23.6632 7.59753 -6.29839    18.6379  13.0528     20.8279  13.2463    214.626     4.11016     214.626     
1 1 1 39 11 17 o 8  29.9673 8.76904 14.2986     21.1463  32.3192     22.4679  20.8931    247.747     3.14912     247.747     
1 1 1 39 11 18 o 13 25.2755 7.88132 -5.08109    20.0394  21.476      20.4707  12.5842    245.664     6.44354     245.664     
1 1 1 39 11 19 o 19 32.5798 8.68476 21.8707     22.1437  36.7168     18.5919  24.2127    24.3675     5.21986     24.3675     
1 1 1 39 11 20 o 2  23.5374 7.49809 -8.19193    20.1482  14.7518     18.7147  13.3779    71.0611     0.0740425   71.0607     
1 1 1 39 11 21 o 16 19.9585 6.68014 -3.86311    18.5582  -8.96646    16.8162  5.13625    107.717     1.07053     107.717     
1 1 1 39 11 22 o 11 29.7094 8.87751 19.0897     22.2755  32.0997     23.4241  20.5396    5.72054     4.22422     5.72053     
1 1 1 39 11 23 o 12 25.0903 7.67707 -4.23686    20.7831  22.5065     17.7436  10.1335    329.882     12.4404     149.882     
1 1 1 39 11 24 o 3  22.3302 7.28775 7.02101     19.9766  -0.661777   17.9897  5.83669    351.949     1.83631     351.949     
1 1 1 39 11 25 o 19 26.8107 8.19142 29.1608     21.7317  8.35861     18.9168  15.3622    184.414     5.90073     184.414     
1 1 1 39 11 26 o 6  25.2473 7.85318 5.43963     21.1951  21.152      18.649   12.7642    83.8714     3.67056     83.8714     
1 1 1 39 11 27 o 9  20.2726 6.76702 -8.16594    19.1279  1.65089     17.2451  6.48491    320.716     2.9215      140.716     
1 1 1 39 11 28 o 4  21.7305 7.20783 1.78242     20.6977  2.22865     18.9948  7.65204    338.59      1.61191     158.59      
1 1 1 39 11 29 o 9  29.5067 8.55321 17.2694     23.0529  38.5642     20.086   12.5173    281.917     6.77037     281.917     
1 1 1 39 11 30 o 19 24.2612 7.63651 -2.4566     20.8245  23.7825     18.9282  9.63086    266.169     0.73347     266.169     
1 1 1 39 11 31 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 11 32 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 11 33 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 12 0  x 6  ?       ?       ?           ?        ?           ?        7.41091    180         0           0           
1 1 1 39 12 1  o 17 33.5235 8.51534 12.2838     19.8721  47.1974     20.2752  18.5735    121.065     10.6088     301.065     
1 1 1 39 12 2  o 3  21.0262 6.85698 -5.63631    16.6222  2.12969     17.07    4.96401    314.472     17.8216     134.472     
1 1 1 39 12 3  o 15 31.6443 8.47679 13.852      18.4841  39.4036     20.1249  25.1499    107.442     9.4527      107.442     
1 1 1 39 12 4  o 8  23.0082 7.34085 11.1027     18.0632  -5.96629    18.6773  12.991     48.5587     0.724045    228.559     
1 1 1 39 12 5  o 9  29.2239 8.0006  28.4678     18.5249  15.2209     14.9177  22.0348    159.071     12.1249     159.071     
1 1 1 39 12 6  o 18 25.6834 7.51197 17.9556     17.883   10.3245     13.5073  16.9539    220.209     2.6999      220.209     
1 1 1 39 12 7  o 7  25.207  7.97178 27.258      25.7771  -0.610462   13.6848  14.7582    301.355     6.54119     301.355     
1 1 1 39 12 8  o 4  28.2606 8.9879  -36.3903    57.9241  24.137      19.4422  16.4361    349.684     9.49516     349.684     
1 1 1 39 12 9  o 16 32.3965 8.62228 34.0351     21.184   25.8106     16.8862  25.6119    144.41      8.77385     144.41      
1 1 1 39 12 10 o 17 37.2777 8.72778 54.5892     21.7974  26.5521     16.8279  31.4965    320.819     11.7983     320.819     
1 1 1 39 12 11 o 16 28.0235 7.92594 35.3178     20.1446  4.06029     14.7066  20.4019    220.834     9.62988     220.834     
1 1 1 39 12 12 o 5  25.4339 8.16576 25.0849     28.6751  2.94808     14.8037  14.3232    74.4933     6.61749     74.4933     
1 1 1 39 12 13 o 8  21.4175 7.04285 1.11027     19.7393  -2.68627    16.6565  7.57045    194.287     2.54716     194.287     
1 1 1 39 12 14 o 3  24.7004 7.36774 -5.05583    20.1901  20.2289     14.9871  15.5756    45.4072     4.46747     45.4072     
1 1 1 39 12 15 o 8  26.9911 7.95269 16.1194     21.2178  18.8842     15.3999  14.1699    215.966     7.54228     35.9664     
1 1 1 39 12 16 o 6  21.5826 7.0002  15.7491     20.1966  -7.92905    13.0007  4.50897    317.209     1.59123     317.209     
1 1 1 39 12 17 o 2  27.5628 8.47564 16.0292     21.1763  24.3628     22.5382  15.6696    39.8285     4.14102     219.829     
1 1 1 39 12 18 o 6  26.1787 8.20078 15.6048     21.1568  16.8035     21.4937  10.4429    17.8854     5.40896     17.8854     
1 1 1 39 12 19 o 12 21.3124 7.12441 -16.144     20.1421  8.32793     20.5896  8.9292     216.626     1.06622     36.6259     
1 1 1 39 12 20 o 15 32.9558 10.1792 15.9566     21.9558  92.1271     39.6777  13.6164    311.988     9.11263     311.988     
1 1 1 39 12 21 o 15 30.1522 8.85734 16.6027     21.6272  44.5825     23.6892  20.0377    291.242     3.34084     291.242     
1 1 1 39 12 22 f 0  44.6409 10.3724 80.1692     26.7336  71.1958     27.2447  33.6544    166.219     0           0           
1 1 1 39 12 23 o 15 21.7075 7.22427 12.4427     20.2818  -15.3288    21.5638  3.64663    71.132      0.396617    71.132      
1 1 1 39 12 24 o 17 24.0973 7.82232 15.7016     20.9661  7.14593     22.4151  8.8196     334.085     1.752       334.085     
1 1 1 39 12 25 o 4  23.0393 7.56135 24.3946     22.1834  -17.1233    21.5786  8.73315    94.5943     0.746681    274.594     
1 1 1 39 12 26 f 0  29.8644 9.1501  28.7427     23.6854  42.9205     26.7853  3.97454    163.112     0           0           
1 1 1 39 12 27 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 12 28 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 12 29 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 13 0  o 6  13.32   6.63955 -12.9617    17.5838  -12.9617    17.5838  0.436253   180         11.2051     5.03601e-05 
1 1 1 39 13 1  o 16 31.0657 9.25998 36.6951     30.988   28.9735     19.8725  15.0405    255.42      10.2168     255.42      
1 1 1 39 13 2  o 14 30.9224 9.29512 35.9647     29.9524  29.1763     21.2497  22.9093    198.457     11.6637     198.457     
1 1 1 39 13 3  o 1  30.2824 8.98588 12.8071     34.9155  35.7561     20.0426  21.4839    299.01      4.27719     299.01      
1 1 1 39 13 4  o 5  31.8015 9.53867 31.915      38.6334  37.9283     21.6162  23.2135    328.661     5.59757     328.661     
1 1 1 39 13 5  o 8  27.3178 8.72034 11.9702     37.3018  21.106      19.3778  17.6914    317.105     2.89564     317.105     
1 1 1 39 13 6  o 8  27.4944 9.57721 -4.60295    36.0393  44.1985     53.87    2.21891    212.282     1.28348     212.282     
1 1 1 39 13 7  o 13 34.2749 10.5146 74.2848     38.6677  35.9709     27.713   21.4086    321.673     4.0556      141.673     
1 1 1 39 13 8  o 4  40.0905 10.9673 102.321     128.628  93.9123     30.4916  23.2773    178.607     10.7662     358.607     
1 1 1 39 13 9  o 7  23.4417 7.99911 8.1893      33.9936  -4.30031    21.0467  8.10573    8.0437      13.883      188.044     
1 1 1 39 13 10 o 7  48.6617 10.6334 115.407     38.8541  68.7211     20.8398  48.512     64.4445     31.3997     64.4445     
1 1 1 39 13 11 o 1  22.0041 7.51022 10.1098     31.6842  -4.6721     14.9261  9.65581    312.946     0.313804    132.946     
1 1 1 39 13 12 o 15 30.6761 9.48174 71.2659     36.5198  15.2218     16.932   18.8       292.523     2.41191     112.523     
1 1 1 39 13 13 o 6  22.4903 7.58721 -5.70259    31.1151  3.97953     18.4432  6.95985    249.895     1.55434     249.895     
1 1 1 39 13 14 o 7  28.7563 8.4067  29.8967     22.2917  23.3444     17.2941  17.7523    134.243     0.637069    314.243     
1 1 1 39 13 15 o 18 19.9436 6.67786 5.24713     20.2461  -7.08796    14.2071  1.14952    240.639     0.027502    60.6385     
1 1 1 39 13 16 o 2  21.0717 6.91647 4.19302     20.6368  2.30625     14.3208  7.94562    190.97      4.41872     10.9702     
1 1 1 39 13 17 o 8  21.3509 6.99877 10.6992     20.822   -0.1835     14.1003  3.52226    186.553     0.294981    186.553     
1 1 1 39 13 18 o 10 23.8659 7.54934 25.9118     21.1865  1.23069     15.494   11.1528    313.264     0.959402    133.264     
1 1 1 39 13 19 o 16 26.7974 8.03659 29.5086     21.829   16.3309     15.4879  15.0306    100.936     0.943927    100.936     
1 1 1 39 13 20 o 17 23.5283 7.74272 11.2376     21.4522  9.20331     22.9464  9.05783    77.6236     0.03759     257.624     
1 1 1 39 13 21 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 13 22 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 13 23 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 13 24 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 13 25 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 14 0  f 0  22.8462 10.8663 23.2921     35.4639  23.2921     35.4639  8.5203     180         0           0           
1 1 1 39 14 1  o 1  24.2697 11.865  5.22694     33.86    0           0        7.42731    100.954     2.62109     280.954     
1 1 1 39 14 2  o 16 28.091  13.5658 36.6692     40.7651  0           0        10.68      49.5409     0.00982915  229.541     
1 1 1 39 14 3  o 7  25.3409 12.7838 0           0        2.55143     53.9536  3.87883    257.726     0.215792    77.7263     
1 1 1 39 14 4  f 0  25.2777 9.21206 -65.0715    243.815  -18.2173    52.8411  5.23867    256.543     0           0           
1 1 1 39 14 5  o 5  26.09   9.14444 17.715      37.8197  20.4874     55.3598  13.6795    162.656     0.799025    342.657     
1 1 1 39 14 6  o 14 26.9432 9.34772 46.0926     39.1632  -11.9194    56.819   14.6328    165.517     0.919584    345.517     
1 1 1 39 14 7  o 11 28.82   9.66476 35.2805     243.843  42.6623     27.4285  16.7969    139.696     0.69638     319.696     
1 1 1 39 14 8  o 4  34.0601 10.6171 94.6761     43.1753  48.4796     28.0273  22.3054    30.3611     0.303922    30.3609     
1 1 1 39 14 9  o 15 24.1591 8.17965 0.000878903 38.2184  14.3969     22.8183  9.89387    175.685     8.68017     355.685     
1 1 1 39 14 10 o 16 24.5142 8.28672 -6.58993    37.5872  20.6394     25.0659  9.09387    86.6737     1.87272     86.6737     
1 1 1 39 14 11 o 8  24.6916 8.29865 1.42422     34.0957  20.9082     24.9754  11.5429    72.5281     0.743588    252.528     
1 1 1 39 14 12 o 18 24.4353 8.69651 -8.95114    35.6377  25.6832     59.1597  8.98537    151.736     0.853464    151.736     
1 1 1 39 14 13 o 8  22.4792 7.87175 31.9957     35.5009  -27.5557    22.6939  7.41384    181.547     1.37729     1.54716     
1 1 1 39 14 14 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 14 15 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 14 16 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 14 17 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 14 18 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 0  x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 1  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 2  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 3  x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 4  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 5  x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 6  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 7  x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 8  x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 39 15 9  x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 0  0  o 11 53.6632 6.14644 55.7546     15.2291  55.7546     15.2291  50.5128    180         34.3526     180         
1 1 1 40 0  1  o 1  69.336  3.41115 87.4552     11.7187  87.4552     11.7187  65.8299    240         26.4175     240         
1 1 1 40 0  2  o 19 12.5079 5.72649 0.122495    8.46634  0.122495    8.46634  2.07748    120         7.38556     120         
1 1 1 40 0  3  o 11 37.874  5.71782 29.3191     9.53457  29.3191     9.53457  1.91129    180         53.6501     360         
1 1 1 40 0  4  f 0  36.0113 6.16176 27.3443     9.63831  27.3443     9.63831  33.4053    60          0           0           
1 1 1 40 0  5  o 3  56.0322 4.25278 58.5579     11.5948  58.5579     11.5948  46.8897    300         8.7885      300         
1 1 1 40 0  6  o 9  24.2294 7.80428 15.9256     10.2749  15.9256     10.2749  11.286     360         3.30926     180         
1 1 1 40 0  7  o 17 55.4869 4.62207 57.9705     12.385   57.9705     12.385   38.5582    60          6.99322     240         
1 1 1 40 0  8  o 14 99.9526 3.09544 179.882     15.4374  179.882     15.4374  86.2894    120         21.1286     120         
1 1 1 40 0  9  o 1  38.5279 6.29095 31.0119     10.5704  31.0119     10.5704  31.9192    3.85227e-06 6.12522     3.85226e-06 
1 1 1 40 0  10 o 10 46.3099 5.17693 41.706      11.1172  41.706      11.1172  47.5143    240         25.4911     240         
1 1 1 40 0  11 o 6  14.4641 6.26779 3.59302     8.70669  3.59302     8.70669  0.937414   120         6.38888     120         
1 1 1 40 0  12 o 13 194.466 2.85747 677.066     27.8204  677.066     27.8204  195.769    180         97.5282     180         
1 1 1 40 0  13 o 15 73.4282 3.53047 98.1732     12.8513  98.1732     12.8513  49.486     60          11.9654     240         
1 1 1 40 0  14 o 12 63.0103 3.90246 73.1381     12.0959  73.1381     12.0959  52.2684    120         9.40989     120         
1 1 1 40 0  15 o 18 25.8661 7.53166 17.3763     9.6628   17.3763     9.6628   8.09394    1.80698e-08 21.5106     180         
1 1 1 40 0  16 o 18 42.4032 5.66771 36.0402     10.7899  36.0402     10.7899  45.3975    60          32.5748     60          
1 1 1 40 0  17 o 11 46.5007 5.33568 42.3235     11.452   42.3235     11.452   33.6273    120         2.76005     300         
1 1 1 40 0  18 o 10 116.991 3.03553 246.195     17.7426  246.195     17.7426  105.75     180         35.5022     180         
1 1 1 40 0  19 o 6  18.9975 7.24289 9.86452     9.56909  9.86452     9.56909  0.791982   60          27.2122     60          
1 1 1 40 0  20 o 1  17.3874 7.01369 7.68179     9.58114  7.68179     9.58114  1.77259    300         3.50315     120         
1 1 1 40 0  21 o 13 95.4957 3.21757 164.821     15.3183  164.821     15.3183  81.0945    180         18.9918     180         
1 1 1 40 0  22 f 0  17.9168 7.30565 8.08901     10.5602  8.08901     10.5602  7.7003     240         0           0           
1 1 1 40 0  23 o 4  46.6241 6.14554 43.913      12.896   43.913      12.896   54.8553    120         42.68       120         
1 1 1 40 0  24 f 0  14.423  6.33653 3.21746     9.19517  3.21746     9.19517  4.54566    360         0           0           
1 1 1 40 0  25 o 1  61.0878 3.92492 69.1924     11.7759  69.1924     11.7759  62.9944    60          34.8517     60          
1 1 1 40 0  26 o 13 16.0027 6.74768 5.74891     9.53523  5.74891     9.53523  2.27057    300         4.31712     120         
1 1 1 40 0  27 o 2  33.1979 7.33792 25.766      10.7067  25.766      10.7067  6.77002    180         5.40643     180         
1 1 1 40 0  28 o 9  71.484  3.92571 94.4199     13.8629  94.4199     13.8629  51.6489    240         2.88216     60          
1 1 1 40 0  29 o 6  46.1133 5.31403 42.1106     11.3018  42.1106     11.3018  37.6053    300         6.82447     300         
1 1 1 40 0  30 o 14 19.5372 7.45686 10.8801     10.1534  10.8801     10.1534  3.05476    180         34.5224     180         
1 1 1 40 0  31 o 12 13.857  6.25457 1.8565      9.65053  1.8565      9.65053  0.706757   59.9999     6.55537     240         
1 1 1 40 0  32 o 3  12.7149 5.92132 -0.718088   9.62798  -0.718088   9.62798  1.07393    300         11.234      300         
1 1 1 40 0  33 o 3  66.4416 3.90194 82.1269     12.7787  82.1269     12.7787  50.0846    1.30273e-06 2.30727     1.30273e-06 
1 1 1 40 0  34 f 0  47.8469 5.17376 45.2547     11.5455  45.2547     11.5455  32.5248    240         0           0           
1 1 1 40 0  35 o 19 30.4296 7.78259 23.5506     10.8879  23.5506     10.8879  19.7518    300         13.9675     300         
1 1 1 40 0  36 o 6  74.5984 4.13119 103.945     15.2202  103.945     15.2202  58.947     180         8.64491     180         
1 1 1 40 0  37 o 15 16.6599 7.47708 4.3327      13.5611  4.3327      13.5611  8.69126    240         40.6945     240         
1 1 1 40 0  38 o 7  29.2876 9.31378 25.3905     14.6243  25.3905     14.6243  22.7121    120         6.59291     120         
1 1 1 40 0  39 o 14 13.6637 6.49952 -2.88277    12.6938  -2.88277    12.6938  7.57404    8.63317e-06 31.2575     8.63317e-06 
1 1 1 40 0  40 o 6  15.5879 7.12362 2.34671     13.0217  2.34671     13.0217  2.12856    240         21.4405     240         
1 1 1 40 0  41 o 14 24.3119 8.88217 18.497      13.9081  18.497      13.9081  11.046     300         3.13078     300         
1 1 1 40 0  42 o 2  10.8928 5.46597 -14.2916    12.5998  -14.2916    12.5998  2.23618    2.31255e-05 8.31466     2.31255e-05 
1 1 1 40 0  43 o 11 17.4494 7.67951 6.38448     13.5651  6.38448     13.5651  0.925549   60.0001     0.535277    240         
1 1 1 40 0  44 o 16 37.4554 9.00478 35.9785     15.1461  35.9785     15.1461  37.3827    120         28.064      120         
1 1 1 40 0  45 o 2  64.692  4.85473 80.6086     15.2936  80.6086     15.2936  61.45      180         30.0484     180         
1 1 1 40 0  46 o 5  12.8521 6.28544 -7.9232     13.7839  -7.9232     13.7839  0.230441   60.0001     8.95888     60          
1 1 1 40 0  47 o 3  22.3434 8.79713 16.0038     14.6077  16.0038     14.6077  10.8252    120         3.55728     120         
1 1 1 40 0  48 o 5  15.2627 7.15178 0.263185    14.3936  0.263185    14.3936  1.71164    9.70848e-08 2.87154     180         
1 1 1 40 0  49 o 7  23.83   9.57135 19.6971     17.7374  19.6971     17.7374  5.00394    240         2.30119     240         
1 1 1 40 0  50 o 10 38.6713 9.70292 41.5462     17.1128  41.5462     17.1128  31.0477    300         7.57341     300         
1 1 1 40 0  51 f 0  15.9031 7.44034 1.92466     15.4811  1.92466     15.4811  6.4856     1.5968e-08  0           0           
1 1 1 40 0  52 o 10 18.0235 8.18111 7.54768     16.8016  7.54768     16.8016  4.21567    60          31.506      60          
1 1 1 40 0  53 o 18 15.8736 7.5299  0.724372    16.8222  0.724372    16.8222  0.142351   300         4.26959     120         
1 1 1 40 0  54 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 0  55 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 1  0  o 19 24.7904 7.50763 16.2295     9.52804  16.2295     9.52804  4.86885    179.999     1.39835     179.999     
1 1 1 40 1  1  o 11 46.424  4.59255 39.0975     10.4937  42.291      10.2615  33.017     73.7133     0.123633    253.713     
1 1 1 40 1  2  o 14 37.7238 5.38362 24.4651     9.88382  31.0568     9.75859  27.9996    276.272     5.71777     276.272     
1 1 1 40 1  3  o 17 14.2881 4.719   -8.98705    8.53986  -5.59459    8.22565  5.24486    106.725     22.3589     106.725     
1 1 1 40 1  4  o 8  26.9047 6.02369 17.7803     9.37565  9.7533      9.24785  10.4946    16.5698     12.5857     196.57      
1 1 1 40 1  5  o 15 104.561 2.99347 190.477     15.3499  205.755     15.9567  88.5957    119.426     20.3228     119.426     
1 1 1 40 1  6  o 2  58.3856 3.96244 62.858      11.6634  63.3701     11.2323  47.9666    246.732     11.0476     246.732     
1 1 1 40 1  7  o 5  47.9222 4.94857 49.7054     10.9013  38.107      11.8047  30.6196    271.457     7.73487     91.4572     
1 1 1 40 1  8  o 10 22.9485 6.0192  4.14487     9.85348  11.7569     9.12912  2.3499     38.0228     0.109037    38.0229     
1 1 1 40 1  9  o 9  74.8421 3.64084 125.067     13.4625  82.6428     13.2363  74.2859    238.957     38.8732     238.957     
1 1 1 40 1  10 o 8  52.0968 4.45391 50.5601     11.4003  51.4337     11.3834  32.7456    296.986     10.2668     116.986     
1 1 1 40 1  11 o 15 23.5611 6.2142  11.6959     10.0199  5.93052     9.90135  9.20795    215.975     4.38337     35.9755     
1 1 1 40 1  12 o 2  35.8446 6.02652 30.5396     10.6571  20.9202     10.8556  24.178     307.523     0.437736    307.523     
1 1 1 40 1  13 o 14 29.208  6.42009 14.8853     10.4171  18.8351     10.449   3.9266     258.176     32.2346     78.1762     
1 1 1 40 1  14 o 12 60.3807 4.03824 72.6562     11.5787  63.0099     12.4157  54.8634    17.8669     22.3267     17.8669     
1 1 1 40 1  15 o 17 34.443  5.85921 29.8612     10.0854  17.6976     10.2267  25.7308    287.049     7.26957     287.049     
1 1 1 40 1  16 o 14 76.4608 3.50183 111.93      13.7211  102.725     12.9742  40.6665    256.525     32.4841     76.5252     
1 1 1 40 1  17 o 8  54.3448 4.40946 65.7685     11.0923  46.1818     11.8986  39.6252    321.146     0.312135    321.146     
1 1 1 40 1  18 o 15 15.8428 5.13449 -8.14324    8.74371  -2.3778     9.72536  7.69414    229.399     34.1435     229.399     
1 1 1 40 1  19 o 15 50.5519 4.60012 57.5439     11.0796  40.2657     11.2658  20.5035    40.0327     32.9865     220.033     
1 1 1 40 1  20 o 11 20.5007 5.90219 3.83328     9.47988  5.25408     9.59608  7.29505    161.421     4.25916     341.421     
1 1 1 40 1  21 o 5  42.8418 5.21745 36.959      10.8289  34.8238     10.7624  34.9126    59.6017     9.8649      59.6017     
1 1 1 40 1  22 o 4  21.328  6.2239  5.66869     11.7017  3.82916     9.82856  1.75436    97.1329     23.6803     277.133     
1 1 1 40 1  23 o 5  15.0272 5.02043 -5.83717    9.56657  -15.2189    10.6694  0.391376   98.8284     11.6605     278.828     
1 1 1 40 1  24 o 9  32.782  6.18928 19.5039     10.4203  24.8421     10.4017  26.3013    353.402     12.0249     353.402     
1 1 1 40 1  25 o 7  34.9028 6.10014 23.9552     10.576   26.3185     10.6519  20.4282    339.32      7.3294      159.32      
1 1 1 40 1  26 o 14 20.0283 5.91548 1.8615      9.86616  5.15881     10.0147  4.88942    205.904     0.293111    205.904     
1 1 1 40 1  27 o 3  62.4055 4.10717 68.6023     12.9272  78.9817     12.3406  49.6154    156.457     8.50033     156.457     
1 1 1 40 1  28 o 15 86.9472 3.49907 150.386     15.8164  130.933     14.557   59.7704    28.8137     8.51536     208.814     
1 1 1 40 1  29 o 4  26.3746 6.55852 11.3394     10.2284  16.5291     11.349   7.74204    179.254     19.6418     359.254     
1 1 1 40 1  30 o 1  52.1117 4.89868 49.7496     12.7753  57.0076     12.0147  31.0781    49.4915     12.9362     229.492     
1 1 1 40 1  31 o 7  22.8159 6.24827 5.2223      10.3754  11.7337     10.3059  11.0197    117.749     1.6943      117.749     
1 1 1 40 1  32 o 10 28.7041 6.43453 21.7325     10.6424  13.1553     10.5506  8.52036    188.425     21.7194     8.4247      
1 1 1 40 1  33 o 11 47.9876 5.17884 47.9994     11.9556  44.4052     12.1368  39.7491    201.947     12.3994     201.947     
1 1 1 40 1  34 o 17 47.4317 5.78756 35.489      13.1013  58.5201     12.9146  41.5676    29.692      17.792      29.692      
1 1 1 40 1  35 o 2  20.5998 6.22125 5.98658     11.5044  0.799072    11.3611  7.20523    72.8983     5.14079     252.898     
1 1 1 40 1  36 o 12 30.0007 7.30221 18.53       14.628   21.3622     12.2588  11.1526    348.855     17.2211     168.855     
1 1 1 40 1  37 o 18 21.5156 6.43414 7.13781     11.5011  2.38709     12.6183  7.58976    173.09      5.64717     353.09      
1 1 1 40 1  38 o 6  47.6124 6.13477 49.4252     14.6103  46.7507     13.5864  29.6195    8.76592     7.02743     188.766     
1 1 1 40 1  39 o 19 42.6473 6.43937 35.9162     13.3444  43.1528     13.3623  26.1594    345.388     6.10024     165.388     
1 1 1 40 1  40 o 15 63.1795 5.04553 84.2562     16.3976  75.7414     15.0036  55.4113    169.141     22.0403     169.141     
1 1 1 40 1  41 o 3  49.0449 6.22651 54.5554     15.5369  48.0137     13.9578  37.8195    99.6069     7.97917     99.6069     
1 1 1 40 1  42 o 1  25.1584 7.01742 18.1457     14.0046  4.37184     12.7906  11.3653    258.935     7.87916     78.9351     
1 1 1 40 1  43 o 6  25.4619 7.4463  -3.38408    16.6819  20.3237     16.3887  7.79717    312.263     16.8675     132.263     
1 1 1 40 1  44 o 14 31.8088 8.07461 12.9084     17.3867  34.6015     17.2997  23.5145    4.99026     9.94425     4.99026     
1 1 1 40 1  45 o 7  57.3381 7.40671 86.6463     21.524   65.8811     19.4749  52.7505    350.06      27.0242     350.06      
1 1 1 40 1  46 o 13 24.6746 7.71687 3.22783     18.4117  11.6372     19.3077  12.8359    87.9853     1.24202     267.985     
1 1 1 40 1  47 o 15 31.0533 8.62334 31.0244     19.1936  19.6358     20.935   21.2128    266.516     7.29248     266.516     
1 1 1 40 1  48 o 12 23.8208 7.41344 17.3878     16.6648  -13.9591    21.7282  10.6501    4.05125     1.14617     4.05124     
1 1 1 40 1  49 o 12 28.9335 8.20973 31.6287     18.076   9.25199     21.21    15.2191    280.831     3.27658     100.831     
1 1 1 40 1  50 o 19 21.0538 6.95162 0.959928    16.2471  -4.04402    20.2478  1.59539    199.914     0.252006    19.914      
1 1 1 40 1  51 o 15 22.4155 7.27625 7.36436     16.7963  -0.252005   21.105   5.95576    23.3365     10.2111     203.336     
1 1 1 40 1  52 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 1  53 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 2  0  f 0  36.9896 6.18789 28.8252     9.95965  28.8252     9.95965  2.41544    180         0           0           
1 1 1 40 2  1  o 14 49.9811 4.46615 48.6198     11.139   45.601      10.7361  30.4494    273.606     12.1143     93.6064     
1 1 1 40 2  2  o 4  99.6744 3.01872 184.27      15.024   176.543     15.0574  72.6187    117.622     4.90618     297.622     
1 1 1 40 2  3  o 16 20.0996 5.76332 2.1532      9.15944  6.03267     9.05882  4.19888    236.3       2.60096     56.2997     
1 1 1 40 2  4  o 2  34.8892 5.84527 23.4608     10.2374  25.0451     9.89552  18.2985    195.505     11.7778     15.5049     
1 1 1 40 2  5  o 9  43.7182 5.03536 37.111      10.385   36.4565     10.9072  38.6098    0.689958    17.0098     0.689958    
1 1 1 40 2  6  o 17 28.1498 6.10945 20.4358     9.8843   10.5393     9.53022  16.7811    318.438     0.204411    318.439     
1 1 1 40 2  7  o 13 27.7202 6.19511 16.0221     9.77719  14.1165     9.50212  1.01498    335.444     36.3392     155.444     
1 1 1 40 2  8  o 18 61.2093 3.9672  56.7996     11.6001  83.6164     12.1731  45.0892    316.103     0.161218    136.103     
1 1 1 40 2  9  o 12 77.5267 3.35917 116.612     12.9424  103.601     12.9924  59.8826    86.1407     4.08964     86.1407     
1 1 1 40 2  10 o 19 32.4588 5.81066 30.6241     9.99439  11.6        10.0808  24.914     21.2896     11.887      21.2896     
1 1 1 40 2  11 o 17 41.2703 5.20114 30.604      10.3945  35.7294     10.2957  13.0587    62.2662     33.8834     242.266     
1 1 1 40 2  12 o 13 79.3003 3.62428 114.545     15.2469  117.123     13.2975  54.1473    76.7993     10.2269     256.799     
1 1 1 40 2  13 o 2  34.3272 6.45445 17.5767     12.381   30.274      10.9612  3.90748    210.868     41.3862     30.8676     
1 1 1 40 2  14 f 0  18.3337 5.67963 1.11324     9.98097  -2.49533    10.0294  4.62307    285.47      0           0           
1 1 1 40 2  15 o 10 29.4391 6.52545 14.5431     10.6399  20.4217     10.9432  19.8981    45.9141     10.3052     45.9141     
1 1 1 40 2  16 o 11 54.4397 4.57025 59.8142     12.1807  53.046      12.2189  23.2862    41.4955     33.8919     221.496     
1 1 1 40 2  17 o 17 50.6197 4.98982 45.0275     11.9272  54.2594     12.6696  45.2688    95.8452     17.9973     95.8452     
1 1 1 40 2  18 o 11 51.9089 4.59543 45.3197     11.2092  58.0584     12.1156  43.3228    81.3802     11.5593     81.3802     
1 1 1 40 2  19 o 18 38.1708 5.62552 27.92       10.383   30.5677     10.4421  30.2196    219.725     7.84997     219.725     
1 1 1 40 2  20 o 12 30.0458 6.09744 25.9725     10.235   10.6053     10.2242  11.291     88.1789     18.9401     268.179     
1 1 1 40 2  21 o 5  78.1474 3.6406  116.272     14.4815  110.752     13.8768  56.155     185.106     3.65796     5.10606     
1 1 1 40 2  22 o 13 78.6077 3.61595 120.47      13.7493  109.463     14.5011  53.2924    251.872     10.0445     71.872      
1 1 1 40 2  23 o 8  25.9301 6.52766 10.2334     10.1412  15.9075     11.3129  10.3327    264.753     13.3953     84.7528     
1 1 1 40 2  24 o 8  80.3512 3.54147 122.569     14.363   117.702     14.0169  63.6527    193.404     8.52399     193.404     
1 1 1 40 2  25 o 16 25.9742 6.39756 10.2304     10.263   16.3781     10.4143  5.99415    14.3341     23.1422     194.334     
1 1 1 40 2  26 o 9  21.4484 6.14465 1.99551     10.6237  9.31909     10.3238  9.13501    211.205     0.924317    211.205     
1 1 1 40 2  27 o 8  17.0738 5.44732 -4.21711    9.87756  -1.16381    9.92601  0.61398    100.804     18.0853     280.804     
1 1 1 40 2  28 o 15 60.4524 4.66445 64.0264     13.9554  78.6866     13.6314  51.4713    232.747     15.5412     232.747     
1 1 1 40 2  29 o 4  66.3746 4.2958  84.6328     13.4735  84.8767     14.7471  44.9287    281.967     7.06411     101.967     
1 1 1 40 2  30 o 1  58.8297 4.71129 69.751      13.0774  65.9482     14.1221  40.3177    185.269     4.56859     5.26854     
1 1 1 40 2  31 f 0  49.7831 5.58626 51.0665     13.5406  50.3288     13.4033  39.5417    32.7165     0           0           
1 1 1 40 2  32 o 11 21.2078 6.34309 7.6881      11.87    1.00708     11.5816  7.87344    220.894     6.59993     40.8944     
1 1 1 40 2  33 o 13 25.4542 6.77994 14.9363     11.764   10.3443     11.9389  7.38467    161.331     17.9147     341.331     
1 1 1 40 2  34 o 6  19.5722 6.07566 0.18998     11.4322  2.18957     11.4993  5.54515    247.908     5.96792     67.9079     
1 1 1 40 2  35 o 9  20.7643 6.29645 8.37977     12.1467  -2.58495    11.852   0.721609   266.22      23.7417     86.2204     
1 1 1 40 2  36 o 9  25.2609 6.77589 19.7883     12.5176  2.52734     12.7891  10.2452    181.947     9.52313     1.94652     
1 1 1 40 2  37 o 11 49.9931 5.68257 55.6315     13.6318  48.1825     13.798   41.7991    113.904     14.4805     113.904     
1 1 1 40 2  38 o 7  33.6732 7.10658 34.057      13.4319  17.8092     13.4602  11.3308    213.154     23.1678     33.1537     
1 1 1 40 2  39 o 9  19.9818 6.21    -1.9747     12.1957  4.26734     12.0056  4.97058    135.555     0.118961    315.555     
1 1 1 40 2  40 f 0  29.3412 7.57792 14.0367     14.4254  24.3787     15.0094  18.5552    7.21056     0           0           
1 1 1 40 2  41 o 10 21.1011 6.59004 8.11323     13.9202  -7.64563    14.396   5.84194    237.651     13.5803     57.6506     
1 1 1 40 2  42 o 4  26.7064 7.47069 8.24405     14.8603  20.1964     15.3534  12.0957    125.031     9.53592     305.031     
1 1 1 40 2  43 o 18 25.3326 7.65524 10.556      18.5327  10.4217     15.9624  13.7359    102.962     1.51504     282.962     
1 1 1 40 2  44 o 9  20.758  6.65686 -33.8353    19.7946  10.3873     15.0866  8.46699    288.935     3.69752     108.935     
1 1 1 40 2  45 o 8  36.6195 8.92067 49.9703     22.2045  27.445      17.8506  24.4531    174.601     18.1838     174.601     
1 1 1 40 2  46 o 5  30.1874 8.50805 33.2266     21.6683  17.3578     17.0112  17.8659    177.585     9.66482     177.585     
1 1 1 40 2  47 o 8  17.6269 6.07944 -21.515     19.745   -13.9115    15.2563  2.96004    121.914     5.7129      301.914     
1 1 1 40 2  48 o 9  21.5402 7.08464 -4.51584    21.042   3.43274     16.5807  6.68934    149.118     3.41279     329.118     
1 1 1 40 2  49 o 4  24.6566 7.78461 12.1377     21.7094  11.7028     17.6569  9.20165    161.346     7.18878     341.346     
1 1 1 40 2  50 o 2  22.3191 7.28591 3.76376     21.5068  4.50818     16.7114  3.48369    353.749     0.743265    173.749     
1 1 1 40 2  51 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 3  0  o 11 47.9819 4.74486 44.2832     10.7704  44.2832     10.7704  35.0791    2.21388e-05 2.99746     180         
1 1 1 40 3  1  o 1  54.2722 4.24945 64.77       11.15    46.7277     11.2446  46.0875    56.9127     12.77       56.9127     
1 1 1 40 3  2  o 19 75.3672 3.46273 91.4598     12.9077  118.299     12.9256  66.0263    356.97      19.4346     356.97      
1 1 1 40 3  3  o 2  23.9515 6.24596 10.9396     9.55703  8.66989     10.3045  0.816112   151.364     30.8057     331.364     
1 1 1 40 3  4  o 6  76.6481 3.4774  105.405     13.0683  110.855     13.5063  73.8758    18.6725     33.5489     18.6725     
1 1 1 40 3  5  o 15 32.5764 6.17165 20.1505     10.6948  23.0165     9.92976  20.0082    323.99      4.48643     143.99      
1 1 1 40 3  6  f 0  25.9163 6.21013 13.617      9.48896  12.1327     9.748    33.1206    179.007     0           0           
1 1 1 40 3  7  o 18 43.5515 5.49651 39.7093     10.7735  35.1271     12.2074  36.5337    183.088     11.3434     183.088     
1 1 1 40 3  8  o 18 35.9569 5.89535 32.6323     10.7428  20.0415     10.3167  23.6456    99.8141     3.02401     279.814     
1 1 1 40 3  9  o 3  30.6753 6.28592 17.6199     9.97217  20.8736     10.4959  15.6707    20.3411     10.783      200.341     
1 1 1 40 3  10 o 6  23.2475 6.1311  11.9018     9.8489   6.05862     9.53847  11.2583    161.061     4.56843     341.061     
1 1 1 40 3  11 f 0  81.7615 3.31542 123.657     13.5619  122.083     13.4933  52.5894    244.379     0           0           
1 1 1 40 3  12 o 14 97.6383 3.11727 176.837     15.1477  172.035     15.275   93.106     248.983     39.7077     248.983     
1 1 1 40 3  13 f 0  44.6973 5.06007 38.6725     10.9042  39.3616     11.0002  30.4569    101.72      0           0           
1 1 1 40 3  14 o 9  50.1914 4.73305 51.4123     11.899   45.7516     11.3128  39.8608    149.647     6.6773      149.646     
1 1 1 40 3  15 o 13 94.8163 3.2949  169.723     15.9287  161.201     15.2899  94.0058    58.1617     46.2891     58.1617     
1 1 1 40 3  16 f 0  31.4467 6.56783 23.2606     10.9954  18.1218     11.2936  21.7359    244.758     0           0           
1 1 1 40 3  17 o 15 51.214  5.05454 60.2917     12.3015  42.9353     12.5135  45.8762    281.111     17.9029     281.111     
1 1 1 40 3  18 o 9  61.1523 4.51036 82.4632     13.8856  61.6153     13.1783  44.2686    252.459     1.79125     72.4587     
1 1 1 40 3  19 o 9  30.8235 6.44917 11.3883     11.1669  28.1979     11.4222  23.7551    202.27      9.07709     202.27      
1 1 1 40 3  20 o 11 47.3025 5.74702 38.8946     13.3166  52.1873     12.6772  30.2397    327.189     8.21032     147.189     
1 1 1 40 3  21 o 2  41.9016 5.88266 33.1633     11.7789  39.1433     12.0542  25.9684    107.759     8.18731     287.759     
1 1 1 40 3  22 o 13 76.3215 4.0154  105.928     13.8919  114.747     16.556   62.0844    83.6515     11.1211     83.6515     
1 1 1 40 3  23 f 0  39.2439 5.92105 46.8328     11.0859  18.636      12.1264  17.8288    134.835     0           0           
1 1 1 40 3  24 f 0  31.2601 6.40078 27.5937     10.6793  13.7624     11.6451  17.8466    88.6521     0           0           
1 1 1 40 3  25 o 4  23.4921 6.30791 9.66529     10.2651  10.2685     10.2165  5.7071     268.932     19.2513     88.9322     
1 1 1 40 3  26 o 7  23.0076 6.12013 15.8099     10.2466  0.154442    10.5967  2.82703    18.6414     24.733      198.641     
1 1 1 40 3  27 o 2  18.4644 5.85281 -1.44261    11.0245  -1.31914    11.3719  4.07682    13.1495     1.41953     193.15      
1 1 1 40 3  28 o 9  71.5999 4.25084 100.346     14.9842  97.1664     15.2292  64.0246    47.5075     23.5797     47.5075     
1 1 1 40 3  29 o 18 25.3789 6.79859 3.76165     13.207   18.5559     12.0792  14.046     31.4772     4.29292     31.4772     
1 1 1 40 3  30 o 1  32.6317 7.15417 27.6561     12.3948  20.3816     13.9413  24.9724    232.568     13.3304     232.568     
1 1 1 40 3  31 o 18 28.4013 6.98138 18.7955     12.0153  16.4772     12.3602  18.3094    252.338     4.99642     252.338     
1 1 1 40 3  32 o 17 21.4886 6.39168 8.49149     11.702   1.57034     11.9838  7.4358     3.64997     1.08415     183.65      
1 1 1 40 3  33 o 1  38.2285 7.11698 20.8905     12.7817  47.8524     15.8763  28.431     343.641     6.31559     343.641     
1 1 1 40 3  34 o 1  26.0437 6.70651 24.2612     12.8575  -0.898979   12.8624  14.1166    354.838     3.36817     354.838     
1 1 1 40 3  35 o 13 18.1444 5.82307 3.86818     11.6628  -15.4069    12.7097  3.34424    194.67      2.8045      14.6698     
1 1 1 40 3  36 o 11 38.931  6.96948 38.9931     13.3143  29.7345     14.1702  27.7401    329.688     2.84672     329.688     
1 1 1 40 3  37 o 16 33.7513 7.53625 29.1377     13.3495  24.2025     15.6079  22.5878    344.678     0.992245    344.678     
1 1 1 40 3  38 o 3  17.4949 5.86949 -17.2219    13.4171  -5.11369    14.3631  4.74811    15.6991     4.40319     195.699     
1 1 1 40 3  39 o 17 28.2178 7.78984 21.659      16.9703  13.2517     14.9548  16.9407    311.624     1.0718      131.624     
1 1 1 40 3  40 o 18 25.0394 7.42662 17.4527     16.0448  0.733613    16.5896  12.3945    105.553     5.65181     105.553     
1 1 1 40 3  41 o 18 25.8474 7.61015 9.56738     16.8453  15.3075     16.0246  9.7567     331.716     5.40464     331.716     
1 1 1 40 3  42 o 15 24.8916 7.48993 10.0764     16.6336  11.2049     16.1139  13.384     289.141     4.82359     289.141     
1 1 1 40 3  43 o 8  41.8767 8.44745 53.8856     19.2825  39.9894     18.2061  33.775     220.234     12.3228     220.234     
1 1 1 40 3  44 o 13 30.1258 8.13995 30.1395     17.5836  17.9642     17.1985  18.7652    44.1756     1.34598     44.1756     
1 1 1 40 3  45 o 4  24.0635 7.27043 -3.32616    16.8727  20.2267     16.2277  10.0913    309.393     1.99276     309.393     
1 1 1 40 3  46 o 10 21.0777 6.98129 -11.2984    20.5347  4.4184      17.4669  2.21003    235.92      0.169981    55.9198     
1 1 1 40 3  47 o 1  24.5058 7.71177 9.24861     22.0746  13.401      16.8011  9.88955    40.7438     1.22003     220.744     
1 1 1 40 3  48 o 6  29.102  8.32538 17.4304     22.6247  31.1099     17.59    15.4736    268.811     1.72928     268.811     
1 1 1 40 3  49 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 3  50 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 4  0  o 16 109.938 2.98653 218.233     16.399   218.233     16.399   81.0748    180         5.74023     2.23098e-05 
1 1 1 40 4  1  f 0  65.0814 3.97907 65.3213     12.7394  94.8099     12.4787  28.2654    289.978     0           0           
1 1 1 40 4  2  o 18 23.5973 5.52389 -7.94868    9.66724  21.0151     9.71811  12.6335    156.401     2.9939      336.401     
1 1 1 40 4  3  o 8  29.4765 6.22711 13.6857     10.1091  21.8408     10.0681  17.713     72.808      4.21171     252.808     
1 1 1 40 4  4  f 0  30.309  5.90885 4.75399     10.9851  30.8419     10.4898  25.7233    234.808     0           0           
1 1 1 40 4  5  o 5  15.7776 5.10606 -3.82588    9.01372  -5.21389    9.14448  1.51201    75.1747     2.32648     255.175     
1 1 1 40 4  6  o 13 19.3631 5.73446 -1.14619    9.56346  6.09086     9.5004   2.34079    303.071     19.3586     123.071     
1 1 1 40 4  7  o 14 25.0859 6.26485 13.0412     9.87167  10.9132     9.79442  12.3444    291.187     7.50084     111.187     
1 1 1 40 4  8  o 15 41.4677 5.37126 31.9571     10.7936  36.6348     10.6828  25.2867    190.059     9.6536      10.0591     
1 1 1 40 4  9  o 18 34.6996 6.03474 19.8961     10.6669  30.0366     10.437   25.0345    210.598     2.0431      210.598     
1 1 1 40 4  10 o 2  65.4519 3.96098 85.2566     12.518   76.1106     13.1236  58.3066    52.9391     19.3547     52.9391     
1 1 1 40 4  11 o 8  15.7684 5.14181 -5.87344    9.40915  -4.83441    9.48075  1.28401    293.442     13.0584     113.442     
1 1 1 40 4  12 o 18 22.0144 6.07208 3.0846      9.79489  11.0871     9.98826  3.24554    60.6608     1.29442     60.6608     
1 1 1 40 4  13 o 4  24.2573 6.27661 13.4916     10.1084  8.04755     10.0152  14.0242    309.158     4.34686     309.158     
1 1 1 40 4  14 o 9  24.7434 6.44797 8.33066     10.9745  14.0265     10.4048  9.37732    157.301     13.9299     337.301     
1 1 1 40 4  15 o 10 67.1468 3.88804 88.2728     13.2104  81.8319     12.7266  51.1668    256.839     2.26348     256.839     
1 1 1 40 4  16 o 18 18.1489 5.67948 -4.11197    9.69301  2.43661     10.8085  4.66025    101.742     10.242      281.742     
1 1 1 40 4  17 o 17 37.7803 6.00399 27.3745     10.9019  32.2668     11.2988  8.95801    296.282     37.0805     116.282     
1 1 1 40 4  18 o 14 62.9254 4.02393 71.9799     12.469   78.6242     12.6194  53.6386    74.8061     14.3595     74.8061     
1 1 1 40 4  19 o 7  29.4205 6.53255 9.18118     12.5336  25.8454     10.8928  21.3905    35.3494     6.04649     35.3494     
1 1 1 40 4  20 o 17 33.554  6.53248 22.2705     11.5632  26.5677     11.1957  27.1687    62.9659     10.6998     62.9659     
1 1 1 40 4  21 o 11 30.6223 6.80311 25.3868     12.5666  15.9422     10.9031  11.5324    32.497      19.4749     212.497     
1 1 1 40 4  22 o 4  73.7583 4.32582 91.8024     14.8023  118.913     16.8871  57.8747    261.077     6.43621     261.077     
1 1 1 40 4  23 o 14 42.4486 6.73128 41.3708     13.8099  37.4343     14.1353  37.1776    11.6936     15.8137     11.6936     
1 1 1 40 4  24 o 8  32.373  7.41052 23.3983     13.7961  24.5846     13.6557  5.30605    21.1256     35.1114     201.126     
1 1 1 40 4  25 o 2  21.808  6.61881 6.95192     13.1604  1.53972     12.9196  9.31464    217.665     4.45187     37.6649     
1 1 1 40 4  26 o 17 49.2236 6.10911 46.0223     13.2456  56.5878     15.8264  43.2837    322.582     17.0616     322.582     
1 1 1 40 4  27 o 18 27.4226 7.16755 17.5533     11.9597  13.7764     14.5147  13.8455    153.375     7.075       333.375     
1 1 1 40 4  28 o 1  37.5424 7.29093 29.2483     12.7092  36.0654     15.5776  32.3101    154.787     20.6199     154.787     
1 1 1 40 4  29 o 5  22.4508 6.67219 8.33063     13.0029  4.6616      12.4831  9.22579    347.765     4.52083     167.765     
1 1 1 40 4  30 o 7  20.7326 6.43858 2.88541     11.5052  1.5392      14.299   4.68187    60.0233     0.649191    240.023     
1 1 1 40 4  31 o 14 31.3221 7.21806 24.7396     12.6813  20.3987     13.5234  7.54054    98.1858     27.809      278.186     
1 1 1 40 4  32 o 2  26.1651 7.05062 19.8628     13.3216  6.92106     13.2123  13.0997    159.468     5.28509     159.468     
1 1 1 40 4  33 o 3  44.327  7.355   37.0401     15.5643  54.2369     16.7851  31.9171    186.503     2.14175     186.503     
1 1 1 40 4  34 o 2  32.9636 7.97989 31.8917     15.9634  20.3094     16.4859  23.4747    68.9524     4.97362     68.9524     
1 1 1 40 4  35 o 17 26.7077 7.66346 12.3963     16.2398  15.2002     15.8305  14.511     71.0855     4.01375     251.086     
1 1 1 40 4  36 o 3  37.5802 8.29275 31.9463     16.9653  39.0756     17.7574  14.5578    182.127     23.3408     2.12734     
1 1 1 40 4  37 o 7  62.604  6.6589  92.3355     19.7017  79.8162     20.5378  44.581     104.209     0.793399    284.209     
1 1 1 40 4  38 o 3  26.2225 7.71359 17.9369     16.2693  6.6132      18.0853  11.8043    31.0715     9.67358     211.071     
1 1 1 40 4  39 o 1  20.6196 6.62584 11.3545     16.4142  -22.1638    15.3888  7.10711    323.907     1.07856     323.907     
1 1 1 40 4  40 o 15 23.1026 7.21892 0.0971054   16.3739  10.6747     16.7765  11.8118    279.31      0.638687    99.31       
1 1 1 40 4  41 o 11 25.7779 7.64077 16.3864     16.8724  11.0868     16.4378  14.9687    41.0044     2.89006     41.0044     
1 1 1 40 4  42 o 18 32.8893 8.23911 19.2759     17.7401  40.4088     17.9324  23.4358    164.018     6.9754      164.018     
1 1 1 40 4  43 o 12 26.366  7.71656 8.34983     17.2123  23.7117     17.0309  14.2682    210.374     2.65319     210.374     
1 1 1 40 4  44 o 15 22.9841 7.21368 12.385      16.8767  3.36663     16.4811  6.27873    148.675     0.805049    148.675     
1 1 1 40 4  45 o 4  20.3449 6.67884 7.6178      16.8154  -10.8235    16.4337  4.94832    10.3351     4.3856      190.335     
1 1 1 40 4  46 o 14 28.3516 8.21853 30.2175     19.1284  17.0884     18.6585  14.1648    222.742     3.3854      222.742     
1 1 1 40 4  47 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 4  48 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 5  0  o 15 10.8183 5.25242 -5.34575    9.21587  -5.34575    9.21587  9.01948    8.66527e-06 30.6818     8.66527e-06 
1 1 1 40 5  1  o 5  23.0485 6.21527 9.58928     9.92552  8.63984     10.0177  12.8448    346.087     1.03848     346.087     
1 1 1 40 5  2  o 5  18.0406 5.596   -1.4501     9.90771  1.23144     9.55487  5.54801    12.4333     3.2525      192.433     
1 1 1 40 5  3  o 9  24.0037 6.26007 5.29495     9.97605  15.1621     10.4889  8.52202    167.556     4.35806     167.556     
1 1 1 40 5  4  o 18 34.9054 6.22675 24.5571     11.0473  26.839      10.7534  23.0921    86.3819     3.0653      266.382     
1 1 1 40 5  5  o 10 33.3868 6.35397 20.5535     11.1747  26.8034     10.7348  29.1145    121.043     16.7738     121.043     
1 1 1 40 5  6  o 4  21.2071 6.06534 6.2134      9.86972  5.84799     10.1117  5.36086    44.4925     1.75378     44.4925     
1 1 1 40 5  7  o 10 40.1477 5.71873 27.49       11.1713  38.9855     11.0224  40.2166    310.161     28.0321     310.161     
1 1 1 40 5  8  o 17 50.8221 4.68735 46.2379     11.5318  54.6899     11.7045  46.2741    286.617     18.3441     286.617     
1 1 1 40 5  9  o 1  17.9118 5.50398 -8.21898    9.47524  5.93825     9.87758  5.2199     11.8457     7.6428      191.846     
1 1 1 40 5  10 o 16 22.1673 5.81598 17.9628     10.2676  -14.6226    11.8388  7.44825    19.255      13.6578     199.255     
1 1 1 40 5  11 o 13 91.6394 3.28864 154.677     15.0173  156.892     15.0894  66.5021    85.8885     5.49571     265.888     
1 1 1 40 5  12 o 19 56.6453 4.40537 67.5667     12.3037  56.6461     12.2026  37.6597    346.171     8.98614     166.171     
1 1 1 40 5  13 o 2  50.6931 4.99274 46.8472     12.6126  55.1872     11.8671  31.5124    246.797     11.9227     66.7967     
1 1 1 40 5  14 o 5  50.7078 4.829   55.1206     11.793   46.4858     12.0005  33.4242    279.059     7.96733     99.0587     
1 1 1 40 5  15 o 6  76.4558 3.73884 110.964     13.7509  109.702     14.6954  64.449     106.073     14.4836     106.073     
1 1 1 40 5  16 o 4  21.4218 6.05427 -0.608823   10.2808  12.0457     10.3841  9.98958    10.4576     2.7294      190.458     
1 1 1 40 5  17 o 16 27.3248 6.50722 18.5826     10.6752  12.9459     10.6212  3.39911    87.7434     31.4608     267.743     
1 1 1 40 5  18 o 14 42.8799 6.38145 39.0074     13.7444  39.9467     12.8062  38.506     247.496     17.2457     247.496     
1 1 1 40 5  19 o 14 75.0752 4.06446 103.613     14.6316  112.34      15.7251  65.1033    232.375     18.518      232.375     
1 1 1 40 5  20 o 18 25.1966 6.75925 7.65625     11.5317  16.6827     12.3381  14.0658    239.917     2.10371     59.9166     
1 1 1 40 5  21 o 4  22.7709 6.37216 -4.30808    11.3404  17.1071     12.2572  8.37109    70.329      11.4129     250.329     
1 1 1 40 5  22 o 18 21.4083 6.61244 4.45897     12.5897  1.08923     14.3893  8.40103    229.509     6.24531     49.5094     
1 1 1 40 5  23 o 13 21.9034 6.47064 -4.15638    12.6297  12.5615     12.4527  8.15316    280.239     8.85214     100.239     
1 1 1 40 5  24 o 11 86.0675 4.39412 145.218     19.1017  143.033     18.5469  65.7334    173.124     3.55063     173.124     
1 1 1 40 5  25 o 17 17.7047 5.82428 -1.51652    12.9848  -12.0352    12.2287  2.57961    254.635     26.2763     254.635     
1 1 1 40 5  26 o 1  29.2955 7.33765 28.7491     14.9956  9.66747     13.1484  19.1769    190.633     7.80023     190.633     
1 1 1 40 5  27 f 0  36.2384 7.54747 22.0078     14.8039  40.8023     15.4919  19.1544    325.787     0           0           
1 1 1 40 5  28 o 8  22.4668 6.78813 5.75181     12.4905  6.12849     14.591   8.5529     183.315     7.78208     3.31523     
1 1 1 40 5  29 o 16 34.2615 7.8556  32.2023     15.2984  24.7361     15.8611  25.3413    349.434     6.82652     349.434     
1 1 1 40 5  30 o 19 22.6631 6.84178 3.47965     12.5796  9.13435     14.843   8.99868    252.741     8.4402      72.7411     
1 1 1 40 5  31 o 18 39.5223 8.39394 34.5825     16.2409  44.4202     19.6885  34.6002    296.949     18.2244     296.949     
1 1 1 40 5  32 o 6  34.3976 8.5276  32.3875     16.8589  27.3566     20.1229  20.2097    23.8326     6.15103     203.833     
1 1 1 40 5  33 o 4  27.5379 7.79456 25.0407     16.2834  -1.59276    20.1872  14.7871    232.54      5.83534     52.5405     
1 1 1 40 5  34 o 4  25.2238 7.48329 9.67083     16.1116  11.9447     15.8449  15.1708    186.684     4.95296     186.684     
1 1 1 40 5  35 f 0  46.1648 7.93427 55.6859     18.3266  48.4011     18.0766  27.2698    315.205     0           0           
1 1 1 40 5  36 o 2  29.0264 7.9191  9.70905     17.9795  28.0905     16.5225  18.8111    307.474     1.47658     307.474     
1 1 1 40 5  37 o 13 31.1556 8.12399 31.4355     17.2859  18.3509     16.803   13.8406    252.821     14.2262     72.8212     
1 1 1 40 5  38 o 17 23.0954 7.26466 8.22433     16.522   2.91648     17.4621  11.8209    164.531     0.963448    164.531     
1 1 1 40 5  39 o 14 26.7264 7.67676 30.2967     17.9058  -3.91933    17.8225  14.4529    221.413     3.37023     41.4131     
1 1 1 40 5  40 o 8  23.1692 7.2919  5.10603     17.4296  9.37628     16.7928  10.0309    241.839     0.993878    241.839     
1 1 1 40 5  41 o 16 24.63   7.54787 5.72541     18.204   17.5811     16.9423  11.7636    261.008     0.605991    261.008     
1 1 1 40 5  42 o 11 31.8331 8.54116 30.6887     19.2529  32.1736     18.345   20.2596    7.11766     9.97989     7.11767     
1 1 1 40 5  43 o 16 23.3479 7.40214 9.26904     18.3407  9.43167     17.513   8.76999    77.467      3.91809     257.467     
1 1 1 40 5  44 o 13 22.3489 7.20491 13.1655     17.9618  -3.22541    18.4567  3.44161    75.3366     0.375038    255.337     
1 1 1 40 5  45 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 5  46 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 6  0  o 4  30.1808 8.07377 23.864      11.4504  23.864      11.4504  21.9689    180         1.92731     360         
1 1 1 40 6  1  o 9  45.7405 5.28254 35.0253     11.639   50.0377     11.4215  41.3777    178.079     16.7824     178.079     
1 1 1 40 6  2  o 19 57.7204 4.40431 58.2968     12.4267  71.2016     12.5267  53.5982    336.772     21.7297     336.772     
1 1 1 40 6  3  o 9  43.9342 5.6067  43.456      11.9421  36.0302     11.7999  38.8254    76.2016     14.6343     76.2016     
1 1 1 40 6  4  o 2  59.0008 4.28116 76.3762     12.4141  58.5297     12.3251  52.6487    312.56      17.6099     312.56      
1 1 1 40 6  5  o 17 36.7163 6.05325 25.5566     10.9208  31.7804     10.9991  25.0679    235.094     2.13393     55.0944     
1 1 1 40 6  6  o 15 26.2279 6.3897  7.62592     10.6846  19.8609     10.6564  17.5927    90.9667     6.21654     90.9667     
1 1 1 40 6  7  o 6  57.2052 4.40149 64.9618     12.3646  62.2034     12.4555  60.8902    184.953     38.5378     184.953     
1 1 1 40 6  8  o 18 22.1476 6.30903 7.99747     10.2609  6.83992     11.3027  5.05965    121.23      18.9201     301.23      
1 1 1 40 6  9  o 13 41.6871 5.67838 30.1209     11.3478  42.4008     11.4574  33.2994    135.949     6.82727     135.949     
1 1 1 40 6  10 o 14 44.4145 5.67997 31.4967     11.8845  51.1425     12.2403  22.4455    196.514     20.573      16.5142     
1 1 1 40 6  11 o 16 22.6022 6.32986 9.28386     10.3654  7.51565     10.979   6.80592    333.317     15.6694     153.317     
1 1 1 40 6  12 f 0  81.5863 4.24096 128.48      18.9015  128.087     15.2614  54.2062    138.613     0           0           
1 1 1 40 6  13 o 11 19.9816 6.04203 -4.47086    11.8318  7.73064     10.6418  7.62203    59.3915     5.64901     239.392     
1 1 1 40 6  14 o 9  68.3937 4.92301 94.8453     17.7499  91.108      15.4513  69.207     49.4784     37.3106     49.4784     
1 1 1 40 6  15 o 15 38.5353 6.85996 18.389      13.046   50.2774     15.0966  18.5549    246.248     18.4328     66.2475     
1 1 1 40 6  16 o 16 32.2512 7.15024 22.3588     12.9663  25.2007     12.7965  22.5269    179.184     2.18475     179.184     
1 1 1 40 6  17 o 1  22.1594 6.4533  -9.38878    13.5278  15.0085     12.3886  7.16764    45.0302     1.82252     45.0302     
1 1 1 40 6  18 o 4  40.8962 6.78402 38.6721     13.7475  35.8597     13.5851  37.3422    94.6316     19.6028     94.6316     
1 1 1 40 6  19 o 1  23.1314 6.70068 9.72059     12.1256  6.86323     12.7137  10.2919    142.719     6.05959     322.719     
1 1 1 40 6  20 o 15 20.7365 6.25924 10.1121     11.9449  -5.59629    12.2512  2.62621    310.328     20.5342     130.329     
1 1 1 40 6  21 o 6  24.1725 6.83132 6.99999     12.5122  13.5995     12.7351  5.97581    201.671     19.3786     21.6711     
1 1 1 40 6  22 o 7  33.2016 7.40631 31.0554     13.5533  20.5768     14.7668  16.7949    47.3013     11.9058     227.301     
1 1 1 40 6  23 o 16 51.1677 5.90122 51.8106     14.3759  58.8864     14.8259  39.9606    291.829     6.23968     291.829     
1 1 1 40 6  24 o 4  63.5317 5.04154 86.0675     15.5235  76.8287     15.9226  49.2087    14.478      5.09896     14.478      
1 1 1 40 6  25 o 14 40.9707 6.77755 48.8958     13.9305  27.521      14.0228  28.7911    152.508     0.0814655   152.507     
1 1 1 40 6  26 o 2  22.9486 6.87114 6.15641     14.0283  7.83305     13.3225  6.04361    122.969     2.08555     122.969     
1 1 1 40 6  27 o 7  32.1304 7.76287 26.9193     15.7317  22.8358     14.2978  20.3622    164.643     1.96978     344.643     
1 1 1 40 6  28 o 16 25.6063 7.64891 6.78582     18.1044  13.8739     16.0608  9.83421    22.5413     5.14169     22.5413     
1 1 1 40 6  29 o 10 40.9461 8.79184 46.8223     20.0488  40.7245     19.2427  32.7041    266.796     9.30142     266.796     
1 1 1 40 6  30 o 18 34.3958 8.47688 21.8166     19.4988  38.0672     17.9083  22.3149    353.66      1.99917     173.66      
1 1 1 40 6  31 o 10 28.567  8.05422 6.6609      19.1162  26.8106     17.5863  17.9635    63.27       10.457      63.27       
1 1 1 40 6  32 o 6  27.2922 7.98954 13.1612     17.6332  18.0662     18.1113  17.333     270.798     1.73671     270.798     
1 1 1 40 6  33 o 4  26.7316 8.12583 2.49271     16.9769  25.916      22.3524  6.6506     72.3639     22.5741     252.364     
1 1 1 40 6  34 o 4  34.4708 9.09924 28.3124     18.452   41.5772     23.7198  25.2144    210.696     5.71246     210.696     
1 1 1 40 6  35 o 15 37.7026 9.92566 49.724      24.6185  43.743      25.8404  25.6998    95.3909     0.884635    95.3909     
1 1 1 40 6  36 o 19 24.2726 7.6953  -8.52189    17.5003  22.6986     21.7843  8.81885    324.683     3.71293     324.683     
1 1 1 40 6  37 o 4  24.5135 7.87457 7.76109     17.9378  10.0134     24.2991  11.9623    277.062     2.48235     277.062     
1 1 1 40 6  38 o 9  20.7595 6.98363 -24.073     16.6968  12.807      21.9762  6.61535    356.233     1.77692     176.233     
1 1 1 40 6  39 o 9  55.1933 8.53919 70.9542     23.8855  99.5923     22.432   53.1683    45.8141     31.6423     45.8141     
1 1 1 40 6  40 o 12 31.6686 8.31818 46.3003     19.3568  13.4441     19.5278  20.068     51.9223     2.44095     51.9223     
1 1 1 40 6  41 o 9  22.1899 7.12772 18.439      18.2536  -14.0444    18.3662  7.00863    33.4004     2.87563     213.4       
1 1 1 40 6  42 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 6  43 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 7  0  o 19 41.2875 7.05695 37.7251     12.6569  37.7251     12.6569  45.4319    180         37.7956     180         
1 1 1 40 7  1  o 10 35.2901 6.78475 29.8698     12.2591  26.0264     12.4236  31.4306    283.791     19.5496     283.791     
1 1 1 40 7  2  o 18 43.6805 6.22209 29.0355     12.8206  54.3625     13.5544  22.3077    296.541     19.8141     116.541     
1 1 1 40 7  3  o 16 32.6118 6.87049 19.9938     12.3388  27.9807     12.1186  22.7296    292.868     0.984949    292.868     
1 1 1 40 7  4  o 6  54.5273 5.26821 76.5186     13.158   45.4769     13.6838  44.9084    78.2637     9.04582     78.2637     
1 1 1 40 7  5  o 19 26.6112 6.62634 6.78506     11.2822  22.1052     11.8922  10.0485    336.992     16.147      156.992     
1 1 1 40 7  6  o 2  21.6169 6.41693 6.80983     12.3185  4.71171     11.1615  7.01033    230.176     12.6953     50.1757     
1 1 1 40 7  7  o 16 24.9378 6.73158 14.5504     11.9653  9.67924     11.5459  14.7027    22.2123     3.39374     22.2122     
1 1 1 40 7  8  o 16 53.3012 5.45648 50.5364     13.9502  66.4324     14.0935  35.2884    353.997     8.67171     173.997     
1 1 1 40 7  9  o 3  19.967  6.06651 9.93394     11.9767  -7.49261    11.015   4.94435    308.781     13.856      128.781     
1 1 1 40 7  10 o 8  27.7726 6.94906 6.82987     12.4989  25.4039     13.2473  17.3767    80.9517     8.67616     80.9517     
1 1 1 40 7  11 o 1  49.6573 6.08214 51.3199     14.4667  53.5288     14.7084  42.9471    357.489     13.8754     357.489     
1 1 1 40 7  12 o 6  15.9373 5.34575 -5.29507    11.071   -16.5524    12.3505  1.44386    148.106     2.84899     328.106     
1 1 1 40 7  13 o 3  21.8047 6.57075 6.67996     12.0332  3.68691     13.3403  3.18266    65.7273     0.786561    65.7273     
1 1 1 40 7  14 o 15 44.4161 6.99871 32.7734     13.8636  58.1823     16.83    37.5175    261.149     12.2485     261.149     
1 1 1 40 7  15 o 3  20.1116 6.29606 -0.0582388  11.7994  2.78917     13.2595  1.75884    215.363     0.0250632   35.3628     
1 1 1 40 7  16 f 0  23.1843 7.08117 13.7139     16.8324  -1.33338    13.3817  14.3662    110.222     0           0           
1 1 1 40 7  17 f 0  22.9965 6.65903 -1.96859    12.6229  15.732      13.1728  20.5326    325.782     0           0           
1 1 1 40 7  18 o 14 26.2515 6.6105  26.3606     12.7254  -4.76555    13.6541  6.65262    90.4862     3.55896     90.4862     
1 1 1 40 7  19 o 9  17.5995 5.79221 -7.45041    11.8631  -4.30979    12.9035  2.61946    188.004     2.58731     8.00399     
1 1 1 40 7  20 o 4  53.8432 5.8984  57.8754     14.9319  64.8201     15.8734  46.4187    202.827     14.6728     202.827     
1 1 1 40 7  21 o 15 45.3843 6.92273 56.6683     14.5146  36.9913     16.2335  30.4852    41.5181     4.47143     221.518     
1 1 1 40 7  22 o 3  30.0724 7.27433 2.78495     13.6439  37.0247     16.1607  18.5382    81.6639     2.58952     261.664     
1 1 1 40 7  23 o 2  39.277  7.23714 40.7137     13.9162  31.2101     15.2342  27.3182    39.3687     0.685586    219.369     
1 1 1 40 7  24 o 5  23.9538 7.43547 13.7142     17.914   -4.07459    17.1911  9.57411    217.845     4.09095     217.845     
1 1 1 40 7  25 o 4  28.0101 7.9118  18.8167     16.4883  15.0037     17.1768  19.4509    50.122      8.40863     50.122      
1 1 1 40 7  26 o 14 29.2908 8.03964 24.9213     16.8773  14.1826     17.5333  13.4211    161.315     13.0205     341.315     
1 1 1 40 7  27 o 3  26.3077 7.81452 15.8295     17.8281  10.0107     17.1196  16.8668    299.298     2.83434     299.298     
1 1 1 40 7  28 o 9  28.2135 8.0527  19.2326     17.5904  16.7951     17.5686  17.4241    327.165     1.21208     147.165     
1 1 1 40 7  29 o 4  27.0953 7.77208 1.76398     18.2723  25.4987     17.0761  18.3102    54.3175     5.99839     54.3175     
1 1 1 40 7  30 o 2  23.6312 7.45135 -5.44789    20.7265  12.087      16.7803  12.8655    272.629     1.0096      92.629      
1 1 1 40 7  31 o 1  26.7976 8.2723  31.5397     24.0359  -4.37677    18.7902  16.5923    198.844     7.14497     198.844     
1 1 1 40 7  32 o 19 51.8992 8.88288 63.6688     25.2907  84.6546     21.5139  42.684     123.13      11.7726     123.13      
1 1 1 40 7  33 o 14 34.3203 8.91566 47.3447     21.961   24.4151     19.0209  26.7862    226.623     11.0802     226.623     
1 1 1 40 7  34 o 15 27.3771 8.05061 36.4931     21.0782  -2.05689    17.8762  15.5697    344.831     6.9658      344.831     
1 1 1 40 7  35 o 12 28.7797 8.19348 13.2593     18.8607  32.3198     18.7691  15.2418    206.176     5.69622     26.1755     
1 1 1 40 7  36 o 6  22.7097 7.2424  10.4433     17.558   3.29599     17.4587  9.41048    139.665     2.34586     319.665     
1 1 1 40 7  37 o 9  20.0468 6.72742 1.927       18.5925  -11.3158    17.9858  5.42132    95.9501     5.57302     275.95      
1 1 1 40 7  38 o 10 25.3692 8.1273  12.3714     18.5496  20.0016     26.0237  11.4718    177.731     1.07765     357.731     
1 1 1 40 7  39 o 15 31.8017 9.19913 34.5201     19.8725  42.1115     27.699   19.4137    219.788     6.93024     219.788     
1 1 1 40 7  40 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 7  41 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 8  0  o 8  52.5484 6.17782 56.8809     14.9183  56.8809     14.9183  63.2984    180         45.9898     180         
1 1 1 40 8  1  o 3  68.9664 4.98193 82.4262     16.6877  109.684     16.9169  60.5644    110.984     17.6318     110.984     
1 1 1 40 8  2  o 6  40.5366 6.93192 32.7702     14.2496  42.226      13.7763  31.1142    217.195     4.77075     217.195     
1 1 1 40 8  3  o 12 40.3246 6.72141 29.351      14.2676  44.0898     12.8811  35.0596    258.702     14.3417     258.702     
1 1 1 40 8  4  o 7  68.2952 4.64483 98.7544     16.0911  86.3872     15.2967  59.4449    180.023     16.433      180.023     
1 1 1 40 8  5  o 11 32.6082 7.39042 32.3687     13.8142  17.3866     14.8548  19.6699    141.165     5.31437     321.165     
1 1 1 40 8  6  o 10 35.3859 7.41184 31.3329     14.0233  28.2428     14.175   29.0319    144.894     12.1023     144.894     
1 1 1 40 8  7  o 2  27.5166 6.99382 25.86       13.2891  4.60831     13.6549  14.9838    186.876     5.4553      6.87645     
1 1 1 40 8  8  o 14 19.1552 6.16744 -12.7063    14.3949  3.56379     12.7496  2.83835    216.754     16.3379     36.754      
1 1 1 40 8  9  o 8  20.5996 6.42844 2.41032     12.8967  1.79266     13.0745  6.04999    137.492     10.8487     317.492     
1 1 1 40 8  10 o 11 25.5041 7.19752 15.7861     14.184   9.53445     13.7049  11.2015    242.245     9.86384     62.2452     
1 1 1 40 8  11 o 2  31.9988 7.6918  17.6563     16.494   30.7647     14.3987  21.8611    208.086     1.85975     208.086     
1 1 1 40 8  12 o 13 23.7844 6.87603 16.0979     13.8151  1.45172     13.0599  10.7286    335.267     6.98141     155.267     
1 1 1 40 8  13 o 17 29.6161 7.09787 31.3648     13.8552  6.16652     14.2588  20.8965    179.304     5.52594     179.304     
1 1 1 40 8  14 o 15 56.984  6.67002 82.7783     16.2315  60.4321     19.3338  51.0758    52.1092     18.6228     52.1092     
1 1 1 40 8  15 o 3  26.2757 7.47201 17.9942     15.8711  9.7233      14.3869  13.6212    354.454     6.0986      174.454     
1 1 1 40 8  16 f 0  42.513  7.26488 47.9073     15.7718  36.5593     14.9659  25.0529    283.187     0           0           
1 1 1 40 8  17 o 16 42.7014 7.18187 39.9745     14.9946  44.3876     15.3106  42.7614    170.884     31.0177     170.884     
1 1 1 40 8  18 o 16 31.303  7.54833 17.5556     14.2258  29.0071     14.6977  16.2246    0.722749    10.9061     180.723     
1 1 1 40 8  19 o 3  19.8614 6.52147 -17.9839    19.1877  1.04404     13.6411  7.63888    38.0418     0.689481    218.042     
1 1 1 40 8  20 o 11 18.8174 6.25492 -1.61919    16.2455  -13.8031    13.6404  6.90528    304.565     5.2606      124.564     
1 1 1 40 8  21 o 12 39.048  8.77034 42.5185     20.0388  38.5364     18.531   30.5127    172.302     6.74752     172.302     
1 1 1 40 8  22 o 11 37.9958 9.03719 52.8442     21.2558  26.2488     21.9469  34.2804    163.639     20.0445     163.639     
1 1 1 40 8  23 o 13 28.2367 7.67591 -8.46261    18.0367  34.6912     17.9774  19.749     191.323     10.7595     191.323     
1 1 1 40 8  24 o 14 40.0958 8.98382 46.1317     21.3573  42.7836     19.1643  34.2197    298.788     13.7904     298.788     
1 1 1 40 8  25 o 4  22.3109 7.15524 5.06803     17.9887  -1.09663    16.6152  10.8787    217.025     2.78113     217.025     
1 1 1 40 8  26 o 13 25.4638 7.68471 10.5742     17.4714  13.6008     17.2106  15.8287    316.18      2.12228     316.18      
1 1 1 40 8  27 o 1  25.5993 7.75152 22.2513     18.8295  0.242976    17.8161  15.5329    154.804     0.55871     154.804     
1 1 1 40 8  28 o 12 25.2782 7.69684 18.4859     17.757   4.06359     18.395   13.3152    183.629     5.05046     3.62948     
1 1 1 40 8  29 o 11 19.2743 6.56555 -9.95878    16.1933  -14.2072    21.3394  6.27284    245.08      8.11273     65.0802     
1 1 1 40 8  30 o 9  28.7324 8.3293  24.9693     19.4845  20.2993     18.8344  17.7865    110.3       0.0975957   290.3       
1 1 1 40 8  31 o 3  30.3516 8.33807 35.3943     18.4532  17.1632     19.598   17.7254    12.9578     3.7842      192.958     
1 1 1 40 8  32 o 13 23.6176 7.48383 12.505      17.8816  5.42279     18.9842  9.26838    292.622     9.36347     112.622     
1 1 1 40 8  33 f 0  28.0917 8.25565 26.4697     19.0203  19.8523     19.527   17.2693    53.8437     0           0           
1 1 1 40 8  34 o 14 21.963  7.19513 -13.2016    21.339   13.0592     18.3911  3.89849    41.2337     0.228791    41.2338     
1 1 1 40 8  35 o 18 27.0132 8.15245 2.92532     22.2364  33.9931     20.1658  13.4723    3.08886     3.25863     3.08886     
1 1 1 40 8  36 o 7  27.9918 8.59297 34.7713     24.865   18.2458     19.6546  7.82203    159.273     3.43722     159.273     
1 1 1 40 8  37 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 8  38 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 9  0  o 14 66.588  5.92404 89.0193     18.9205  89.0193     18.9205  70.6176    4.4337e-06  38.6152     4.4337e-06  
1 1 1 40 9  1  o 16 26.0504 7.05784 15.8307     10.8179  11.1476     16.0458  13.631     265.51      6.41812     85.51       
1 1 1 40 9  2  o 2  55.8713 6.21006 73.1506     14.1417  61.1065     18.3449  45.5457    325.774     7.96039     325.774     
1 1 1 40 9  3  o 8  48.6507 6.97625 62.4048     15.3367  45.3978     17.374   42.5534    27.6953     14.352      27.6953     
1 1 1 40 9  4  o 6  43.8307 7.34184 46.6761     15.197   43.3341     16.6093  40.0825    317.465     18.3069     317.465     
1 1 1 40 9  5  o 9  19.1969 6.21176 3.1298      13.1051  -13.257     14.8172  5.32661    308.818     0.805154    128.818     
1 1 1 40 9  6  o 5  20.1064 6.52246 -0.322906   14.8211  -5.23826    15.1137  7.81726    257.302     4.79804     77.3023     
1 1 1 40 9  7  o 5  18.5486 6.04172 -19.6258    12.4295  5.96539     14.3772  5.51918    305.503     8.41568     125.503     
1 1 1 40 9  8  f 0  21.6827 6.75633 2.87307     13.3032  3.98581     15.2494  13.6802    349.646     0           0           
1 1 1 40 9  9  o 12 40.102  7.82949 36.2357     15.3666  42.574      17.1497  31.0956    3.55859     5.22408     3.5586      
1 1 1 40 9  10 o 4  37.8366 8.10635 26.7127     18.2054  45.2232     16.7851  24.4113    110.124     5.20191     290.124     
1 1 1 40 9  11 o 14 24.7373 7.28812 3.7048      14.1366  16.8076     16.1697  15.1116    126.884     3.77189     126.884     
1 1 1 40 9  12 o 19 24.4181 7.1607  7.58354     14.1499  12.6882     14.6675  13.9637    40.3821     1.93228     220.382     
1 1 1 40 9  13 o 13 21.5728 6.56056 13.9812     13.7817  -13.6689    14.5364  9.36157    247.778     2.83602     247.778     
1 1 1 40 9  14 o 3  49.0374 7.9217  60.3921     19.2693  55.9753     18.8191  50.296     212.068     31.3794     212.068     
1 1 1 40 9  15 o 9  18.9617 6.34047 -10.2832    17.3359  -7.73445    14.4662  6.98579    214.87      0.350939    34.87       
1 1 1 40 9  16 o 17 34.5444 8.36829 38.4336     19.187   24.4538     15.8398  21.6141    99.5832     5.31191     279.583     
1 1 1 40 9  17 o 6  25.5621 7.79172 21.5241     19.98    -1.1668     16.9868  16.526     170.777     3.92346     170.777     
1 1 1 40 9  18 o 16 29.5942 8.48864 28.0837     20.7062  15.0394     18.8003  19.728     177.614     0.750765    177.614     
1 1 1 40 9  19 o 16 42.7956 9.07451 52.9006     22.125   48.9914     19.9012  40.8984    115.396     24.0098     115.396     
1 1 1 40 9  20 o 10 22.9367 7.34061 -7.38367    19.9112  9.88035     17.5183  11.2262    215.404     5.55657     35.4038     
1 1 1 40 9  21 f 0  26.9375 8.10581 18.4689     20.1561  12.928      18.1491  17.4746    296.236     0           0           
1 1 1 40 9  22 o 2  48.0136 9.88095 64.3858     24.5259  75.1974     25.9528  46.5147    82.1466     26.8254     82.1466     
1 1 1 40 9  23 o 19 27.8856 8.30688 24.4574     20.9945  13.6429     18.6323  18.5951    79.111      9.31376     79.111      
1 1 1 40 9  24 o 12 41.5581 9.28306 49.8537     23.3385  54.5124     20.4998  30.7652    6.79844     3.08728     6.79844     
1 1 1 40 9  25 o 17 26.127  7.95366 25.7943     20.1728  2.48773     18.5665  12.8064    302.016     8.00141     122.016     
1 1 1 40 9  26 o 14 22.5362 7.25314 -3.01702    19.6323  9.67947     17.1789  9.65993    197.29      2.07316     197.29      
1 1 1 40 9  27 f 0  23.9059 7.59688 17.7706     20.4443  0.747202    17.6129  5.91338    194.308     0           0           
1 1 1 40 9  28 o 15 23.0535 7.4883  7.81768     21.1156  4.98353     18.3473  9.66885    12.8909     6.95561     192.891     
1 1 1 40 9  29 o 1  26.9833 8.12218 34.6232     21.0685  3.13702     19.2949  10.6686    338.128     5.14933     338.128     
1 1 1 40 9  30 o 10 27.9311 8.48307 26.705      21.8393  22.0542     20.8564  16.3096    311.309     3.31487     311.309     
1 1 1 40 9  31 o 14 24.9434 7.86126 23.0478     20.8966  6.66177     19.143   11.6679    308.999     0.210383    308.999     
1 1 1 40 9  32 o 16 21.2785 7.11587 -4.49139    21.5809  3.85886     18.9467  4.49461    65.0135     1.0256      245.013     
1 1 1 40 9  33 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 9  34 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 9  35 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 10 0  o 4  27.2023 10.3825 26.2076     19.6838  26.2076     19.6838  12.3176    1.1196e-05  17.1768     180         
1 1 1 40 10 1  o 1  23.4565 7.48343 7.68705     20.1449  0.112599    16.9769  11.6778    169.192     6.39995     349.192     
1 1 1 40 10 2  o 7  32.3502 7.66971 10.5111     19.3247  36.3887     14.7193  17.7023    101.572     10.6774     281.572     
1 1 1 40 10 3  o 12 26.3512 7.49051 10.3859     17.9609  16.9196     13.3495  18.4481    111.214     6.96766     111.214     
1 1 1 40 10 4  o 19 26.1667 7.45441 14.5219     17.6876  13.7813     12.6552  17.0497    73.6954     8.63165     73.6954     
1 1 1 40 10 5  o 9  28.657  7.98705 2.53807     18.7256  31.0437     18.083   20.9535    76.8387     5.7251      76.8387     
1 1 1 40 10 6  o 3  20.3359 6.60662 -1.60923    14.6664  -2.77172    16.1222  6.40704    277.982     1.81861     277.982     
1 1 1 40 10 7  o 19 30.9594 8.15742 23.4337     15.4604  25.2974     18.5466  24.9544    258.719     11.4969     258.719     
1 1 1 40 10 8  o 9  25.837  7.7663  24.25       19.4745  -2.35075    16.9761  16.2559    77.2404     0.20889     77.2403     
1 1 1 40 10 9  o 14 29.1745 8.02598 8.25241     17.0546  31.5315     18.2953  21.4895    120.151     5.80739     120.151     
1 1 1 40 10 10 o 13 40.018  8.98796 39.7454     21.6621  49.9563     19.6519  30.9542    324.685     5.04311     324.685     
1 1 1 40 10 11 o 16 27.1598 8.15246 19.8939     19.6971  11.1433     19.0933  13.4363    141.632     8.1782      141.632     
1 1 1 40 10 12 o 10 30.909  8.69573 29.0854     20.7436  22.5604     19.667   18.9349    259.153     4.39754     79.1531     
1 1 1 40 10 13 o 18 27.0056 9.21965 0.606914    29.1982  5.56918     46.1798  17.4274    350.852     5.0879      350.852     
1 1 1 40 10 14 o 7  22.6297 7.34389 10.2948     19.1787  -11.4933    19.7869  9.55838    105.863     3.74353     105.863     
1 1 1 40 10 15 o 5  26.0628 8.14973 13.9179     20.2463  10.7822     21.8125  15.4034    120.12      7.44859     120.12      
1 1 1 40 10 16 o 12 24.3677 7.80133 8.44858     19.4969  5.29065     21.5822  14.6501    188.391     1.81593     188.391     
1 1 1 40 10 17 o 11 32.9384 9.29464 34.444      22.3126  33.6075     24.0441  24.1599    343.813     4.62396     343.813     
1 1 1 40 10 18 o 9  21.3237 7.12265 0.975617    19.4196  -12.0501    21.0324  10.4443    252.321     0.671672    72.3212     
1 1 1 40 10 19 o 14 20.0419 6.75429 3.07768     18.8155  -27.3661    20.0978  8.11663    356.398     5.45811     176.398     
1 1 1 40 10 20 o 16 23.4302 7.57023 15.7214     20.3052  -8.39504    20.5473  2.1059     230.503     0.990789    230.503     
1 1 1 40 10 21 o 10 27.3838 8.51591 14.85       22.2401  24.2426     23.069   17.4877    303.768     5.60798     303.768     
1 1 1 40 10 22 o 14 27.5698 8.55705 13.4148     22.2225  28.4578     23.491   17.1045    190.775     1.79418     190.775     
1 1 1 40 10 23 o 17 24.8788 8.01322 13.4213     21.1705  10.5502     22.9675  13.3341    123.662     1.58449     123.662     
1 1 1 40 10 24 o 1  22.4444 7.33141 -0.49623    20.8002  8.79372     18.3667  9.86163    155.559     1.86245     335.559     
1 1 1 40 10 25 o 12 26.6884 8.23732 15.4042     22.4305  24.0798     19.8835  7.68833    87.8049     3.79241     87.8049     
1 1 1 40 10 26 o 7  21.5458 7.11261 -9.94686    20.6405  10.2861     18.4837  7.10836    294.946     1.08712     114.946     
1 1 1 40 10 27 o 2  26.2554 8.47964 25.4849     22.5025  10.848      29.8174  12.442     227.986     2.92492     227.986     
1 1 1 40 10 28 o 13 27.9723 8.5168  26.3796     23.4622  26.1603     20.0732  15.6886    157.678     2.30884     157.679     
1 1 1 40 10 29 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 10 30 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 10 31 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 11 0  o 13 30.7296 11.1532 35.3843     21.8361  35.3843     21.8361  29.3877    180         16.866      180         
1 1 1 40 11 1  o 4  24.5388 7.63578 15.1574     18.4368  3.4015      18.3558  10.5322    285.113     5.55606     285.113     
1 1 1 40 11 2  o 9  18.2518 6.23149 -21.5271    16.6244  -7.23251    17.676   3.46589    190.091     15.6937     10.0913     
1 1 1 40 11 3  o 10 27.5425 8.15615 10.2251     19.6977  24.9068     19.0209  19.6536    235.137     8.06671     235.137     
1 1 1 40 11 4  o 16 22.9523 7.31475 10.1785     17.76    -1.31631    18.1767  11.4231    277.91      5.91331     97.9103     
1 1 1 40 11 5  o 2  23.6515 7.65523 -28.4433    27.7151  15.9414     19.1242  12.7461    352.843     3.69766     172.843     
1 1 1 40 11 6  o 8  26.1714 8.36894 11.8252     28.4607  12.7624     19.3496  17.2281    192.229     5.07745     192.229     
1 1 1 40 11 7  f 0  19.9658 6.92307 -6.90742    29.6499  -9.22311    12.1056  11.3419    342.055     0           0           
1 1 1 40 11 8  o 10 45.348  12.6972 171.503     63.8112  76.8679     30.2245  27.8436    227.66      9.76633     47.6599     
1 1 1 40 11 9  o 12 30.8847 9.62837 47.9355     31.8284  16.1759     26.2847  21.1998    238.594     2.06367     238.594     
1 1 1 40 11 10 o 14 33.3531 10.0642 58.4669     32.9505  27.0058     26.3089  23.0987    99.1354     1.40128     99.1354     
1 1 1 40 11 11 o 8  25.6573 8.47194 8.29155     29.0327  10.2569     24.968   4.75279    206.97      2.67503     206.97      
1 1 1 40 11 12 o 3  29.9339 9.52957 32.2059     31.9656  27.7059     28.1898  20.7962    107.119     9.80314     107.119     
1 1 1 40 11 13 o 16 26.0292 9.14797 -17.4705    18.7606  71.2225     50.3098  10.6995    77.5537     4.9647      77.5537     
1 1 1 40 11 14 o 16 19.2568 6.60668 -15.7812    18.2406  -9.94289    21.2307  6.69736    15.6814     6.47628     195.681     
1 1 1 40 11 15 o 12 26.7759 8.34338 5.12456     21.1752  30.556      23.2035  15.812     283.278     6.46251     283.278     
1 1 1 40 11 16 o 18 23.6154 7.76215 -0.740893   20.6276  14.1851     23.5279  10.6821    35.2721     7.08958     215.272     
1 1 1 40 11 17 o 15 26.9816 8.50977 4.62902     21.6641  35.7285     25.503   16.4393    173.846     3.39277     173.846     
1 1 1 40 11 18 o 8  19.4135 6.69369 -16.3698    19.962   -10.136     22.1108  2.31962    50.4277     0.281367    230.428     
1 1 1 40 11 19 o 18 22.2865 7.47138 -9.28339    21.129   11.7308     23.4833  9.35473    188.255     1.28113     8.25517     
1 1 1 40 11 20 o 16 25.1168 8.08511 -11.858     21.1526  36.3422     24.9796  12.9101    80.2498     1.20898     80.2498     
1 1 1 40 11 21 o 14 24.7202 7.92089 30.8601     22.1218  -16.8008    24.7577  11.9407    105.397     1.07761     105.397     
1 1 1 40 11 22 o 15 33.0771 9.94444 42.8122     30.6474  58.5456     28.3515  22.7106    2.58511     5.68872     2.58511     
1 1 1 40 11 23 o 9  19.8635 6.79663 -26.4686    20.5796  6.01294     21.2209  4.85318    148.1       3.58725     328.1       
1 1 1 40 11 24 o 1  27.4962 8.45152 41.8377     22.9458  2.10977     24.3665  10.4895    213.993     4.34148     213.993     
1 1 1 40 11 25 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 11 26 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 11 27 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 12 0  o 2  22.7099 10.8912 18.4927     37.0862  18.4927     37.0862  8.61192    360         2.59162     360         
1 1 1 40 12 1  f 0  21.4984 7.48031 -17.7767    30.0521  -13.405     26.6707  14.7105    299.639     0           0           
1 1 1 40 12 2  o 6  24.3559 8.16643 21.8019     32.73    0.692269    19.0026  13.0841    99.6391     0.838425    279.639     
1 1 1 40 12 3  o 10 24.2438 8.03213 -8.40181    36.2467  13.3143     18.9877  12.585     34.2468     3.06881     214.247     
1 1 1 40 12 4  o 13 25.5735 8.51885 16.8172     33.1851  11.0377     23.6284  9.78835    160.59      4.38277     160.59      
1 1 1 40 12 5  o 17 31.8351 9.96391 68.4022     36.2712  25.2136     25.7305  13.0151    332.362     8.53373     332.362     
1 1 1 40 12 6  o 7  25.1826 8.47623 17.9773     33.6917  6.40736     24.7223  13.9052    71.4815     1.21024     71.4815     
1 1 1 40 12 7  o 3  26.8717 9.49012 317.796     293.394  12.9105     25.7283  15.3646    150.553     0.764623    150.554     
1 1 1 40 12 8  o 2  37.8057 10.7701 61.1549     39.1259  79.1015     30.0282  19.8077    28.9312     14.0004     208.931     
1 1 1 40 12 9  o 18 26.4342 8.67429 -4.38163    33.023   32.5206     26.4153  8.37776    332.732     4.06618     332.732     
1 1 1 40 12 10 o 10 33.155  10.1478 53.3624     36.242   52.1454     27.8939  23.9468    214.616     7.00301     214.616     
1 1 1 40 12 11 o 9  29.4958 9.46616 17.7225     37.0655  48.4055     28.9244  17.2435    45.9662     2.86196     225.966     
1 1 1 40 12 12 o 5  19.6764 6.81538 -37.3452    33.616   -3.72944    16.0493  4.58791    225.409     1.36        45.4092     
1 1 1 40 12 13 o 16 27.1272 8.94105 24.1204     36.8284  25.884      25.2214  5.96839    184.933     2.94648     184.933     
1 1 1 40 12 14 o 19 29.4778 9.3849  29.071      37.5813  42.4738     26.005   18.3896    294.136     2.588       294.136     
1 1 1 40 12 15 o 9  26.6216 8.71628 2.09031     36.3595  33.5306     25.1575  14.2084    61.1997     1.73173     241.2       
1 1 1 40 12 16 o 3  26.7429 8.88252 37.185      33.7052  15.7894     26.3517  13.8533    212.589     2.51447     212.589     
1 1 1 40 12 17 o 6  25.9365 8.34525 18.4676     22.3341  23.2984     25.2234  6.39859    291.982     2.48183     291.982     
1 1 1 40 12 18 o 9  20.6424 7.00236 -15.739     20.3671  8.25212     21.5422  3.52494    177.074     0.949724    357.074     
1 1 1 40 12 19 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 12 20 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 12 21 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 12 22 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 13 0  x 12 ?       ?       ?           ?        ?           ?        20.4846    1.07088e-05 0           0           
1 1 1 40 13 1  x 1  ?       ?       ?           ?        ?           ?        4.02763    26.5292     0           0           
1 1 1 40 13 2  o 18 24.1249 11.9206 4.98891     37.2441  0           0        6.36306    286.458     2.88804     106.458     
1 1 1 40 13 3  o 5  29.0042 13.7632 46.2739     38.1214  0           0        12.398     160.895     2.34146     340.895     
1 1 1 40 13 4  o 6  31.8587 14.8226 68.7249     40.5631  0           0        15.3984    129.16      0.0283105   129.16      
1 1 1 40 13 5  o 1  25.1505 12.2596 15.9748     35.3934  0           0        4.25081    107.785     0.467836    287.785     
1 1 1 40 13 6  o 7  24.0262 8.83648 92.4348     294.532  -64.4268    53.8102  10.0522    320.05      3.27612     140.05      
1 1 1 40 13 7  o 11 23.0523 8.19573 -1.18167    32.3642  -49.9577    63.7386  8.65956    167.324     1.6818      347.324     
1 1 1 40 13 8  o 10 27.1048 9.47667 30.5136     37.0337  54.0724     65.1362  10.79      265.388     3.42581     265.388     
1 1 1 40 13 9  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 13 10 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 13 11 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 13 12 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 13 13 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 13 14 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 40 13 15 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 0  0  o 14 29.7248 8.96924 23.0624     13.6061  23.0624     13.6061  0.438799   360         0.00992721  180         
1 1 1 41 0  1  o 12 18.607  7.07623 9.44934     9.11241  9.44934     9.11241  3.41163    240         4.44886     60          
1 1 1 41 0  2  o 13 22.8541 7.47902 14.2929     9.4522   14.2929     9.4522   6.89754    300         18.5487     120         
1 1 1 41 0  3  o 10 44.1273 5.84371 39.1109     11.5962  39.1109     11.5962  10.1453    1.7574e-06  46.8606     180         
1 1 1 41 0  4  o 17 83.9466 3.20901 127.553     13.4093  127.553     13.4093  76.0249    240         24.3277     240         
1 1 1 41 0  5  o 3  38.935  5.82797 31.0925     10.0026  31.0925     10.0026  24.8203    300         9.5484      120         
1 1 1 41 0  6  o 5  15.0017 6.62127 3.22809     10.1585  3.22809     10.1585  0.0413606  180         1.68589     8.30975e-06 
1 1 1 41 0  7  o 1  42.8253 5.79178 36.9575     11.113   36.9575     11.113   23.4762    240         18.1436     60          
1 1 1 41 0  8  o 2  77.5826 3.3804  109.402     13.0274  109.402     13.0274  68.8471    300         19.8111     300         
1 1 1 41 0  9  o 18 61.4008 3.86954 69.63       11.679   69.63       11.679   64.8019    360         36.3536     360         
1 1 1 41 0  10 o 3  53.1631 4.40134 53.2883     11.306   53.2883     11.306   53.1733    60          25.6571     60          
1 1 1 41 0  11 f 0  40.6122 5.74314 33.5041     10.3718  33.5041     10.3718  26.4988    300         0           0           
1 1 1 41 0  12 o 5  94.6963 3.46474 162.706     16.3413  162.706     16.3413  71.8905    3.50247e-07 0.212418    3.50255e-07 
1 1 1 41 0  13 o 6  40.8996 6.35352 34.8438     11.3974  34.8438     11.3974  18.8851    240         24.1937     60          
1 1 1 41 0  14 o 14 16.2279 6.90718 5.58881     10.1759  5.58881     10.1759  2.26949    120         8.10267     300         
1 1 1 41 0  15 o 8  65.4303 4.12473 79.4321     13.2661  79.4321     13.2661  53.474     180         7.97128     180         
1 1 1 41 0  16 o 7  40.8015 6.4405  34.9157     11.503   34.9157     11.503   29.6749    60          2.30838     240         
1 1 1 41 0  17 o 13 20.4046 7.61236 11.7879     10.3731  11.7879     10.3731  9.50422    120         1.90875     300         
1 1 1 41 0  18 o 8  58.6023 4.09105 64.1096     11.7265  64.1096     11.7265  72.5283    4.58603e-09 56.7526     4.58603e-09 
1 1 1 41 0  19 o 4  17.2184 7.00922 7.59369     9.69641  7.59369     9.69641  0.990445   240         0.528196    60.0001     
1 1 1 41 0  20 o 16 28.5197 7.63544 20.6974     10.2371  20.6974     10.2371  11.8565    300         8.23565     300         
1 1 1 41 0  21 o 15 11.8257 5.61485 -2.81881    9.39314  -2.81881    9.39314  10.4792    180         35.7456     180         
1 1 1 41 0  22 o 2  61.186  4.8869  71.4065     14.4928  71.4065     14.4928  68.6089    240         45.323      240         
1 1 1 41 0  23 o 8  17.6528 7.19028 8.17863     10.2128  8.17863     10.2128  4.94267    300         11.509      120         
1 1 1 41 0  24 o 6  122.727 3.01857 272.297     18.5144  272.297     18.5144  115.483    180         47.1076     180         
1 1 1 41 0  25 o 9  9.55133 4.77553 -10.539     9.32483  -10.539     9.32483  3.45804    240         11.5261     240         
1 1 1 41 0  26 o 6  12.5629 5.88879 -1.33038    9.77274  -1.33038    9.77274  0.00604593 300.003     0.280822    300.003     
1 1 1 41 0  27 o 10 54.4186 4.70396 56.9283     12.3166  56.9283     12.3166  28.7411    3.98346e-06 23.6983     180         
1 1 1 41 0  28 o 2  18.1378 7.30126 9.08024     10.353   9.08024     10.353   5.70494    60          37.8331     60          
1 1 1 41 0  29 f 0  18.1855 7.5345  8.79674     11.5217  8.79674     11.5217  34.8838    120         0           0           
1 1 1 41 0  30 o 15 81.5398 4.00308 123.519     16.1735  123.519     16.1735  70.2951    180         19.5242     180         
1 1 1 41 0  31 o 4  12.5764 6.01946 -3.74361    11.2173  -3.74361    11.2173  0.979342   60          9.12466     60          
1 1 1 41 0  32 o 18 10.8564 5.36598 -9.03537    10.7786  -9.03537    10.7786  4.56304    120         16.8739     120         
1 1 1 41 0  33 o 6  24.9735 8.46798 18.6327     12.2079  18.6327     12.2079  9.74984    1.08815e-05 4.7836      1.08815e-05 
1 1 1 41 0  34 o 8  16.6242 7.22504 6.03007     11.6476  6.03007     11.6476  2.7961     60          7.7611      240         
1 1 1 41 0  35 o 1  18.3933 7.66316 9.18815     12.0329  9.18815     12.0329  3.81768    300         13.8603     120         
1 1 1 41 0  36 o 8  15.5054 7.01072 3.15353     12.1892  3.15353     12.1892  0.539842   180         2.87316     360         
1 1 1 41 0  37 o 2  23.0769 8.83741 16.8025     14.307   16.8025     14.307   9.08363    240         13.206      60          
1 1 1 41 0  38 o 13 69.9361 4.69457 93.3988     16.092   93.3988     16.092   63.9513    120         25.6145     120         
1 1 1 41 0  39 o 1  20.9923 8.20174 13.4113     12.5846  13.4113     12.5846  6.49423    180         15.724      8.72156e-06 
1 1 1 41 0  40 o 11 13.6732 6.46465 -1.90126    12.2164  -1.90126    12.2164  0.633164   240         4.83367     60          
1 1 1 41 0  41 o 7  50.8574 7.21976 55.6069     16.3175  55.6069     16.3175  52.5409    300         31.196      300         
1 1 1 41 0  42 o 4  14.2053 6.81681 -4.0834     14.5747  -4.0834     14.5747  1.21517    360         3.68506     180         
1 1 1 41 0  43 o 14 33.3766 10.1233 33.772      17.3201  33.772      17.3201  30.795     60          20.8639     60          
1 1 1 41 0  44 o 5  31.2541 10.1717 31.2647     17.4715  31.2647     17.4715  27.2822    120         16.8074     120         
1 1 1 41 0  45 o 3  22.5213 9.26809 16.9818     17.2412  16.9818     17.2412  13.1138    2.26319e-06 0.989372    2.26319e-06 
1 1 1 41 0  46 o 16 18.7347 8.68721 5.92135     20.3858  5.92135     20.3858  4.60171    240         1.6182      60          
1 1 1 41 0  47 o 9  42.6208 11.4701 56.3412     23.0466  56.3412     23.0466  43.5363    120         28.7057     120         
1 1 1 41 0  48 o 16 17.8889 8.51546 2.4122      21.8636  2.4122      21.8636  1.8771     8.68881e-06 2.31806     180         
1 1 1 41 0  49 o 12 57.5205 9.85995 84.0009     24.632   84.0009     24.632   64.1437    60          46.8926     60          
1 1 1 41 0  50 o 18 29.3086 11.1953 35.7521     22.9037  35.7521     22.9037  18.6653    120         1.35417     120         
1 1 1 41 0  51 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 0  52 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 1  0  o 1  23.1115 7.56185 14.7242     9.66249  14.7242     9.66249  13.5186    1.92242e-05 1.27884     180         
1 1 1 41 1  1  o 12 18.1392 5.50733 -1.20131    9.13966  2.48599     8.95097  3.87312    72.1136     5.60648     252.114     
1 1 1 41 1  2  f 0  26.7084 6.28922 11.8664     10.3297  15.519      9.54672  17.0995    64.5272     0           0           
1 1 1 41 1  3  o 19 20.1738 5.78844 2.22031     9.19779  6.31736     9.19769  0.39776    333.215     26.3921     333.215     
1 1 1 41 1  4  o 9  50.6412 4.55709 49.4231     11.2214  48.0083     11.379   40.0473    69.3222     6.31344     69.3222     
1 1 1 41 1  5  o 14 25.3463 6.05147 17.4824     9.5357   5.54141     9.76137  9.95239    203.818     4.58588     203.818     
1 1 1 41 1  6  o 6  25.3721 6.2917  6.61707     10.4356  16.2566     10.0692  5.85641    66.5316     22.3304     246.532     
1 1 1 41 1  7  o 15 85.524  3.48384 127.063     15.0096  142.223     14.6624  65.0301    77.5493     1.5021      77.5492     
1 1 1 41 1  8  o 18 60.9776 3.97292 65.3309     11.7068  73.6388     12.2953  43.6965    128.209     3.15113     308.209     
1 1 1 41 1  9  o 14 35.6216 5.97191 25.1861     10.6689  26.2155     10.3308  26.0651    46.3269     3.21388     46.3269     
1 1 1 41 1  10 o 19 31.4873 6.08489 14.9945     10.0991  25.3683     10.0943  7.35834    129.892     30.0303     309.892     
1 1 1 41 1  11 o 10 31.646  5.78535 31.1481     10.0937  9.21625     10.0745  21.2229    179.116     0.167829    359.116     
1 1 1 41 1  12 o 17 58.2981 4.14037 66.8216     11.7943  61.143      12.0316  57.9649    222.643     31.1966     222.643     
1 1 1 41 1  13 o 3  59.9796 4.03861 79.4693     11.8101  56.4667     11.83    24.4049    65.1613     40.6802     245.161     
1 1 1 41 1  14 o 9  46.8893 4.92252 46.7942     11.1796  38.7008     11.1595  33.5488    277.187     0.989202    97.1871     
1 1 1 41 1  15 o 7  90.8506 3.28899 153.423     15.3896  150.148     14.4521  80.6223    33.1899     25.3039     33.1899     
1 1 1 41 1  16 o 6  53.3522 4.78532 61.614      12.3766  48.6096     12.4338  34.8604    81.9197     8.73276     261.92      
1 1 1 41 1  17 o 5  55.3684 4.6672  56.81       12.4962  61.2648     12.8918  33.5897    218.256     14.5039     38.2564     
1 1 1 41 1  18 o 4  45.2836 5.71408 50.0769     12.071   33.2168     12.5888  27.1903    232.046     11.3196     52.046      
1 1 1 41 1  19 o 11 60.057  4.64672 72.4015     13.0201  66.6405     14.3383  44.2712    222.578     0.0767258   222.58      
1 1 1 41 1  20 o 5  23.476  6.30909 1.80376     10.732   15.1015     10.878   3.31091    272.068     24.8108     92.0677     
1 1 1 41 1  21 o 17 25.6253 6.63959 15.1969     11.1711  9.6221      11.3537  5.79212    283.198     23.1486     103.198     
1 1 1 41 1  22 o 13 42.0123 5.9296  47.0221     12.0137  26.7856     12.0455  27.5968    25.9778     4.82915     205.978     
1 1 1 41 1  23 o 5  17.1759 5.42945 -14.3841    9.49571  5.1961      10.7541  2.18836    81.2574     14.4167     261.257     
1 1 1 41 1  24 o 15 73.1948 3.91732 95.9362     14.835   106.875     13.5197  58.6721    16.2296     9.36988     16.2296     
1 1 1 41 1  25 o 14 34.4308 6.22163 28.4901     10.8224  22.1279     10.841   6.57755    207.468     35.9319     27.4677     
1 1 1 41 1  26 o 14 30.3109 6.46277 22.8876     10.6942  16.7041     10.7788  18.8642    79.4959     12.6212     79.4959     
1 1 1 41 1  27 o 12 50.395  5.4174  58.0973     13.0749  45.161      13.2019  39.4541    243.483     6.72426     243.483     
1 1 1 41 1  28 o 11 29.5574 6.64744 28.0169     12.0002  8.64083     12.0727  16.2162    222.247     6.55493     42.2465     
1 1 1 41 1  29 o 11 48.6042 6.41682 34.7564     14.6068  68.4044     15.1885  41.5457    56.7034     14.9022     56.7034     
1 1 1 41 1  30 o 9  46.9476 5.93025 45.972      13.2628  46.2492     13.6161  41.2905    317.439     17.4541     317.439     
1 1 1 41 1  31 o 16 30.2089 7.1172  19.2173     12.6683  21.7315     12.6091  17.5248    234.33      3.69737     54.3302     
1 1 1 41 1  32 o 16 19.8794 6.14368 -0.139973   11.4991  3.6164      11.7553  2.66378    17.5774     17.5506     197.577     
1 1 1 41 1  33 o 10 28.2904 7.00482 14.1873     12.3607  20.8037     12.4054  13.1581    357.738     9.61849     177.738     
1 1 1 41 1  34 f 0  21.3025 6.35798 -3.61582    12.0038  11.0881     12.2604  7.36059    141.036     0           0           
1 1 1 41 1  35 o 19 27.8915 7.10091 18.5905     12.8476  15.4054     12.5374  9.50117    125.903     17.33       305.903     
1 1 1 41 1  36 o 8  21.7604 6.54899 -2.96024    12.376   11.3141     13.3774  7.39995    204.69      9.7204      24.6897     
1 1 1 41 1  37 o 12 34.4868 7.72913 18.4015     14.2147  38.988      16.6736  16.971     333.348     12.733      153.348     
1 1 1 41 1  38 o 15 31.2264 8.0899  16.5098     18.8172  28.0528     15.6787  17.2539    238.766     6.29494     58.7655     
1 1 1 41 1  39 o 15 29.954  7.85502 23.3206     15.745   18.1845     15.7428  20.8391    139.611     5.38428     139.611     
1 1 1 41 1  40 o 10 34.2523 7.87706 14.9275     17.0064  41.4979     16.7277  21.547     356.298     2.29637     176.298     
1 1 1 41 1  41 o 13 18.6192 6.20111 -7.86643    14.9155  -8.48896    14.9803  6.10664    273.783     3.8026      93.7825     
1 1 1 41 1  42 o 16 19.3215 6.36873 -11.0224    15.3874  -1.00047    15.062   5.26441    49.8651     0.113791    229.865     
1 1 1 41 1  43 o 8  45.9644 8.0426  52.3869     18.3861  54.1981     18.4655  42.2355    212.267     23.999      212.267     
1 1 1 41 1  44 o 12 37.5493 8.43753 41.5247     18.2284  36.0399     17.5076  30.1969    149.219     13.8703     149.219     
1 1 1 41 1  45 o 6  43.6169 8.4937  54.4679     19.7271  50.2758     18.5834  30.2098    190.031     2.05107     190.031     
1 1 1 41 1  46 o 16 19.8425 6.49453 -19.7679    15.9149  9.23382     16.1107  4.6352     323.992     9.71729     143.992     
1 1 1 41 1  47 o 6  21.5751 6.95998 3.0752      16.7698  3.96289     16.5999  4.39149    45.2401     0.706004    225.24      
1 1 1 41 1  48 o 18 18.3992 6.188   -29.5059    16.2837  5.2735      16.247   2.22067    250.432     8.99387     70.4321     
1 1 1 41 1  49 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 1  50 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 2  0  o 6  17.1032 7.05635 7.27547     10.0355  7.27547     10.0355  0.955822   180         21.2993     360         
1 1 1 41 2  1  o 18 29.4654 6.19957 13.0609     10.1694  22.189      9.9791   21.3249    140.426     5.56318     140.426     
1 1 1 41 2  2  o 9  87.1466 3.24787 130.571     14.1148  148.694     14.1027  61.7354    282.594     8.20561     102.594     
1 1 1 41 2  3  o 9  37.7868 5.61908 24.1312     10.3244  33.5042     10.3094  30.3738    263.061     8.07855     263.061     
1 1 1 41 2  4  o 15 25.8473 6.31344 9.96068     10.0693  15.5987     10.0419  14.9284    236.45      2.2683      56.4496     
1 1 1 41 2  5  o 8  26.2891 6.32614 11.1413     9.87802  15.8475     10.1867  10.7342    203.852     13.7729     23.8516     
1 1 1 41 2  6  o 1  27.3593 6.30873 10.3352     10.4209  19.1248     10.0271  18.2728    109.415     3.24296     109.415     
1 1 1 41 2  7  o 7  33.6327 6.05017 22.4839     10.295   24.0532     10.1551  28.0991    247.652     12.6051     247.652     
1 1 1 41 2  8  o 15 36.4468 6.09586 24.4836     10.7417  30.3107     11.2195  29.1027    277.057     8.09027     277.057     
1 1 1 41 2  9  o 9  67.3757 3.73609 88.7838     12.5175  80.7015     12.4861  52.8421    242.734     5.03429     242.734     
1 1 1 41 2  10 o 9  52.9954 4.39678 51.5019     11.5176  55.845      11.3622  48.5405    178.293     19.8266     178.293     
1 1 1 41 2  11 o 11 23.5559 6.06757 15.732      9.85879  1.99033     10.0815  6.66996    231.77      17.8075     51.7697     
1 1 1 41 2  12 o 4  40.8541 5.58988 42.8805     10.941   25.2953     11.0013  39.5562    194.527     31.1405     194.527     
1 1 1 41 2  13 o 1  29.4538 6.02152 27.7222     10.4368  7.09728     10.3499  13.9536    353.292     12.7442     173.292     
1 1 1 41 2  14 o 4  22.368  6.1692  12.8544     10.61    1.21416     10.1763  10.7761    104.778     4.23564     284.778     
1 1 1 41 2  15 o 11 118.477 3.11181 256.61      17.843   259.617     19.0295  99.2579    207.409     19.8613     207.409     
1 1 1 41 2  16 o 4  60.9307 4.25091 79.6313     13.146   62.6037     12.3933  50.6379    212.641     11.2466     212.641     
1 1 1 41 2  17 f 0  53.0374 4.52497 52.8276     11.7099  56.0256     11.8526  35.587     38.761      0           0           
1 1 1 41 2  18 o 7  19.8425 5.80226 -4.94643    9.74403  9.90316     10.2415  7.99006    131.442     2.45959     311.442     
1 1 1 41 2  19 o 19 76.3758 3.7541  103.201     14.6925  116.366     13.7266  64.5292    39.305      15.4402     39.305      
1 1 1 41 2  20 o 10 35.981  6.82956 30.4987     13.0189  26.3058     12.1426  31.5693    53.9501     16.9559     53.9501     
1 1 1 41 2  21 o 9  53.8278 5.0413  56.3992     13.2824  58.6814     13.2401  38.0849    21.387      2.61191     201.387     
1 1 1 41 2  22 o 12 23.2589 6.5828  14.3654     12.0337  0.13323     12.4432  12.2121    241.342     1.33063     241.342     
1 1 1 41 2  23 o 18 48.5818 6.13031 40.1623     13.8741  59.7736     14.7326  47.1249    336.174     26.3731     336.174     
1 1 1 41 2  24 o 3  21.104  6.47807 0.12769     12.9811  5.20796     12.596   6.36795    18.7411     12.3875     198.741     
1 1 1 41 2  25 o 18 26.9144 7.01659 15.3941     11.7582  14.5251     13.2724  12.0619    167.822     11.0048     347.822     
1 1 1 41 2  26 o 5  35.1444 7.08938 27.8143     12.4041  28.1539     13.8247  24.8038    58.1545     2.36219     58.1544     
1 1 1 41 2  27 o 17 55.3162 5.43437 63.7239     13.8546  60.9204     15.3304  47.3527    7.36979     15.2811     7.3698      
1 1 1 41 2  28 f 0  40.9109 6.43553 34.2521     12.8714  38.5351     12.8502  22.4287    113.733     0           0           
1 1 1 41 2  29 o 15 24.4176 6.50466 -9.00479    13.299   22.3301     12.6361  6.06402    121.66      19.2592     301.66      
1 1 1 41 2  30 o 5  59.2814 5.37789 67.1469     14.4031  76.44       16.8148  39.3091    16.7794     7.22911     196.779     
1 1 1 41 2  31 o 19 22.4229 6.60348 7.95232     11.9641  5.86215     12.6772  7.55614    207.383     9.98529     27.3833     
1 1 1 41 2  32 o 2  20.6918 6.37097 0.625012    12.2827  4.91656     12.5367  4.26072    72.0115     0.240693    252.012     
1 1 1 41 2  33 o 18 20.022  6.25273 -8.98461    12.6849  7.66658     12.9175  6.53237    301.332     5.43308     121.332     
1 1 1 41 2  34 o 19 27.0007 6.94197 2.32632     13.435   25.2471     13.4144  5.55751    280.613     3.40504     280.613     
1 1 1 41 2  35 o 1  24.5762 7.36321 1.07661     16.0365  14.7307     16.0813  4.95223    53.1876     22.1341     233.188     
1 1 1 41 2  36 o 7  25.9399 7.5506  9.21569     16.1384  14.7795     15.6766  12.2517    17.9916     8.21544     197.992     
1 1 1 41 2  37 o 6  26.4974 7.75755 16.8934     16.1069  8.16273     18.1805  9.29891    241.95      16.0151     61.95       
1 1 1 41 2  38 o 1  49.5618 7.90713 71.9686     20.0371  47.3732     18.6168  37.934     38.1033     6.55872     38.1033     
1 1 1 41 2  39 o 19 22.3833 6.99408 12.755      16.3129  -8.66883    15.7318  10.4175    326.199     2.20063     326.199     
1 1 1 41 2  40 o 6  37.4049 8.19727 27.4088     17.6774  45.6476     17.4421  29.722     184.401     10.8283     184.401     
1 1 1 41 2  41 o 6  32.7889 8.40115 29.2484     18.1043  29.2003     17.4525  23.3102    52.4631     5.66563     52.4631     
1 1 1 41 2  42 o 10 20.5988 6.67619 -11.5414    16.2345  6.98723     15.8481  6.68689    285.993     8.66024     105.993     
1 1 1 41 2  43 o 17 36.545  8.19359 55.7279     18.937   19.1567     18.792   29.3741    23.8615     17.57       23.8615     
1 1 1 41 2  44 f 0  31.8746 8.40125 26.0262     18.472   33.9872     17.877   3.46335    299.661     0           0           
1 1 1 41 2  45 o 7  33.5792 8.21477 48.0022     18.5018  18.1179     18.1543  23.4428    30.5529     9.59104     30.5529     
1 1 1 41 2  46 o 3  23.1452 7.27277 18.3258     17.8196  -2.56703    16.8946  6.77544    145.465     0.605446    325.465     
1 1 1 41 2  47 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 2  48 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 3  0  o 3  11.2148 5.41387 -4.72258    9.48412  -4.72258    9.48412  0.648773   180         3.9116      180         
1 1 1 41 3  1  o 17 29.3572 6.07169 8.1294      10.3874  26.7301     10.3402  21.434     146.308     5.00902     146.308     
1 1 1 41 3  2  o 14 45.0101 5.17134 46.7818     11.2171  33.9793     11.1147  29.8481    134.333     6.35516     314.333     
1 1 1 41 3  3  o 10 48.81   4.80505 53.2929     11.3169  40.067      11.3122  29.3667    356.905     13.6203     176.905     
1 1 1 41 3  4  o 2  48.0108 4.83157 40.8608     11.1957  49.4233     11.3069  40.8653    180.889     11.7127     180.889     
1 1 1 41 3  5  o 15 36.3499 6.20184 28.6927     11.6175  26.7167     10.7183  32.5759    94.9387     16.7502     94.9387     
1 1 1 41 3  6  o 2  23.9297 6.07808 2.35923     9.98507  16.9243     10.011   9.42844    25.4603     12.5711     205.46      
1 1 1 41 3  7  o 12 29.2375 6.37641 19.4631     10.3987  16.445      10.1825  19.3918    107.367     0.0159077   107.367     
1 1 1 41 3  8  o 15 28.9055 6.43705 19.5624     10.5897  15.5313     10.301   17.3562    308.139     4.17376     128.139     
1 1 1 41 3  9  o 3  20.5629 5.88197 10.7781     9.83651  -3.79422    10.388   7.75832    80.7252     1.17115     80.7252     
1 1 1 41 3  10 o 13 79.4207 3.59133 118.287     13.8446  117.492     14.578   63.906     322.897     8.28822     322.897     
1 1 1 41 3  11 o 11 40.5169 5.91063 29.0567     12.0369  39.113      11.1437  15.9615    71.1815     27.4648     251.182     
1 1 1 41 3  12 o 15 26.9094 6.35718 9.85529     10.4015  19.4553     10.3541  17.6635    9.8592      1.6962      9.8592      
1 1 1 41 3  13 f 0  29.743  6.25987 10.8362     10.6546  26.1521     10.6021  21.1057    312.366     0           0           
1 1 1 41 3  14 o 13 37.5315 6.17224 26.5513     11.7492  33.0969     11.1099  13.9055    333.653     26.6657     153.653     
1 1 1 41 3  15 o 13 25.8252 6.62747 6.63235     10.2411  19.8023     12.464   16.3104    349.356     2.2341      349.356     
1 1 1 41 3  16 o 19 44.461  5.45788 35.6215     11.8403  45.0369     11.4589  38.1619    34.7154     12.8554     34.7154     
1 1 1 41 3  17 o 15 27.5399 6.50773 17.9582     10.5155  14.0598     10.7027  10.513     114.354     16.5814     294.354     
1 1 1 41 3  18 o 16 40.2726 5.84169 41.5468     11.3289  26.8011     11.4744  30.5391    354.416     4.04203     354.416     
1 1 1 41 3  19 o 13 23.5655 6.5241  0.11552     12.4344  15.7379     11.5574  8.81038    219.632     12.4466     39.6323     
1 1 1 41 3  20 o 13 92.3494 3.72036 154.751     16.4218  167.563     17.8768  81.7775    191.963     25.5317     191.963     
1 1 1 41 3  21 o 10 61.0388 4.94826 73.9387     14.4023  74.2398     15.3016  51.3802    252.857     13.1594     252.857     
1 1 1 41 3  22 o 1  21.9684 6.57576 7.0483      12.6969  3.76378     12.3448  9.77305    191.887     0.266678    11.8869     
1 1 1 41 3  23 o 4  30.6571 6.68684 -0.645151   15.0314  35.6576     13.1801  21.6452    184.604     12.9758     184.604     
1 1 1 41 3  24 o 9  52.2758 5.84449 60.7726     14.9043  53.3197     14.6614  46.9057    268.484     19.1846     268.484     
1 1 1 41 3  25 o 10 48.504  7.04707 54.7654     16.7602  50.5183     16.3562  33.2436    86.9454     3.02192     266.945     
1 1 1 41 3  26 o 3  87.1121 4.50893 143.896     19.2884  153.051     19.8047  71.6743    193.044     14.4686     193.044     
1 1 1 41 3  27 o 8  23.481  6.97935 10.7892     13.8631  4.2713      14.2311  10.6622    197.786     1.97824     17.7855     
1 1 1 41 3  28 o 12 65.4234 5.34201 99.4216     15.8406  75.3724     17.6455  47.5499    272.645     0.381075    92.6447     
1 1 1 41 3  29 f 0  19.1049 6.19031 3.19564     13.7336  -14.0641    13.8835  22.1465    211.338     0           0           
1 1 1 41 3  30 o 12 24.1599 7.04574 8.77456     12.8264  10.5015     14.7705  11.1301    159.422     5.74105     339.422     
1 1 1 41 3  31 o 18 29.5082 7.34148 25.7989     13.3137  12.298      15.0818  18.0795    319.068     1.35393     139.068     
1 1 1 41 3  32 o 10 22.9219 6.99403 8.81853     14.7897  2.13574     14.6669  10.9324    189.716     3.6066      9.71554     
1 1 1 41 3  33 o 5  21.5651 7.01263 -5.35737    15.6217  0.907006    18.921   9.77728    120.373     0.0148057   300.374     
1 1 1 41 3  34 o 2  57.1499 7.3852  79.389      20.5384  70.1401     20.1837  60.7352    186.834     42.5305     186.834     
1 1 1 41 3  35 o 14 24.8491 7.42117 13.4876     16.1836  6.22067     15.709   3.61177    208.489     2.06209     208.489     
1 1 1 41 3  36 o 10 22.1564 6.91873 -8.1975     16.0201  11.3079     15.4323  6.80639    129.461     13.901      309.461     
1 1 1 41 3  37 o 19 26.0351 7.75827 8.70138     16.6154  17.3643     18.0395  9.63763    207.481     5.48827     207.481     
1 1 1 41 3  38 o 9  35.577  8.57816 29.1119     19.1438  40.2374     18.2253  16.4262    210.228     15.874      30.2278     
1 1 1 41 3  39 o 14 35.0836 8.31741 23.2516     17.6182  44.1337     18.2451  21.3927    143.95      4.04043     323.951     
1 1 1 41 3  40 o 14 28.0279 7.96164 26.506      17.2183  11.8685     18.049   17.0575    62.95       7.27989     62.95       
1 1 1 41 3  41 o 6  35.5615 8.61537 36.7095     18.4809  38.2487     18.5158  26.8199    170.36      10.0422     170.36      
1 1 1 41 3  42 o 15 19.995  6.58316 -10.1472    16.3436  4.6197      16.2272  5.29411    1.31657     8.15112     181.317     
1 1 1 41 3  43 o 2  22.8683 7.20362 19.7935     17.9534  -8.63966    17.0514  6.9485     40.9721     0.0106852   40.9685     
1 1 1 41 3  44 o 14 23.9223 7.50183 17.4581     18.2913  4.19153     17.9202  5.02955    231.561     0.729843    231.561     
1 1 1 41 3  45 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 3  46 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 4  0  o 19 94.5187 3.25891 162.937     15.3525  162.937     15.3525  67.3401    360         10.0848     180         
1 1 1 41 4  1  o 9  53.3221 4.72118 57.8007     12.8282  53.6813     11.8549  39.2009    216.377     0.881782    36.3772     
1 1 1 41 4  2  o 11 40.3222 5.92842 33.8074     11.1314  34.0077     12.0407  38.9254    313.754     22.8581     313.754     
1 1 1 41 4  3  o 8  25.8185 6.4687  12.6769     10.3469  14.2489     10.6097  15.635     169.782     1.14066     349.782     
1 1 1 41 4  4  o 13 45.8654 5.24138 45.0146     11.4167  39.6563     11.7863  41.8297    7.02114     17.5853     7.02114     
1 1 1 41 4  5  o 10 55.6079 4.48297 60.2334     12.4954  59.9015     12.0393  56.6217    288.394     32.0052     288.394     
1 1 1 41 4  6  o 4  36.3892 6.17363 28.9579     10.9805  27.4051     11.2555  22.7895    127.926     6.41666     307.926     
1 1 1 41 4  7  o 16 19.8272 5.9135  4.52741     10.0971  2.63221     10.0267  6.13408    326.509     11.1568     146.509     
1 1 1 41 4  8  o 4  65.8394 3.94832 74.5161     12.8458  90.8754     12.839   57.1171    78.5019     15.7963     78.5019     
1 1 1 41 4  9  o 9  21.7941 6.17187 11.0371     10.6404  2.41319     10.2715  10.3859    12.4504     3.73465     192.45      
1 1 1 41 4  10 o 18 36.7416 6.17304 23.3623     11.0183  34.7044     11.5649  20.6872    176.028     11.3807     356.028     
1 1 1 41 4  11 o 3  50.0385 5.11589 52.367      11.8461  48.0739     12.934   42.5044    224.353     11.888      224.353     
1 1 1 41 4  12 o 7  85.1857 3.55636 134.391     14.8782  138.364     15.3516  81.0344    168.849     34.0471     168.849     
1 1 1 41 4  13 o 12 64.9543 4.31996 80.1018     13.917   83.2622     13.8701  56.86      137.02      17.0878     137.02      
1 1 1 41 4  14 o 14 62.9137 4.62514 81.8811     13.8233  73.4177     14.7659  59.4796    66.3038     26.0271     66.3038     
1 1 1 41 4  15 o 6  45.2389 6.14908 34.0659     13.2898  53.6489     13.4596  40.342     338.002     16.3966     338.002     
1 1 1 41 4  16 o 7  21.5265 6.48637 6.91307     11.7655  1.76029     13.0956  9.3982     234.731     4.60443     54.731      
1 1 1 41 4  17 o 2  43.8518 6.39679 38.3558     13.5445  44.777      13.6415  20.5109    179.489     23.0442     359.489     
1 1 1 41 4  18 o 13 21.4841 6.52747 9.42459     13.6164  -1.69767    11.9779  9.05898    233.879     0.761217    53.8794     
1 1 1 41 4  19 o 1  23.8134 6.81592 9.83506     12.3974  9.07891     12.8653  8.89456    92.7498     12.1589     272.75      
1 1 1 41 4  20 o 8  40.7278 6.76382 35          13.6154  38.8728     13.5423  26.6363    19.6179     4.54653     199.618     
1 1 1 41 4  21 o 14 31.0559 7.37127 26.9389     13.2273  17.0092     14.6765  15.4953    243.174     11.0517     63.174      
1 1 1 41 4  22 o 13 83.2393 4.3218  137.993     17.4826  131.452     18.2731  72.7177    88.7379     21.7094     88.7379     
1 1 1 41 4  23 f 0  28.4923 7.27804 15.7767     13.1347  20.5394     13.6012  18.1411    159.789     0           0           
1 1 1 41 4  24 o 16 40.3034 6.95897 33.3382     13.8291  40.5919     14.108   34.7036    5.85032     26.0217     5.85032     
1 1 1 41 4  25 o 5  23.5023 6.69691 1.4292      12.514   15.466      12.7382  10.723     315.967     4.3745      135.967     
1 1 1 41 4  26 o 6  26.007  7.00633 -0.645775   14.8846  22.7731     13.4242  12.6809    65.3364     6.89553     245.336     
1 1 1 41 4  27 o 7  21.4646 6.64235 4.94158     14.4602  1.94621     12.6884  8.89558    33.2863     2.20537     213.286     
1 1 1 41 4  28 o 18 52.7479 6.21375 68.1098     16.5532  51.6973     15.098   44.6719    92.4938     13.7204     92.4938     
1 1 1 41 4  29 o 6  35.7342 8.26553 21.9774     19.4691  40.9117     16.8878  9.50864    212.223     7.61949     212.223     
1 1 1 41 4  30 o 10 22.4205 7.22852 8.75313     17.9842  -17.1255    19.7502  9.94209    256.538     2.55396     256.538     
1 1 1 41 4  31 o 5  26.7047 7.90794 8.82377     16.2134  18.3347     19.3021  10.9971    169.999     6.56978     169.999     
1 1 1 41 4  32 o 18 24.1038 7.51711 3.35094     16.2445  9.66639     19.1027  10.5027    298.917     4.73488     298.917     
1 1 1 41 4  33 o 9  34.2565 8.6678  38.0416     18.5672  23.9011     20.4786  21.5261    358.709     3.05474     178.709     
1 1 1 41 4  34 o 18 45.3858 8.9641  64.9111     20.0916  47.7265     24.0535  36.7638    301.236     10.7808     301.236     
1 1 1 41 4  35 o 10 22.612  7.22402 -11.9106    16.1347  15.1515     19.3661  10.3396    199.208     5.55574     19.2081     
1 1 1 41 4  36 o 7  33.179  8.64002 51.961      22.9312  12.0088     16.7642  17.1416    18.5768     10.4509     198.577     
1 1 1 41 4  37 o 17 39.1191 8.69816 51.9263     19.2242  35.6177     19.8614  31.2884    309.191     11.1684     309.191     
1 1 1 41 4  38 o 9  26.4778 7.94605 10.6303     19.5452  21.1644     17.8614  4.77407    91.2948     2.60215     91.2948     
1 1 1 41 4  39 o 2  34.5033 8.61578 25.0788     19.5361  47.2196     19.4339  24.6278    333.694     6.34375     333.694     
1 1 1 41 4  40 o 9  18.4614 6.2639  -0.332201   17.0637  -22.5091    16.854   2.83931    55.3457     2.67412     235.346     
1 1 1 41 4  41 o 14 29.7972 8.49765 31.0858     19.5751  24.8904     19.6725  17.1798    337.183     0.327272    337.183     
1 1 1 41 4  42 o 5  22.6994 7.26944 13.2728     17.9066  0.602733    18.1264  5.08273    137.69      0.280767    317.69      
1 1 1 41 4  43 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 4  44 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 5  0  o 17 11.202  5.45984 -6.07419    10.1871  -6.07419    10.1871  0.56801    180         3.36686     180         
1 1 1 41 5  1  o 7  46.4596 5.67067 40.2624     12.3726  49.3837     13.0541  31.0063    24.9406     6.48012     204.941     
1 1 1 41 5  2  o 19 70.817  4.15637 88.9405     14.3049  104.484     14.8915  68.2065    190.225     30.2706     190.225     
1 1 1 41 5  3  o 18 55.9317 4.95683 55.4798     12.8331  69.8125     14.3332  60.2788    273.292     39.6656     273.292     
1 1 1 41 5  4  o 18 20.3403 6.12867 5.5326      10.8227  1.57509     11.2666  6.97614    193.791     0.473376    193.791     
1 1 1 41 5  5  o 16 46.7611 5.64663 44.9696     12.3125  45.5758     13.1891  47.7262    116.027     29.7213     116.027     
1 1 1 41 5  6  o 8  37.092  6.52049 35.7192     11.9326  24.9184     12.52    23.8691    284.43      5.23276     104.43      
1 1 1 41 5  7  f 0  21.4097 6.16939 12.5298     10.6364  -5.38623    12.3215  24.4191    83.4827     0           0           
1 1 1 41 5  8  o 11 32.1027 6.77714 26.9495     11.6403  19.1048     12.2046  14.8459    273.453     15.6453     93.4529     
1 1 1 41 5  9  o 6  19.957  6.12005 0.308479    11.5221  4.2839      11.2297  3.30727    203.742     18.2817     23.742      
1 1 1 41 5  10 o 3  23.5845 6.50042 0.510168    12.2341  16.2416     11.5158  12.7965    9.03941     0.32114     189.039     
1 1 1 41 5  11 o 12 31.8697 7.28939 24.2102     13.1079  22.6393     13.4747  14.6216    302.857     15.3456     122.857     
1 1 1 41 5  12 o 1  50.9509 6.24454 64.5682     15.3984  46.8523     15.1278  45.97      298.415     18.1888     298.415     
1 1 1 41 5  13 o 10 65.1171 5.29985 75.9362     16.8705  96.6315     16.7675  51.5407    39.2862     5.98896     39.2862     
1 1 1 41 5  14 o 9  59.1952 5.71423 67.5005     14.8682  78.2623     18.1247  54.7284    195.543     22.6028     195.543     
1 1 1 41 5  15 o 15 26.3556 7.08972 8.62549     12.417   19.8527     13.8904  16.0158    349.611     3.9665      349.611     
1 1 1 41 5  16 o 9  21.8904 6.55655 1.68934     12.0885  9.3428      12.983   8.16232    237.44      0.549497    237.439     
1 1 1 41 5  17 o 16 52.3452 7.06979 68.2121     16.6518  55.1016     18.8135  34.1372    339.806     8.44559     159.806     
1 1 1 41 5  18 o 13 20.9259 6.43206 3.0181      12.1302  3.75167     12.9967  7.19065    274.58      1.53371     94.5797     
1 1 1 41 5  19 o 4  72.8221 4.71134 106.348     16.4468  104.13      17.5129  71.1655    18.4235     34.7838     18.4235     
1 1 1 41 5  20 o 9  32.8832 7.44844 24.6552     13.3357  26.7897     14.4375  23.2068    144.273     3.87865     144.273     
1 1 1 41 5  21 o 19 26.5172 7.13807 0.0717173   12.8956  26.9752     15.532   13.1666    354.419     7.01066     174.419     
1 1 1 41 5  22 o 12 43.7025 6.98843 35.8338     14.4015  51.5329     15.6478  34.2178    277.449     6.74264     277.449     
1 1 1 41 5  23 o 10 42.8779 7.03353 40.7973     14.2868  43.0663     15.3555  29.9716    71.9254     1.06793     251.925     
1 1 1 41 5  24 o 11 26.2995 7.17958 16.0074     13.0153  12.4546     13.9667  14.0886    332.783     4.95378     152.783     
1 1 1 41 5  25 o 19 49.3923 7.64915 55.9053     17.7628  58.5582     19.0535  42.6666    277.378     15.0245     277.378     
1 1 1 41 5  26 o 6  22.2945 6.97933 8.30639     15.3962  -3.85992    16.0465  6.7227     353.419     2.5442      353.419     
1 1 1 41 5  27 o 7  23.1128 7.19789 5.09638     15.5385  4.43448     16.8775  12.4657    226.17      1.23838     46.1705     
1 1 1 41 5  28 o 5  54.9698 7.30491 80.2862     18.6608  59.01       19.7925  49.6495    316.166     20.2545     316.166     
1 1 1 41 5  29 o 10 27.6835 8.11807 17.1838     19.5553  15.4601     17.3849  8.78839    119.891     19.9809     299.891     
1 1 1 41 5  30 o 10 29.3902 8.5067  24.3715     21.7951  17.8737     18.0159  14.4878    77.0166     10.2169     257.017     
1 1 1 41 5  31 o 14 27.6369 8.23466 18.1807     21.7499  15.7023     17.2708  18.1624    290.694     3.66886     290.694     
1 1 1 41 5  32 o 9  28.1035 8.44462 15.4571     24.1496  20.0475     18.3013  18.1629    160.503     2.35751     160.503     
1 1 1 41 5  33 o 7  24.8428 7.81237 18.5568     21.098   -0.367568   18.1921  14.4124    115.731     2.19728     115.731     
1 1 1 41 5  34 o 7  20.0504 6.74695 4.87903     20.1002  -21.6714    16.5679  7.55716    31.2731     3.66497     211.273     
1 1 1 41 5  35 o 1  24.9544 7.92252 8.48746     18.1702  13.807      22.9421  11.2658    190.902     3.98147     190.902     
1 1 1 41 5  36 o 19 32.45   8.48033 45.281      18.7696  12.6725     24.3045  23.3758    143.188     8.31256     143.188     
1 1 1 41 5  37 o 17 21.3564 7.14253 -3.93607    17.7723  1.35243     22.3173  2.62068    90.4107     20.4017     270.411     
1 1 1 41 5  38 o 5  29.9264 9.86011 5.73326     18.5871  97.6376     46.6777  14.5308    314.863     6.32026     314.863     
1 1 1 41 5  39 o 14 45.112  9.37372 82.4522     21.7902  58.2002     30.4925  39.9956    153.134     24.1742     153.134     
1 1 1 41 5  40 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 5  41 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 5  42 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 6  0  o 15 22.6481 8.49755 16.0658     12.9858  16.0658     12.9858  5.12506    360         2.01202     360         
1 1 1 41 6  1  o 14 33.7558 6.85381 28.55       12.1554  23.3343     12.3826  21.4646    49.6512     15.8269     49.6512     
1 1 1 41 6  2  o 10 43.8291 6.54784 47.6058     14.5031  37.2149     13.3984  34.0928    90.2539     4.96276     90.2539     
1 1 1 41 6  3  o 19 32.734  7.26083 26.8453     13.5109  23.2247     13.031   24.5785    115.599     6.18186     115.599     
1 1 1 41 6  4  f 0  36.7795 6.99459 35.2167     13.971   27.0148     12.4387  9.6519     174.497     0           0           
1 1 1 41 6  5  f 0  31.3295 7.1517  20.1025     13.8903  24.9831     12.0739  24.8058    30.5895     0           0           
1 1 1 41 6  6  o 19 41.8135 6.90596 39.0632     14.3801  39.944      14.039   40.3472    128.592     25.1328     128.592     
1 1 1 41 6  7  o 6  22.096  6.60959 5.27825     12.3582  6.95518     12.8763  5.80112    160.689     1.36357     160.689     
1 1 1 41 6  8  o 15 26.4568 7.28148 15.6992     13.2818  13.0231     14.62    16.0209    213.089     3.69418     213.089     
1 1 1 41 6  9  o 11 23.9791 6.57512 21.6248     13.1138  -8.58683    13.1829  12.4211    266.773     1.98946     86.773      
1 1 1 41 6  10 o 15 38.4648 7.06372 21.5048     14.6866  47.6757     14.4962  29.9774    57.3553     6.63922     57.3553     
1 1 1 41 6  11 o 11 70.9435 5.10772 110.262     18.7072  93.8082     17.1091  61.975     191.968     17.8279     191.968     
1 1 1 41 6  12 o 5  22.9964 6.87371 4.28375     13.8997  9.85087     13.5426  10.2491    312.542     0.055544    312.542     
1 1 1 41 6  13 o 2  65.9495 5.33159 71.4913     16.7971  107.944     16.9906  54.7451    222.372     11.2736     222.372     
1 1 1 41 6  14 o 3  36.9274 7.86068 31.915      14.6619  35.2032     16.8299  24.5173    46.1976     2.16155     226.198     
1 1 1 41 6  15 o 2  29.3265 7.38696 14.7687     13.9451  24.6328     13.9283  13.1936    84.8896     13.3056     264.89      
1 1 1 41 6  16 o 4  32.1956 7.87297 29.8397     16.2705  21.0134     14.7825  19.0956    349.197     5.33351     169.197     
1 1 1 41 6  17 f 0  66.7899 5.20482 81.8825     16.9134  100.217     17.1811  46.1802    186.81      0           0           
1 1 1 41 6  18 o 16 20.5894 6.44918 -0.828473   12.8716  4.17566     13.548   1.20353    303.614     0.221347    303.614     
1 1 1 41 6  19 o 17 38.5771 7.50548 32.6426     14.9108  38.3784     15.0958  35.4728    249.091     21.2407     249.091     
1 1 1 41 6  20 o 11 44.1544 7.31231 29.5816     14.5414  63.9721     18.0933  32.5084    52.3301     1.58833     52.33       
1 1 1 41 6  21 o 14 23.6353 7.23484 13.4106     16.1333  -2.63975    16.3418  9.68599    8.92806     4.0703      8.92806     
1 1 1 41 6  22 o 9  29.547  7.97392 33.118      17.1961  -4.7841     22.1575  14.2489    235.867     11.8625     55.8673     
1 1 1 41 6  23 o 3  70.4302 6.41892 85.1181     21.2851  131.439     21.8186  58.0627    164.6       11.4761     164.6       
1 1 1 41 6  24 o 2  25.9913 7.7603  7.30325     17.3333  16.5526     17.6266  13.0941    144.763     7.59048     324.763     
1 1 1 41 6  25 o 3  24.4724 7.4658  16.2062     17.4017  -0.727446   16.7675  14.3327    307.989     4.9906      307.989     
1 1 1 41 6  26 o 7  37.4631 8.15833 18.9276     18.3429  53.9326     18.7932  32.5414    287.121     15.3413     287.121     
1 1 1 41 6  27 o 3  23.6579 7.30605 14.5424     17.0291  -1.77403    16.4639  11.1063    23.8966     7.25567     203.897     
1 1 1 41 6  28 o 2  29.1746 8.04172 5.40344     18.4765  33.345      18.2637  15.0189    151.512     9.10611     331.512     
1 1 1 41 6  29 o 9  27.9552 7.82698 2.14818     17.9288  31.0088     17.6421  7.95379    51.4101     5.35066     51.4101     
1 1 1 41 6  30 o 8  18.7987 6.32273 -27.6836    15.8992  3.41777     17.2396  1.07023    152.068     21.2305     332.068     
1 1 1 41 6  31 f 0  29.0139 7.90643 -4.56229    19.4947  39.8572     18.8233  12.8902    106.005     0           0           
1 1 1 41 6  32 o 10 27.5323 8.32467 23.3566     19.7425  15.5193     21.5281  13.801     291.796     7.14155     111.796     
1 1 1 41 6  33 o 14 25.3954 7.85006 -0.932017   21.2522  24.0411     19.0365  11.5129    295.329     7.65499     115.329     
1 1 1 41 6  34 o 8  21.1273 7.02688 -5.64109    20.8637  2.23576     17.7234  7.14414    132.421     2.23699     312.421     
1 1 1 41 6  35 o 16 33.0821 9.23494 40.6144     24.0401  38.161      21.2903  23.0332    310.418     8.83423     310.418     
1 1 1 41 6  36 o 19 24.4563 7.78103 10.5986     21.4901  14.777      18.8324  6.86307    29.4308     1.57778     29.4308     
1 1 1 41 6  37 o 1  20.964  7.01217 -13.2483    22.3616  6.01605     18.145   4.11543    310.724     1.70819     130.724     
1 1 1 41 6  38 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 6  39 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 7  0  o 1  37.584  8.63043 35.7222     14.3766  35.7222     14.3766  30.8872    360         4.0517      360         
1 1 1 41 7  1  o 19 26.6753 7.4045  12.1878     13.4406  18.083      15.4691  14.5204    298.814     4.37718     118.814     
1 1 1 41 7  2  o 15 18.0276 5.9338  0.858282    12.4792  -20.6315    15.1859  9.17449    296.188     42.3008     296.188     
1 1 1 41 7  3  o 5  26.7302 7.36128 20.5076     14.0738  8.04195     15.4146  16.4698    46.2968     3.07718     46.2968     
1 1 1 41 7  4  o 19 40.3902 8.24048 34.019      20.5838  48.3228     16.4033  32.1172    293.298     7.90043     293.298     
1 1 1 41 7  5  o 5  22.4955 6.85944 5.33921     13.3453  6.31237     14.7725  5.38212    243.669     18.1055     63.6692     
1 1 1 41 7  6  o 19 31.3111 7.55884 20.4046     14.5869  26.4847     14.1335  14.2382    350.144     15.1779     170.144     
1 1 1 41 7  7  o 1  26.7299 7.84446 16.9853     15.6007  9.2509      19.8734  14.3998    64.8289     6.20134     64.8289     
1 1 1 41 7  8  o 18 22.1967 6.74844 5.61967     13.238   5.61904     13.8371  1.84032    127.28      25.8555     307.28      
1 1 1 41 7  9  f 0  36.1039 7.54887 44.0682     14.8523  17.2537     18.213   22.0195    22.2677     0           0           
1 1 1 41 7  10 o 18 20.9019 6.58471 2.50407     14.3666  0.731572    13.5097  7.49443    330.542     0.251404    330.542     
1 1 1 41 7  11 o 15 40.648  7.43607 33.1501     15.3476  45.5232     15.483   22.6014    59.4764     13.8664     239.476     
1 1 1 41 7  12 o 6  16.6049 5.5452  -1.31557    12.347   -22.2682    12.7894  3.49969    304.285     5.05525     124.285     
1 1 1 41 7  13 o 14 28.0213 7.68752 20.6641     14.5706  13.3034     16.9948  16.8529    11.8195     2.69922     191.82      
1 1 1 41 7  14 o 16 58.2245 5.91567 77.9184     16.9316  65.9064     16.5132  53.0852    218.222     20.0569     218.222     
1 1 1 41 7  15 o 15 20.8408 6.6792  2.41961     15.9706  -3.07971    14.0587  8.71682    251.364     6.45485     71.3645     
1 1 1 41 7  16 o 8  28.9028 7.63251 20.2612     14.5652  18.3447     15.1945  21.5506    117.034     10.225      117.034     
1 1 1 41 7  17 o 5  23.5323 7.03568 -12.3295    18.1015  16.7588     14.3341  11.9453    78.8767     5.62233     258.877     
1 1 1 41 7  18 o 7  31.1105 8.39523 8.25328     23.4945  33.5246     17.5688  23.5995    239.796     7.31238     239.796     
1 1 1 41 7  19 o 7  17.9816 6.10709 -6.1278     16.4843  -23.5122    15.6106  5.37968    328.292     0.974199    148.292     
1 1 1 41 7  20 o 8  25.9293 7.82184 19.5913     18.76    3.15958     17.7623  13.3012    203.067     7.27118     203.067     
1 1 1 41 7  21 o 2  29.5322 8.32869 35.7842     19.759   -3.71608    23.034   19.3791    224.704     0.101444    224.704     
1 1 1 41 7  22 o 12 23.62   7.44127 7.56638     17.6952  3.96487     17.9806  13.6187    293.002     1.38867     293.002     
1 1 1 41 7  23 o 2  23.8839 7.48744 8.38466     18.0159  5.76135     17.6094  7.52756    256.454     16.5703     76.4541     
1 1 1 41 7  24 o 7  30.7428 8.59973 17.7938     21.6876  31.9304     19.0781  22.2338    177.921     5.29766     177.921     
1 1 1 41 7  25 o 10 30.2589 8.83518 17.0869     19.9415  34.5313     23.6458  21.7561    16.5128     11.9318     16.5128     
1 1 1 41 7  26 o 15 22.7593 7.19654 -15.6593    18.3285  17.3098     17.8479  12.0408    17.5498     1.55484     17.5498     
1 1 1 41 7  27 o 2  22.0621 7.20634 2.01236     18.8618  0.705222    18.4611  9.16334    194.419     1.91962     194.419     
1 1 1 41 7  28 o 2  22.5332 7.30487 4.82206     19.046   2.93466     18.2964  10.7179    347.878     1.64119     167.878     
1 1 1 41 7  29 o 2  25.1372 7.79106 29.3258     21.0179  -6.85692    18.3464  7.83381    95.0878     3.59539     95.0878     
1 1 1 41 7  30 o 10 20.1902 6.79259 -7.83345    20.62    -2.9206     17.2113  4.85076    313.366     0.654848    133.366     
1 1 1 41 7  31 o 14 25.3424 8.0268  7.83398     22.2121  20.517      20.5641  11.2278    275.407     3.17927     275.407     
1 1 1 41 7  32 o 14 18.5567 6.34118 -31.6903    20.4815  -0.387594   17.1655  1.54717    31.1214     1.08698     211.121     
1 1 1 41 7  33 o 9  21.2859 7.07855 -0.20427    19.8642  2.09275     18.8724  6.19302    125.498     2.51227     305.498     
1 1 1 41 7  34 f 0  22.908  7.84878 30.6477     31.4541  -17.5112    18.7768  9.99083    327.962     0           0           
1 1 1 41 7  35 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 7  36 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 8  0  o 7  21.2032 9.03691 13.5156     17.4656  13.5156     17.4656  10.2153    180         9.88778     360         
1 1 1 41 8  1  o 17 43.1781 8.15523 58.4109     18.8333  35.7348     17.9911  26.4128    336.436     10.5781     156.436     
1 1 1 41 8  2  o 10 26.832  7.73756 24.5196     17.7054  2.32156     16.6092  16.4155    41.3528     1.64763     221.353     
1 1 1 41 8  3  o 16 46.5718 8.71626 65.2737     22.3368  47.6479     19.1058  46.8346    170.059     29.0259     170.059     
1 1 1 41 8  4  o 4  35.5948 8.29307 16.1626     21.4753  45.8658     17.6313  22.9181    29.7668     4.6615      209.767     
1 1 1 41 8  5  o 9  21.4743 6.90501 2.47972     14.372   -4.02427    18.5392  9.45242    254.373     2.15787     254.373     
1 1 1 41 8  6  o 4  19.5836 6.38882 -8.14302    13.7812  0.595713    15.3987  7.90742    266.371     5.85314     86.3706     
1 1 1 41 8  7  f 0  23.5519 7.13412 -2.24536    14.9863  15.1587     15.9538  20.2127    4.01867     0           0           
1 1 1 41 8  8  o 16 21.888  6.94085 1.2913      15.0955  2.8514      16.4145  10.6403    17.6629     2.91472     17.6629     
1 1 1 41 8  9  o 12 36.7159 8.13433 20.7548     15.9618  49.1839     18.8682  24.3504    214.945     3.77873     34.9455     
1 1 1 41 8  10 o 16 30.006  8.2834  19.3661     17.7285  24.7785     18.3509  23.0083    309.117     8.60995     309.117     
1 1 1 41 8  11 o 3  16.8791 5.76466 -19.5439    13.0371  -8.87748    15.7988  3.36075    267.626     12.5014     87.6257     
1 1 1 41 8  12 o 16 34.4842 8.7559  23.9666     16.495   42.0046     22.038   17.7693    172.825     13.6269     352.825     
1 1 1 41 8  13 o 6  24.3384 7.85197 0.113166    18.4346  9.18016     23.6544  14.4257    205.991     4.36622     205.991     
1 1 1 41 8  14 o 13 33.6867 9.97155 38.8688     30.8459  32.5129     25.7448  26.7784    58.2407     11.2773     58.2407     
1 1 1 41 8  15 o 12 33.1142 9.66042 35.8821     20.9385  25.092      38.3478  21.7045    101.863     1.61341     281.863     
1 1 1 41 8  16 o 11 21.5684 7.06807 4.79874     19.3147  -8.82568    16.9544  10.7498    1.1562      1.39908     1.1562      
1 1 1 41 8  17 o 15 40.363  9.94797 61.2851     29.0096  44.0842     20.6605  34.8447    0.10757     14.7378     0.10757     
1 1 1 41 8  18 f 0  28.1736 8.07207 6.06084     20.2708  28.2209     17.7927  22.6372    151.25      0           0           
1 1 1 41 8  19 o 19 30.2114 8.65175 29.8889     21.4276  20.3005     19.3202  22.9034    260.575     9.83895     260.575     
1 1 1 41 8  20 o 16 20.8979 6.93894 6.15452     19.4068  -17.5464    17.9165  5.86174    71.4412     14.8233     251.441     
1 1 1 41 8  21 o 3  39.6266 10.0694 52.5898     24.5305  55.1549     26.4515  26.9795    26.5632     1.65582     206.563     
1 1 1 41 8  22 o 9  28.8067 8.46277 21.5551     21.5565  23.7123     18.9442  20.2634    307.557     7.13185     307.557     
1 1 1 41 8  23 o 7  28.0257 8.39774 24.2669     21.8512  18.4174     18.959   18.0627    22.159      2.08906     22.159      
1 1 1 41 8  24 o 3  29.9516 8.71834 30.7376     22.425   24.6957     19.7231  20.6198    120.381     5.05747     120.38      
1 1 1 41 8  25 o 14 23.9572 7.64906 17.5445     20.8228  1.71512     18.2551  11.7169    103.799     2.19669     103.799     
1 1 1 41 8  26 o 18 24.1462 7.69509 8.00582     21.0098  13.2213     18.6245  12.1107    73.3625     0.0436279   253.363     
1 1 1 41 8  27 o 5  34.4355 8.05186 -1.88963    23.04    64.4722     20.515   23.75      7.54202     1.82133     7.54201     
1 1 1 41 8  28 o 15 21.2639 7.09007 2.92549     21.0722  -1.86091    18.0369  5.8167     232.301     0.66289     52.3008     
1 1 1 41 8  29 o 19 20.7854 6.97323 3.09816     21.0197  -4.95439    17.7844  1.73608    294.079     0.19336     114.079     
1 1 1 41 8  30 o 9  24.7244 7.92942 10.3584     22.342   18.1116     20.5781  8.93592    60.3004     1.55118     60.3004     
1 1 1 41 8  31 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 8  32 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 8  33 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 9  0  o 1  54.72   9.2306  71.5049     21.9633  71.5049     21.9633  47.0641    180         9.53646     180         
1 1 1 41 9  1  o 8  33.2686 8.74672 24.7824     19.3714  36.9647     19.9901  19.0822    91.7818     8.91607     271.782     
1 1 1 41 9  2  o 11 22.4656 7.2576  -0.980897   17.838   4.05321     18.6163  9.99889    179.924     8.51487     359.924     
1 1 1 41 9  3  o 17 25.2272 7.7707  11.034      17.7138  10.3615     19.1718  5.29188    241.422     3.18168     241.422     
1 1 1 41 9  4  o 19 47.0725 8.91894 51.3152     20.8029  70.2125     22.4537  36.1668    162.623     3.27675     162.623     
1 1 1 41 9  5  f 0  20.8438 6.92047 -7.62679    17.2089  -2.09282    19.3713  4.33031    39.4222     0           0           
1 1 1 41 9  6  o 1  20.0927 6.69569 -6.84888    16.8327  -5.99007    18.0797  6.2956     84.4439     12.5807     264.444     
1 1 1 41 9  7  o 12 30.8325 8.41285 13.6248     19.2067  35.889      19.3591  21.4838    114.193     1.46449     114.193     
1 1 1 41 9  8  o 7  23.8382 7.84856 -0.746284   27.3873  3.52507     18.7616  13.8596    89.3926     0.354743    89.3926     
1 1 1 41 9  9  o 11 27.5761 9.23628 15.9756     59.0638  11.1728     18.5329  8.76166    179.334     5.35964     179.334     
1 1 1 41 9  10 o 12 26.4779 8.30682 12.3413     20.6833  14.9315     23.2243  17.1465    235.326     1.93107     235.326     
1 1 1 41 9  11 o 8  27.7769 8.56094 10.1413     20.9841  26.0927     23.8754  19.3957    51.5545     7.9587      51.5545     
1 1 1 41 9  12 o 19 28.5912 9.30774 21.3261     21.0993  5.25008     54.012   19.4977    3.98552     8.83733     3.98552     
1 1 1 41 9  13 o 7  29.3647 9.33694 26.4915     29.4352  21.738      28.0401  21.0351    63.9434     7.43874     63.9434     
1 1 1 41 9  14 o 3  27.6003 8.58332 11.3161     20.6418  26.5216     25.0935  18.9373    308.318     7.45902     308.318     
1 1 1 41 9  15 o 13 34.0229 9.30124 41.2709     22.1077  33.7658     23.3973  21.3716    282.732     4.41671     102.732     
1 1 1 41 9  16 o 2  26.6321 8.29432 5.48965     20.8534  26.2371     22.7009  15.8627    290.087     1.60735     110.087     
1 1 1 41 9  17 o 12 24.2406 7.70861 23.1558     20.4909  -15.771     22.0299  13.7095    190.233     2.57891     190.233     
1 1 1 41 9  18 o 16 31.465  9.14667 32.3164     21.7427  33.9957     24.7503  21.6843    328.511     2.78119     328.511     
1 1 1 41 9  19 o 19 22.9148 7.55452 0.0537327   20.1647  7.76083     22.2253  9.94668    259.655     2.06198     259.655     
1 1 1 41 9  20 o 15 25.9555 8.25679 14.0085     21.4687  18.8906     23.5093  9.77817    319.688     4.6222      319.688     
1 1 1 41 9  21 o 1  39.1376 10.12   57.0732     25.2858  61.861      26.4576  28.7645    156.273     4.22233     156.273     
1 1 1 41 9  22 o 16 27.1912 8.42748 10.9622     20.7345  33.0344     23.5178  14.2727    353.753     5.7777      353.753     
1 1 1 41 9  23 o 13 18.169  6.31459 -13.0367    19.0437  -25.3187    21.283   3.92156    258.552     5.76886     78.552      
1 1 1 41 9  24 o 4  21.6302 7.29994 -8.68124    20.1531  8.36697     23.5476  7.68818    237.952     6.18505     57.9522     
1 1 1 41 9  25 o 4  34.6877 9.36935 62.5377     23.6789  29.5815     26.6633  25.7737    153.065     12.3183     153.065     
1 1 1 41 9  26 o 13 22.4307 7.47414 -7.58558    20.5672  16.0687     22.9395  6.52116    282.471     0.522769    102.471     
1 1 1 41 9  27 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 9  28 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 9  29 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 10 0  o 15 20.0599 9.0226  11.7071     19.8726  11.7071     19.8726  0.162746   359.995     0.0495216   359.995     
1 1 1 41 10 1  o 9  28.7114 8.40439 20.1296     19.8568  25.8054     19.7551  20.611     276.749     6.00574     276.749     
1 1 1 41 10 2  o 17 37.2907 10.0046 52.3411     30.524   49.6325     22.6691  25.2724    302.573     2.00295     122.573     
1 1 1 41 10 3  o 8  21.4166 7.34511 -26.4203    33.4737  -3.31338    18.2118  9.55264    338.852     1.13769     338.852     
1 1 1 41 10 4  o 2  25.5183 8.42541 32.1188     31.6823  -3.63485    18.7342  15.4682    345.172     1.40167     345.172     
1 1 1 41 10 5  o 15 25.1626 8.32977 23.3416     31.3768  0.319314    19.4269  12.7815    222.03      5.43232     222.03      
1 1 1 41 10 6  o 2  27.33   8.78932 -4.76897    34.693   28.9173     24.0897  12.0085    288.715     6.79432     288.715     
1 1 1 41 10 7  o 8  27.2105 8.95954 37.0643     34.196   3.35065     23.7015  16.9792    238.951     1.1453      238.951     
1 1 1 41 10 8  o 16 27.2503 9.74057 153.208     123.653  1.31017     23.1684  13.4671    317.542     6.09718     317.542     
1 1 1 41 10 9  o 14 35.6455 10.4371 63.9745     33.1926  45.9744     27.6549  28.3292    37.8178     10.9951     37.8178     
1 1 1 41 10 10 o 14 25.4572 8.39629 -2.08192    30.9964  19.1524     24.1172  14.4021    209.204     4.06266     209.204     
1 1 1 41 10 11 o 14 25.6557 8.50641 16.1868     30.8661  10.2064     24.2922  13.361     345.606     4.96072     165.606     
1 1 1 41 10 12 o 15 26.4663 9.28231 12.5737     30.5053  -9.67569    91.2893  13.7336    93.3005     4.71645     93.3005     
1 1 1 41 10 13 o 12 31.7832 9.81582 47.691      33.2025  38.5635     26.3762  17.5339    209.52      7.78027     29.5204     
1 1 1 41 10 14 o 14 32.7827 9.82624 32.937      31.9428  56.0171     27.3777  24.1757    169.539     10.6084     169.539     
1 1 1 41 10 15 o 5  25.8553 8.27499 11.2634     20.6998  24.7104     25.0724  14.5595    108.756     1.93262     108.756     
1 1 1 41 10 16 o 9  28.5208 8.74801 34.7619     22.606   19.0384     25.1057  12.9693    60.443      6.87518     60.443      
1 1 1 41 10 17 o 5  20.748  7.07532 -8.81282    20.1619  -1.27704    23.4899  3.23383    81.9493     0.0249089   261.949     
1 1 1 41 10 18 o 1  33.2371 9.60018 36.2656     22.7839  56.3923     27.7562  23.5302    94.7647     5.8804      94.7647     
1 1 1 41 10 19 o 19 27.9321 8.68904 18.5707     21.948   36.7672     25.1355  13.218     224.749     5.72291     224.749     
1 1 1 41 10 20 o 16 24.9972 8.10458 19.9695     21.3614  10.7769     25.6586  10.3568    276.158     2.08817     276.158     
1 1 1 41 10 21 o 2  22.2297 7.38555 17.2225     20.4727  -20.5725    24.9487  7.43491    329.413     1.51191     149.413     
1 1 1 41 10 22 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 10 23 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 10 24 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 10 25 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 11 0  o 14 21.5326 10.4548 14.2958     36.5209  14.2958     36.5209  9.92144    360         1.2084      180         
1 1 1 41 11 1  o 11 30.0183 9.87724 61.1488     36.7082  25.4519     36.4315  19.0938    81.9117     7.53779     81.9117     
1 1 1 41 11 2  o 2  25.0406 12.1117 10.8628     32.8119  0           0        9.18788    42.7896     5.23803     222.79      
1 1 1 41 11 3  o 8  27.6477 14.4322 326.351     353      0           0        7.8683     225.35      0.432118    45.3499     
1 1 1 41 11 4  o 14 30.4542 10.4594 27.0922     36.979   117.621     60.1887  17.9417    115.966     2.47123     295.966     
1 1 1 41 11 5  o 16 25.1002 8.46538 37.0332     33.3201  -4.967      23.5214  13.0865    140.114     0.335049    320.114     
1 1 1 41 11 6  o 2  27.0791 9.01159 25.9399     37.1627  25.1768     27.3055  15.5606    35.7985     2.48619     35.7985     
1 1 1 41 11 7  o 9  23.5614 8.56291 -77.5926    350.75   -9.50542    23.4258  7.59365    72.3069     1.25476     72.3069     
1 1 1 41 11 8  o 7  21.9756 7.64239 2.55718     35.2046  -9.65722    21.7991  8.59037    98.5633     2.49729     278.563     
1 1 1 41 11 9  o 5  22.5435 7.71955 -19.0742    35.0046  7.86331     22.7937  7.01826    271.643     0.616379    271.643     
1 1 1 41 11 10 o 15 27.1751 8.79842 -4.7684     37.0596  40.2624     25.6229  10.9166    18.7283     4.7253      18.7283     
1 1 1 41 11 11 o 1  26.4158 8.82548 12.6255     36.6113  30.0878     27.8882  12.1981    201.348     8.06174     21.3482     
1 1 1 41 11 12 o 15 26.6683 8.70815 3.3968      34.3209  35.7598     25.5427  13.5554    301.072     3.31914     301.072     
1 1 1 41 11 13 o 17 22.6672 7.81296 5.9784      34.0425  -1.86796    23.0874  8.82285    28.2919     3.63867     208.292     
1 1 1 41 11 14 o 9  23.5359 7.90006 -47.9244    34.411   28.308      24.7233  9.8871     172.376     3.21316     352.376     
1 1 1 41 11 15 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 11 16 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 11 17 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 11 18 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 11 19 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 0  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 1  x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 2  x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 3  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 4  x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 5  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 6  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 7  x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 8  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 9  x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 10 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 41 12 11 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 0  0  o 2  14.7867 6.92991 -2.6056     13.5238  -2.6056     13.5238  8.4849     360         29.3791     360         
1 1 1 42 0  1  o 10 22.176  7.65368 13.952      10.0306  13.952      10.0306  7.96895    240         2.91763     240         
1 1 1 42 0  2  o 19 34.9603 6.82777 27.2559     10.3445  27.2559     10.3445  18.7969    120         15.7545     300         
1 1 1 42 0  3  o 15 18.7255 7.48531 9.46852     10.7791  9.46852     10.7791  7.28264    180         4.41363     360         
1 1 1 42 0  4  o 18 15.3943 6.63115 4.70678     9.61674  4.70678     9.61674  2.23401    240         5.83981     60          
1 1 1 42 0  5  o 4  25.3267 8.08245 17.8588     11.0144  17.8588     11.0144  18.1222    300         0.850938    300         
1 1 1 42 0  6  o 4  13.6664 6.1918  1.40025     9.568    1.40025     9.568    0.0919992  180         0.809307    360         
1 1 1 42 0  7  o 18 55.2873 4.51717 57.9906     12.0815  57.9906     12.0815  56.685     240         29.0891     240         
1 1 1 42 0  8  o 1  37.9368 6.57392 31.0301     10.8238  31.0301     10.8238  29.1724    300         0.564135    300         
1 1 1 42 0  9  o 17 96.441  3.13537 168.547     15.0802  168.547     15.0802  80.7176    180         14.5477     180         
1 1 1 42 0  10 o 4  52.2586 4.47939 52.0195     11.2728  52.0195     11.2728  55.3533    240         31.1583     240         
1 1 1 42 0  11 o 15 27.9388 7.82593 20.44       10.5565  20.44       10.5565  22.7072    120         13.0869     120         
1 1 1 42 0  12 o 3  53.2304 4.51294 54.0108     11.5812  54.0108     11.5812  46.3571    180         11.781      180         
1 1 1 42 0  13 o 9  16.5242 6.92709 6.53121     9.94103  6.53121     9.94103  0.378961   240         0.231644    59.9995     
1 1 1 42 0  14 f 0  19.7239 7.4804  11.156      10.1575  11.156      10.1575  21.0075    120         0           0           
1 1 1 42 0  15 o 2  83.3004 3.61362 127.281     14.9537  127.281     14.9537  76.0827    180         25.796      180         
1 1 1 42 0  16 o 2  148.455 3.04556 398.361     22.6149  398.361     22.6149  144.293    240         63.5681     240         
1 1 1 42 0  17 o 8  42.1344 5.94866 36.6729     11.1486  36.6729     11.1486  0.244274   120.009     0.220598    120.009     
1 1 1 42 0  18 o 12 16.1796 6.86329 6.05719     9.97942  6.05719     9.97942  3.79566    360         9.81672     180         
1 1 1 42 0  19 o 3  16.4282 7.14372 5.53249     11.4011  5.53249     11.4011  1.26629    240         25.2877     240         
1 1 1 42 0  20 o 13 25.9436 8.25866 19.1944     11.4989  19.1944     11.4989  12.2718    120         14.1734     300         
1 1 1 42 0  21 o 9  22.555  8.45914 15.4314     12.8642  15.4314     12.8642  0.0554361  359.998     0.025282    359.998     
1 1 1 42 0  22 o 13 20.533  7.90065 12.4945     11.4887  12.4945     11.4887  2.4364     240         0.673552    240         
1 1 1 42 0  23 o 1  32.7744 8.70006 28.4279     13.3445  28.4279     13.3445  31.9659    300         19.3854     300         
1 1 1 42 0  24 o 1  24.9624 8.75442 18.9969     13.2088  18.9969     13.2088  15.7703    1.20525e-06 3.75128     180         
1 1 1 42 0  25 o 6  16.2568 7.28429 4.17155     12.8104  4.17155     12.8104  0.693269   59.9998     0.682067    240         
1 1 1 42 0  26 o 1  15.2213 7.01173 1.38418     12.9661  1.38418     12.9661  1.28928    120         3.34008     300         
1 1 1 42 0  27 o 8  66.993  4.48611 85.2048     14.7321  85.2048     14.7321  82.6586    3.98114e-06 65.1089     3.98114e-06 
1 1 1 42 0  28 o 6  61.0863 4.76806 71.8352     14.1431  71.8352     14.1431  44.9144    60          1.42057     240         
1 1 1 42 0  29 o 10 66.3502 4.60345 84.0217     14.9449  84.0217     14.9449  42.6914    300         13.5735     120         
1 1 1 42 0  30 o 12 12.3369 6.02791 -7.4141     12.6053  -7.4141     12.6053  5.34978    180         22.2329     180         
1 1 1 42 0  31 o 9  21.2268 8.29016 13.8414     12.8518  13.8414     12.8518  7.17603    60          13.6486     240         
1 1 1 42 0  32 o 14 15.3532 7.0718  1.68579     13.1846  1.68579     13.1846  2.24228    300         22.3477     300         
1 1 1 42 0  33 o 14 64.5961 5.04332 80.9733     15.8188  80.9733     15.8188  63.7926    180         31.9031     180         
1 1 1 42 0  34 o 8  23.4837 8.6816  17.3115     13.3978  17.3115     13.3978  10.2275    240         12.7853     60          
1 1 1 42 0  35 o 7  52.0387 7.7123  59.2843     17.7171  59.2843     17.7171  51.2982    300         25.8087     300         
1 1 1 42 0  36 o 18 22.1159 9.11031 15.1887     16.6858  15.1887     16.6858  6.10587    360         19.5778     180         
1 1 1 42 0  37 o 14 15.7574 7.40991 -0.362211   15.6809  -0.362211   15.6809  3.45666    240         4.25282     60          
1 1 1 42 0  38 o 13 19.7505 8.62307 10.2207     16.7707  10.2207     16.7707  2.70828    120         34.008      120         
1 1 1 42 0  39 o 18 36.5515 10.1504 38.6962     17.815   38.6962     17.815   23.4582    8.25702e-08 6.55291     180         
1 1 1 42 0  40 o 10 27.9155 10.0523 26.5603     17.6535  26.5603     17.6535  20.4034    240         1.60427     240         
1 1 1 42 0  41 o 17 14.9348 7.16391 -3.10978    16.0628  -3.10978    16.0628  1.8494     300         22.6027     300         
1 1 1 42 0  42 o 13 12.0001 6.0257  -15.6075    15.4042  -15.6075    15.4042  0.0413723  360         0.370526    360         
1 1 1 42 0  43 o 4  22.3603 9.32956 17.6234     17.8808  17.6234     17.8808  7.3984     60          1.84965     60          
1 1 1 42 0  44 f 0  76.5091 5.96584 119.95      22.1655  119.95      22.1655  31.1809    300         0           0           
1 1 1 42 0  45 o 12 53.189  8.95556 69.2655     20.7158  69.2655     20.7158  61.4602    5.17593e-06 47.9491     5.17593e-06 
1 1 1 42 0  46 o 19 13.5989 6.70109 -8.21418    16.4579  -8.21418    16.4579  1.42435    240         8.96847     240         
1 1 1 42 0  47 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 0  48 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 1  0  o 10 12.9071 5.95399 0.0508938   9.39569  0.0508938   9.39569  0.797056   180         12.2331     180         
1 1 1 42 1  1  o 4  19.0088 5.65872 -3.30247    9.52905  6.72942     9.48262  6.56858    253.155     6.28615     73.1553     
1 1 1 42 1  2  o 2  21.384  5.98952 9.00736     9.66868  3.7594      9.6058   8.62339    213.937     1.74345     213.937     
1 1 1 42 1  3  o 2  41.526  5.39789 37.7912     10.7475  31.4643     10.8499  29.0647    62.7661     2.0327      242.766     
1 1 1 42 1  4  o 16 27.7407 6.43629 14.8519     10.6008  16.723      10.1133  16.8558    296.475     2.67779     116.475     
1 1 1 42 1  5  f 0  43.0354 5.33532 31.2547     11.1298  43.1341     10.8556  21.1315    99.6763     0           0           
1 1 1 42 1  6  f 0  30.7983 6.42184 13.0917     11.4524  26.341      10.7415  32.874     224.458     0           0           
1 1 1 42 1  7  o 11 22.1977 5.99733 -1.95088    10.1863  14.5039     10.1325  11.3903    190.474     1.69152     10.474      
1 1 1 42 1  8  o 6  52.9596 4.65496 44.1567     11.6253  65.5507     12.1878  47.8089    113.367     18.018      113.367     
1 1 1 42 1  9  o 9  24.4624 6.34321 9.65594     10.2604  12.6708     10.1669  5.84229    327.808     21.5691     147.808     
1 1 1 42 1  10 o 7  65.9681 3.84804 78.0025     12.5748  86.1262     12.6149  52.1709    349.278     5.70183     349.278     
1 1 1 42 1  11 o 14 28.0185 6.44729 12.4488     10.6268  20.0361     10.5129  16.7833    33.902      3.58153     213.902     
1 1 1 42 1  12 o 5  35.1432 6.3506  24.6453     10.7715  27.984      11.6869  29.4482    323.234     11.6191     323.234     
1 1 1 42 1  13 f 0  54.6547 4.48811 57.8798     12.0897  57.7372     12.0393  32.3004    232.098     0           0           
1 1 1 42 1  14 o 16 25.4407 6.57785 16.3814     11.1901  8.29209     11.0965  12.3719    133.056     8.3196      313.056     
1 1 1 42 1  15 o 10 59.8639 4.49638 73.51       13.0128  65.4123     13.4598  50.782     358.34      13.1105     358.34      
1 1 1 42 1  16 o 15 74.2513 3.64349 108.581     13.4725  98.752      13.4483  75.0044    37.7307     39.8613     37.7307     
1 1 1 42 1  17 o 12 24.3059 5.94863 -3.74906    10.5318  21.3694     10.4958  5.12739    18.056      22.6939     198.056     
1 1 1 42 1  18 o 5  71.4227 3.77644 97.7191     13.4679  95.2857     13.3697  53.7042    8.20146     0.920594    8.20153     
1 1 1 42 1  19 o 5  28.7199 6.57218 19.8864     10.8089  15.6551     10.8946  18.3575    70.5495     0.497182    250.55      
1 1 1 42 1  20 o 15 24.8382 6.85964 12.0173     12.8909  10.6846     11.8099  13.0192    157.667     5.08693     157.667     
1 1 1 42 1  21 o 13 30.7065 7.23693 20.7833     12.2092  21.6648     13.9224  13.4404    147.164     15.3423     327.164     
1 1 1 42 1  22 o 13 39.5908 6.80015 40.059      14.024   29.7387     12.7938  25.5845    172.676     4.76034     352.676     
1 1 1 42 1  23 o 5  67.5354 5.12469 96.1269     15.9832  86.5965     17.8595  73.5188    160.216     49.6446     160.216     
1 1 1 42 1  24 o 18 56.3684 6.18629 69.8666     17.3237  64.5865     16.4979  39.3752    218.936     3.44299     38.9361     
1 1 1 42 1  25 o 18 75.1716 4.93081 112.288     18.3968  112.579     18.3297  58.5849    33.8905     6.23291     33.8905     
1 1 1 42 1  26 o 10 38.9115 7.4213  27.1856     15.2889  43.7707     15.0798  22.4947    267.338     9.35307     87.3383     
1 1 1 42 1  27 o 4  80.1817 4.9254  131.802     20.3152  124.583     18.8735  69.4176    154.053     20.968      154.053     
1 1 1 42 1  28 o 11 23.9163 7.082   4.1819      14.2968  12.3372     14.4962  11.0351    297.728     0.83472     117.728     
1 1 1 42 1  29 o 6  21.7785 6.63042 -2.45283    12.607   10.5355     14.0518  8.33577    199.045     2.84016     19.0447     
1 1 1 42 1  30 o 10 27.3148 7.5509  15.5066     14.9562  15.8739     15.0031  2.70923    196.387     31.5467     16.3868     
1 1 1 42 1  31 o 8  20.5163 6.26915 10.5798     12.6021  -9.72409    12.6191  7.5784     67.6497     2.23585     247.65      
1 1 1 42 1  32 o 18 27.1156 7.63363 13.9837     15.8063  16.0007     15.3576  16.8039    274.39      6.22339     274.39      
1 1 1 42 1  33 o 16 25.3348 7.35241 1.74351     15.7362  18.2327     15.3756  12.8476    112.616     5.45357     292.616     
1 1 1 42 1  34 o 14 24.9785 7.45153 7.99601     16.3022  11.5706     15.7183  11.311     57.9337     5.71241     57.9337     
1 1 1 42 1  35 o 5  38.0196 8.27007 15.8815     23.9857  52.9788     17.7604  32.0134    295.946     24.0157     295.946     
1 1 1 42 1  36 o 6  20.4396 6.88163 -6.90094    15.4906  -14.2857    23.2504  7.128      89.4741     0.697557    89.4741     
1 1 1 42 1  37 o 12 59.8209 7.09746 84.169      21.2138  79.8446     19.8304  41.6532    102.775     2.5083      282.775     
1 1 1 42 1  38 o 14 46.3209 8.11457 51.4566     18.6838  56.8652     18.8279  37.7607    93.6904     11.6858     93.6904     
1 1 1 42 1  39 o 12 19.6193 6.47605 0.843909    15.7604  -12.0205    16.0079  6.90469    200.936     6.1391      20.9357     
1 1 1 42 1  40 o 19 46.4176 8.16901 54.0062     18.5067  58.4323     19.3532  44.5803    75.3089     29.2557     75.3089     
1 1 1 42 1  41 o 1  24.6404 7.41955 -1.51071    16.7489  22.1763     17.1144  10.1918    241.447     3.4421      241.447     
1 1 1 42 1  42 o 7  25.6024 7.64574 23.1421     17.2226  4.77207     17.8157  10.0751    120.445     3.66655     120.445     
1 1 1 42 1  43 o 19 17.2359 5.92664 -18.5232    16.1149  -11.1946    16.4254  1.85736    20.8805     9.16586     200.881     
1 1 1 42 1  44 o 8  26.6803 7.78729 29.1573     17.8193  6.7245      17.646   6.57933    70.2416     2.67391     70.2416     
1 1 1 42 1  45 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 1  46 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 2  0  o 12 10.8756 5.29612 -5.83775    9.53506  -5.83775    9.53506  3.2689     180         14.6956     180         
1 1 1 42 2  1  o 15 21.4576 6.16288 7.53856     9.97801  4.66159     10.8605  6.30347    325.116     14.7952     145.116     
1 1 1 42 2  2  o 12 55.9276 4.49679 60.2354     12.799   61.003      11.9265  45.6338    115.151     8.14854     115.151     
1 1 1 42 2  3  f 0  23.388  5.88712 18.5606     10.0035  -2.42596    10.0007  24.2347    226.975     0           0           
1 1 1 42 2  4  o 1  56.1938 4.51974 62.2574     12.0404  60.2863     12.9138  54.0085    39.2876     25.311      39.2876     
1 1 1 42 2  5  f 0  41.568  5.63705 39.0675     11.2426  31.9469     11.3551  29.0684    317.256     0           0           
1 1 1 42 2  6  o 7  34.0832 6.37645 28.5923     11.265   21.4311     10.9937  20.1718    314.674     7.89936     134.674     
1 1 1 42 2  7  o 19 34.556  6.22755 32.7356     11.1742  18.5954     10.9871  22.9549    322.755     2.69369     142.755     
1 1 1 42 2  8  o 13 18.5718 5.66866 -8.60599    10.2412  7.14664     10.2384  6.19317    135.321     2.7164      315.321     
1 1 1 42 2  9  o 3  32.4798 6.41284 17.8596     11.065   27.7888     11.0176  22.8261    68.6866     1.2354      68.6866     
1 1 1 42 2  10 o 16 25.862  6.46796 13.0448     10.3678  14.2078     10.5718  16.9202    183.834     5.25674     183.834     
1 1 1 42 2  11 o 17 20.7457 6.06468 6.26199     10.3931  4.12863     10.152   6.53485    318.867     12.2817     138.867     
1 1 1 42 2  12 o 16 31.594  6.44859 20.1642     10.8788  23.264      10.7274  17.8866    95.9376     8.09573     275.938     
1 1 1 42 2  13 o 17 48.4186 5.44029 37.2211     12.689   59.1552     12.1294  27.6338    194.008     16.2099     14.0082     
1 1 1 42 2  14 o 4  28.3429 6.62628 12.6003     10.7649  22.0072     11.5158  19.9464    249.652     10.2063     249.652     
1 1 1 42 2  15 o 9  24.2268 6.56608 11.8672     11.2838  10.0171     11.0526  1.75106    202.356     37.155      202.356     
1 1 1 42 2  16 o 17 36.7976 6.86989 35.709      12.895   24.9776     13.1672  22.907     230.877     6.16514     50.8768     
1 1 1 42 2  17 o 1  67.9508 4.64431 72.3929     15.2412  110.397     15.2643  47.0392    213.366     7.34152     33.3663     
1 1 1 42 2  18 o 9  81.7775 4.28691 135.942     17.9619  122.815     16.9287  77.5946    167.873     33.2871     167.873     
1 1 1 42 2  19 o 6  73.6284 5.03094 97.1724     19.056   119.462     16.9598  61.3813    229.561     13.2857     229.561     
1 1 1 42 2  20 o 6  30.1509 7.21479 24.412      13.0797  16.5431     13.2065  17.8141    34.5039     4.16886     214.504     
1 1 1 42 2  21 o 12 21.3803 6.54964 0.628336    12.1208  6.85217     13.7769  3.89542    288.48      0.686298    288.48      
1 1 1 42 2  22 o 13 42.0749 6.72932 38.6337     13.8275  39.9965     13.8855  29.48      20.6246     0.520545    200.624     
1 1 1 42 2  23 o 17 16.3586 5.46638 -13.2406    11.6429  -5.44527    12.0278  1.76235    166.135     4.11181     346.135     
1 1 1 42 2  24 o 4  33.3214 7.14101 32.402      13.3382  18.9732     13.3478  21.0553    118.31      2.36694     298.31      
1 1 1 42 2  25 o 4  30.4114 7.28738 29.4921     14.2487  12.8847     13.2711  11.8878    276.864     17.3211     96.8637     
1 1 1 42 2  26 o 14 29.8112 7.42186 15.7157     14.7285  24.6257     13.4945  19.7847    15.7403     3.70966     15.7403     
1 1 1 42 2  27 o 5  28.4387 7.35537 15.3163     14.6117  20.4801     13.0904  18.6517    319.093     5.16655     319.093     
1 1 1 42 2  28 o 8  38.3668 8.14402 31.3015     15.6276  42.2056     18.2531  31.9456    96.568      13.6444     96.568      
1 1 1 42 2  29 o 16 26.8554 7.89782 17.408      17.4232  9.03383     18.0314  16.3653    4.78115     1.97115     4.78114     
1 1 1 42 2  30 f 0  33.9743 8.80091 30.7226     19.8561  29.1694     19.3059  18.6439    167.728     0           0           
1 1 1 42 2  31 o 13 31.846  8.78638 30.3992     20.0353  19.7916     21.0857  22.0968    41.8701     3.34057     41.8701     
1 1 1 42 2  32 o 19 24.9753 7.59308 10.6221     15.5948  7.28533     18.9585  6.99192    120.598     3.89541     120.598     
1 1 1 42 2  33 o 17 23.2225 7.32375 -13.033     15.6331  17.8222     19.793   6.48821    224.433     2.98632     224.433     
1 1 1 42 2  34 o 7  33.5268 8.5124  35.679      19.6204  24.3466     16.8478  14.5604    19.316      11.1129     19.316      
1 1 1 42 2  35 o 2  54.6427 7.37563 66.2919     18.9053  74.5294     20.025   41.9509    248.742     5.8509      248.742     
1 1 1 42 2  36 o 3  22.5312 7.12925 8.96708     16.0698  -2.69155    17.6725  7.5621     209.52      12.7657     29.5195     
1 1 1 42 2  37 o 3  22.123  7.02186 -4.89579    17.254   9.74329     15.9778  8.77835    337.846     8.09105     157.846     
1 1 1 42 2  38 o 14 27.0714 7.84053 14.8852     17.1917  20.5832     16.872   16.1323    234.158     1.46372     234.158     
1 1 1 42 2  39 o 9  22.6395 7.18119 13.4539     17.8335  -2.03421    16.2594  9.48872    14.2962     4.46055     194.296     
1 1 1 42 2  40 o 10 40.7686 8.75276 52.9411     20.0332  46.2308     18.8918  31.9317    273.503     10.8666     273.503     
1 1 1 42 2  41 o 13 23.3276 7.33575 16.4328     17.7608  0.881099    17.27    9.35555    316.294     2.99657     136.294     
1 1 1 42 2  42 o 4  27.0087 7.78205 2.44319     18.9031  32.4348     17.7111  13.66      153.919     1.05394     333.919     
1 1 1 42 2  43 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 2  44 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 3  0  o 14 62.4388 4.12218 73.4664     12.6254  73.4664     12.6254  65.1157    180         34.475      180         
1 1 1 42 3  1  o 3  63.0415 4.20084 78.8296     13.4577  74.5191     12.7749  48.5153    35.3239     2.39481     35.3239     
1 1 1 42 3  2  o 14 19.0835 5.84981 3.28817     10.6819  0.295975    10.0076  2.11822    134.182     29.3555     134.182     
1 1 1 42 3  3  f 0  38.5164 6.14422 33.7661     11.914   29.7417     11.2501  31.5188    155.763     0           0           
1 1 1 42 3  4  o 9  24.4923 6.50881 16.9127     10.9501  3.65465     12.1177  14.5819    7.09826     3.9597      7.09825     
1 1 1 42 3  5  o 18 43.783  5.79999 40.2466     11.9761  39.7766     12.5331  32.445     129.231     1.16817     129.231     
1 1 1 42 3  6  o 1  17.5903 5.63084 -0.95425    10.5694  -4.21253    10.8116  4.62216    235.977     3.57613     55.9766     
1 1 1 42 3  7  o 7  24.5354 6.62024 8.85331     11.9712  13.5875     10.9292  14.1782    128.501     0.518001    308.501     
1 1 1 42 3  8  o 5  33.3587 6.57161 17.4982     11.794   31.7873     11.7756  28.6026    291.273     16.9173     291.273     
1 1 1 42 3  9  o 11 24.6755 6.52875 7.3258      11.1227  15.8161     11.1214  13.7955    148.727     2.4743      328.727     
1 1 1 42 3  10 o 10 30.4201 6.74497 13.1744     12.6748  27.0237     11.5212  3.22256    153.186     37.246      333.186     
1 1 1 42 3  11 o 17 25.539  6.78881 15.6687     12.517   10.5952     11.1041  15.6269    339.757     4.85664     339.757     
1 1 1 42 3  12 o 12 54.5689 5.40373 55.1019     14.1613  66.6919     14.4781  48.9684    342.364     17.9847     342.364     
1 1 1 42 3  13 o 12 53.7332 5.4841  66.3284     14.2688  52.4014     14.2042  41.4726    23.3542     3.75024     23.3542     
1 1 1 42 3  14 o 9  24.7507 6.82799 0.629937    12.2221  20.0883     13.7014  3.18021    189.438     27.3612     9.43844     
1 1 1 42 3  15 o 16 49.4768 5.95666 50.7153     14.1341  52.4911     14.3474  31.464     137.778     9.75546     317.778     
1 1 1 42 3  16 o 16 19.7498 6.19642 1.44347     11.771   -0.198783   12.7042  3.81893    27.591      15.6445     207.591     
1 1 1 42 3  17 o 15 82.0594 4.22273 119.33      17.0591  141.956     17.3379  66.444     12.7863     9.86919     12.7863     
1 1 1 42 3  18 o 2  26.6175 7.28715 14.9125     14.5377  14.4439     13.1706  15.9128    297.789     3.80066     297.789     
1 1 1 42 3  19 o 5  55.6308 5.44405 64.5853     14.8266  62.8318     14.7142  43.1424    20.5739     4.8015      20.5739     
1 1 1 42 3  20 o 11 30.2413 6.9084  8.27109     13.1475  31.7009     13.2156  16.6616    323.353     6.81662     143.353     
1 1 1 42 3  21 o 1  55.2458 5.65016 54.0717     14.9521  73.5688     15.0492  45.6487    87.5885     11.026      87.5885     
1 1 1 42 3  22 f 0  43.569  6.59573 50.8641     14.0001  33.8718     14.0558  25.2368    294.477     0           0           
1 1 1 42 3  23 o 8  32.6063 7.39682 19.2844     13.7212  30.9812     14.1888  24.3369    342.463     7.43701     342.463     
1 1 1 42 3  24 o 4  25.2569 7.00365 16.3008     13.0453  8.08318     13.2059  10.9814    167.201     10.1232     347.201     
1 1 1 42 3  25 o 1  28.9772 7.15015 27.1649     13.2478  8.57291     14.4076  13.4821    270.98      12.0513     90.9799     
1 1 1 42 3  26 o 3  37.5717 7.72817 51.6803     17.0989  16.3139     17.6244  14.3663    349.17      24.8791     169.17      
1 1 1 42 3  27 o 10 25.3708 7.49472 15.0019     15.8758  6.21443     16.329   14.1157    256.801     6.17828     256.801     
1 1 1 42 3  28 o 12 25.6917 7.656   10.619      16.306   12.1323     17.3346  15.2349    59.4714     6.86051     59.4714     
1 1 1 42 3  29 o 16 44.1817 8.44067 39.2707     20.6387  60.6246     18.9929  42.6379    344.086     26.2453     344.086     
1 1 1 42 3  30 o 16 44.3255 8.73628 42.7077     22.8325  61.0927     19.2376  37.6294    357.642     13.9171     357.642     
1 1 1 42 3  31 o 3  25.5572 7.85369 12.1498     20.0664  9.38667     17.3553  13.4649    180.975     4.8177      0.974937    
1 1 1 42 3  32 o 8  34.0472 8.9865  49.1025     22.2008  13.6841     23.0959  18.7494    349.803     8.87188     169.803     
1 1 1 42 3  33 o 18 27.2077 8.47329 4.28661     24.5397  22.212      21.7999  16.2096    181.638     7.72517     181.638     
1 1 1 42 3  34 o 5  26.8932 8.47934 15.0175     21.4968  13.7648     25.0471  16.2185    100.976     1.22239     100.976     
1 1 1 42 3  35 o 12 20.6147 6.92265 -3.38319    16.4683  -10.8421    22.6301  6.60536    52.0381     9.88818     232.038     
1 1 1 42 3  36 o 10 34.1483 9.07174 39.9863     19.3174  33.9824     24.2936  22.8031    309.682     1.65514     309.682     
1 1 1 42 3  37 o 14 26.9415 7.95755 34.5927     19.2206  -18.1517    25.1886  14.1938    160.282     3.34331     340.282     
1 1 1 42 3  38 o 18 38.3296 8.97203 47.8072     19.3868  45.4189     20.9389  24.771     21.6146     1.37678     201.615     
1 1 1 42 3  39 o 5  22.8185 7.35401 7.50879     18.2803  6.82892     18.8655  8.55569    214.818     3.24961     34.8177     
1 1 1 42 3  40 o 18 22.8917 7.3442  15.1233     18.185   -1.77754    19.2795  5.40509    107.205     0.0197064   287.205     
1 1 1 42 3  41 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 3  42 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 4  0  o 1  43.1437 6.76422 40.2942     12.7852  40.2942     12.7852  30.9799    180         4.31585     8.77981e-06 
1 1 1 42 4  1  o 1  38.6994 6.65069 32.2443     12.8605  34.3383     12.6908  35.1429    186.301     18.0828     186.301     
1 1 1 42 4  2  o 5  31.7952 7.00519 21.1462     12.3004  25.0111     12.4803  20.5965    28.7727     2.09166     208.773     
1 1 1 42 4  3  o 3  29.8862 7.005   23.0573     12.3827  17.2543     12.2464  20.4708    348.634     2.18424     348.634     
1 1 1 42 4  4  o 14 73.9438 4.30789 105.958     15.4722  106.613     16.1628  67.4049    193.304     23.5743     193.304     
1 1 1 42 4  5  o 2  51.1686 5.71512 58.6945     14.6748  50.5872     13.6633  42.8934    295.167     10.6923     295.167     
1 1 1 42 4  6  o 4  27.4472 7.06336 17.7767     13.0091  15.0042     12.1618  17.4542    60.513      7.73264     60.513      
1 1 1 42 4  7  o 11 24.0593 6.656   -3.76526    12.7098  19.9457     13.073   9.31145    191.688     12.2516     11.6879     
1 1 1 42 4  8  o 2  20.4003 6.30943 7.24525     12.3235  -5.11214    12.9498  5.42584    133.592     0.0137815   133.591     
1 1 1 42 4  9  o 9  26.5814 7.14549 20.3513     13.8577  8.66805     13.0025  9.0514     228.048     4.98006     228.048     
1 1 1 42 4  10 o 1  31.0254 7.04401 9.0473      13.7656  33.5116     13.7143  21.9514    347.924     3.83835     347.924     
1 1 1 42 4  11 o 18 33.9629 8.08817 30.0955     16.6573  27.0997     15.9353  26.1646    190.765     8.80912     190.765     
1 1 1 42 4  12 o 4  17.9553 5.93152 1.0488      14.1945  -17.1454    12.4583  1.73633    134.357     1.07739     314.357     
1 1 1 42 4  13 o 2  63.8197 5.67997 76.4586     16.6404  93.6246     18.909   50.2182    261.813     5.44392     261.813     
1 1 1 42 4  14 o 14 19.5791 6.14578 7.48325     12.5721  -11.2024    12.7942  5.92816    332.067     5.99888     152.067     
1 1 1 42 4  15 o 13 31.171  7.66939 23.182      13.6653  23.2306     15.794   17.2265    214.773     7.32832     34.773      
1 1 1 42 4  16 o 4  19.2022 6.14346 -4.03097    12.6397  0.960871    12.7815  4.77791    115         2.7077      295         
1 1 1 42 4  17 o 4  42.6379 7.68292 47.6677     17.2147  39.4735     15.7481  38.8474    243.41      20.0049     243.41      
1 1 1 42 4  18 o 14 34.4349 7.15356 17.4297     13.4123  38.437      14.2787  26.7016    98.5501     8.02303     98.5501     
1 1 1 42 4  19 o 3  42.6024 6.91085 38.0061     14.1061  44.4344     14.8016  27.8893    208.802     5.44178     28.802      
1 1 1 42 4  20 o 6  29.8343 7.73144 19.2707     13.9448  22.777      16.2835  19.7115    213.136     1.31131     213.136     
1 1 1 42 4  21 o 14 19.9059 6.26522 -5.81898    12.4294  5.78832     13.1582  6.92125    114.664     8.00879     294.664     
1 1 1 42 4  22 o 6  26.9784 7.31666 1.64683     15.8615  24.5878     14.5905  18.0623    265.854     5.3241      265.854     
1 1 1 42 4  23 o 5  27.7678 7.78839 19.26       15.7474  13.6017     16.8145  15.8008    268.011     4.58197     88.0112     
1 1 1 42 4  24 o 17 19.8699 6.49645 -1.02644    15.0565  -8.20871    15.56    6.53344    120.846     1.00632     120.846     
1 1 1 42 4  25 o 9  48.7285 8.39952 44.1588     21.596   76.8659     20.5578  32.4492    123.814     5.72529     303.814     
1 1 1 42 4  26 o 10 43.5511 8.45701 39.0981     19.2848  59.1432     19.565   36.1985    211.115     11.3758     211.115     
1 1 1 42 4  27 o 7  26.7454 7.85716 20.5497     17.983   8.09201     17.1323  17.7945    25.5332     5.18246     25.5331     
1 1 1 42 4  28 o 12 25.3343 7.65614 13.7297     17.3923  8.97373     17.1337  12.6469    200.136     6.42236     200.136     
1 1 1 42 4  29 o 19 20.8021 6.80246 1.59135     16.7118  -6.86979    16.8659  8.68764    196.375     6.15807     16.3751     
1 1 1 42 4  30 o 19 40.2344 8.60948 36.8933     19.4035  52.5333     19.0933  37.3543    214.142     22.9801     214.142     
1 1 1 42 4  31 o 11 28.4668 8.02181 4.16789     18.2401  33.3784     18.7928  19.6426    62.4131     8.797       62.4131     
1 1 1 42 4  32 o 12 25.1049 7.87181 0.416436    23.3152  17.2532     18.1526  12.6592    151.7       4.8166      331.7       
1 1 1 42 4  33 o 7  26.1855 8.25991 22.7936     23.1577  6.89334     21.012   12.9592    331.687     5.19939     331.687     
1 1 1 42 4  34 o 14 29.4171 8.79596 26.2567     25.5082  27.3343     19.9671  18.7826    144.863     5.00731     144.863     
1 1 1 42 4  35 o 17 19.8862 6.77629 -14.0895    23.2802  -5.49107    17.32    4.13226    64.3407     1.33794     244.341     
1 1 1 42 4  36 f 0  29.7749 8.87507 25.2599     26.1343  33.6958     20.8356  20.1723    204.66      0           0           
1 1 1 42 4  37 o 6  22.7613 7.65413 12.7761     23.7209  -12.8415    24.9347  6.10138    359.161     0.272255    179.161     
1 1 1 42 4  38 o 17 27.9351 8.73338 4.16253     22.9007  45.566      26.5569  14.006     176.29      2.37105     176.29      
1 1 1 42 4  39 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 4  40 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 5  0  o 17 31.5644 9.02363 28.1664     13.9411  28.1664     13.9411  25.111     2.23727e-05 2.73036     2.23727e-05 
1 1 1 42 5  1  f 0  20.7387 6.45881 3.87566     13.5202  0.973274    12.5585  16.6086    191.715     0           0           
1 1 1 42 5  2  o 15 30.3807 7.5941  19.7097     13.457   24.2394     15.3966  14.0479    271.792     9.01388     271.792     
1 1 1 42 5  3  o 4  20.8485 6.43795 2.66094     12.5577  3.66953     12.8715  5.85428    14.4389     0.283335    194.439     
1 1 1 42 5  4  o 5  49.5299 6.98949 47.3388     17.4102  63.9998     15.926   46.1613    25.9188     21.4659     25.9188     
1 1 1 42 5  5  o 1  25.7629 7.09033 15.332      13.0281  11.6616     13.4037  10.0629    125.875     13.4945     305.875     
1 1 1 42 5  6  o 18 23.8829 7.07921 9.08424     13.4562  8.82336     15.1029  11.6235    293.619     2.91041     113.619     
1 1 1 42 5  7  o 3  38.8786 7.6222  30.5785     14.3661  42.751      16.5041  23.5273    322.395     8.42421     142.395     
1 1 1 42 5  8  o 13 22.3114 6.71264 10.7954     13.4183  0.457882    13.3525  7.06266    102.243     13.2221     282.243     
1 1 1 42 5  9  o 16 56.3768 6.10754 72.1139     17.2104  64.1975     16.2043  34.841     16.8441     14.4937     196.844     
1 1 1 42 5  10 o 16 53.9222 6.50302 74.7251     16.9963  53.3606     16.6131  49.8884    255.621     21.2402     255.621     
1 1 1 42 5  11 o 13 56.3335 6.2171  68.6803     17.8617  68.0575     16.0117  35.7555    72.53       12.503      252.53      
1 1 1 42 5  12 o 19 33.9248 7.87631 31.5086     14.6008  24.9953     16.9789  25.0028    80.0893     4.71233     80.0892     
1 1 1 42 5  13 o 8  33.1382 7.91009 26.761      14.5089  27.5463     16.7471  22.8058    98.5199     15.5935     98.5199     
1 1 1 42 5  14 o 19 21.4818 6.64199 4.17181     13.5266  3.20212     13.6217  9.32355    326.485     0.0220373   146.485     
1 1 1 42 5  15 o 7  21.9941 6.60644 13.1377     13.3936  -5.50827    13.4549  7.87572    346.836     2.24808     346.836     
1 1 1 42 5  16 o 5  31.1116 7.8675  28.3679     16.3016  18.618      14.9768  19.7026    128.312     2.52802     308.312     
1 1 1 42 5  17 o 5  24.3253 7.05691 1.29734     14.6544  16.5426     14.0631  5.41438    103.616     22.1997     283.616     
1 1 1 42 5  18 o 2  26.3488 7.44172 11.0448     15.0609  16.9086     14.8135  16.9085    339.175     7.70097     339.175     
1 1 1 42 5  19 o 6  19.4151 6.48988 -12.4222    17.2535  -6.62897    16.1653  6.79966    215.423     0.236525    215.423     
1 1 1 42 5  20 o 13 28.9037 8.441   11.5307     18.711   26.2102     21.2309  20.5687    236.967     10.4628     236.967     
1 1 1 42 5  21 o 12 28.7795 8.13622 9.60774     19.1682  26.4204     17.8056  12.5486    191.641     14.3962     11.6414     
1 1 1 42 5  22 o 5  59.2612 7.93512 77.7526     22.9053  91.8923     22.4004  44.2435    98.2919     1.00048     98.2919     
1 1 1 42 5  23 o 8  23.7627 7.49668 -2.58685    19.0377  11.5048     17.9838  12.9752    300.401     2.26203     120.401     
1 1 1 42 5  24 o 8  23.553  7.39355 -3.8096     17.6715  13.5355     17.9549  13.0397    224.908     1.19545     44.9076     
1 1 1 42 5  25 f 0  24.0764 7.57653 18.5587     19.6292  -9.37344    18.7122  16.3293    58.2513     0           0           
1 1 1 42 5  26 o 14 27.4481 8.13941 21.8788     19.0076  12.4985     19.0512  17.1743    57.6672     0.0458065   237.666     
1 1 1 42 5  27 o 16 27.8963 8.12418 28.1308     19.1718  8.66646     18.61    19.194     171.225     5.82265     171.225     
1 1 1 42 5  28 o 16 23.1906 7.40178 12.3202     19.0914  -1.45149    17.6341  0.739465   12.4149     0.343433    12.4149     
1 1 1 42 5  29 o 15 18.895  6.42534 -19.5981    17.7646  -4.57529    18.0692  1.52559    323.74      19.8775     143.74      
1 1 1 42 5  30 f 0  26.9189 8.12583 17.8208     19.5599  19.4184     19.2023  18.5329    270.742     0           0           
1 1 1 42 5  31 o 6  21.7973 7.12863 7.82727     18.4563  -3.85845    18.5229  8.70515    166.753     1.55224     346.753     
1 1 1 42 5  32 o 19 25.6875 7.9647  18.2497     19.3086  14.1719     20.0809  11.1035    16.4796     8.95371     196.48      
1 1 1 42 5  33 o 8  21.6212 7.19856 -26.359     26.0352  10.8911     18.5504  7.53793    177.769     3.97457     357.769     
1 1 1 42 5  34 o 15 34.8036 9.12493 37.0676     21.5688  48.6594     21.3028  20.7583    321.821     13.3207     321.821     
1 1 1 42 5  35 o 11 22.4395 7.35595 7.41666     19.9622  4.3441      19.4457  2.88554    71.7253     0.0251108   71.7251     
1 1 1 42 5  36 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 5  37 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 6  0  o 11 36.7332 9.83397 37.8283     16.9814  37.8283     16.9814  35.3945    180         14.7673     180         
1 1 1 42 6  1  o 14 22.3871 6.88418 -6.02063    15.42    12.0895     14.7229  1.58075    330.503     0.633752    330.503     
1 1 1 42 6  2  o 13 21.8632 6.9691  -0.0430553  15.2526  2.79483     16.9546  6.08502    304.778     15.8051     124.778     
1 1 1 42 6  3  o 12 49.3992 7.3278  42.9022     15.6058  72.3213     19.7513  44.2183    232.107     16.5575     232.107     
1 1 1 42 6  4  o 9  25.154  7.18052 20.2437     14.4129  -1.70982    16.02    14.1398    184.662     2.96156     4.66239     
1 1 1 42 6  5  o 18 21.9502 6.7431  -8.23835    13.0851  14.3311     15.5506  9.93573    202.46      5.92813     22.4601     
1 1 1 42 6  6  o 15 32.318  7.61714 9.58589     14.5371  40.702      17.0027  20.2166    107.885     4.40481     287.885     
1 1 1 42 6  7  o 10 36.8361 8.48396 34.0162     18.1508  36.6559     17.8305  27.1333    249.217     2.85078     249.217     
1 1 1 42 6  8  o 15 29.8794 7.25341 -4.37565    14.3107  40.9674     17.1685  22.3538    348.601     6.34794     348.601     
1 1 1 42 6  9  o 4  62.0783 6.46853 80.869      18.0869  87.5571     20.8924  48.0612    175.706     2.90117     175.706     
1 1 1 42 6  10 o 15 20.6432 6.6435  -14.0771    14.8269  7.81704     16.1668  9.45201    187.791     3.01288     7.7908      
1 1 1 42 6  11 o 7  23.9171 7.09293 11.3857     14.169   6.45646     14.6533  1.44792    97.3427     36.5703     97.3427     
1 1 1 42 6  12 o 8  28.4429 7.01354 -5.17819    14.3929  34.9217     15.363   21.3231    161.059     6.76161     161.059     
1 1 1 42 6  13 o 3  24.4389 7.18397 3.35563     14.314   16.1556     15.2465  15.031     74.2382     0.702428    74.2381     
1 1 1 42 6  14 o 8  17.9102 5.92822 1.71859     13.7972  -22.3821    13.9402  5.99049    174.794     1.42918     354.794     
1 1 1 42 6  15 f 0  26.1413 7.82183 -16.2639    27.3737  21.0154     15.7692  9.67279    296.445     0           0           
1 1 1 42 6  16 o 17 32.5457 8.58471 25.5849     19.193   30.6089     18.5456  24.2882    267.646     5.20026     267.646     
1 1 1 42 6  17 o 15 45.3502 8.70929 48.1085     20.317   61.1318     20.5803  28.4409    341.567     9.37525     161.567     
1 1 1 42 6  18 o 10 31.3018 8.65631 20.1885     21.2714  31.1952     19.0944  24.6222    123.379     11.2485     123.379     
1 1 1 42 6  19 o 9  24.5474 7.58228 22.7108     19.6692  -10.022     17.477   13.7224    85.1108     2.90113     265.111     
1 1 1 42 6  20 o 17 35.0913 9.48664 21.8234     23.004   54.4342     25.4107  26.8355    278.874     6.77664     278.874     
1 1 1 42 6  21 o 1  34.7105 9.13916 36.3193     22.423   35.9891     20.228   26.2372    28.2068     5.90927     28.2068     
1 1 1 42 6  22 o 6  28.4158 8.35223 15.4047     21.1159  24.4547     18.838   18.3485    10.9062     0.305863    10.9061     
1 1 1 42 6  23 o 8  61.2637 8.42704 102.273     26.7134  93.8838     23.1126  45.1444    4.08358     0.261268    184.084     
1 1 1 42 6  24 o 7  34.4136 9.05364 38.7627     22.0887  35.2496     19.6747  20.1071    330.998     7.27585     150.998     
1 1 1 42 6  25 o 15 20.3015 6.7761  7.16271     19.0904  -20.238     17.3413  7.86945    186.206     5.31659     6.20626     
1 1 1 42 6  26 o 4  20.549  6.86295 5.04633     19.5436  -13.3478    17.4882  6.72507    207.016     0.179612    27.0161     
1 1 1 42 6  27 o 10 25.454  7.94243 8.26534     20.5222  20.2705     19.6745  13.7256    335.183     3.26354     335.183     
1 1 1 42 6  28 o 6  22.5948 7.34401 8.70019     20.1989  3.04988     17.7857  6.79942    86.72       1.27737     86.72       
1 1 1 42 6  29 f 0  23.8248 7.6865  16.1808     21.7551  4.37512     18.7971  11.3839    228.01      0           0           
1 1 1 42 6  30 o 8  23.1331 7.58927 16.4763     21.905   -3.06421    20.4111  9.25598    344.643     5.45369     164.643     
1 1 1 42 6  31 o 5  27.2553 8.32435 13.1607     22.5423  30.8727     20.5581  13.5971    320.055     3.88855     320.055     
1 1 1 42 6  32 o 7  36.0605 9.57283 56.4612     24.6781  44.3416     22.1924  25.0825    148.499     4.92992     148.499     
1 1 1 42 6  33 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 6  34 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 7  0  f 0  22.6265 9.60318 16.7361     19.5583  16.7361     19.5583  6.19271    180         0           0           
1 1 1 42 7  1  o 15 45.3907 8.86173 62.1937     20.5009  48.274      21.7951  28.2143    148.048     10.5964     328.048     
1 1 1 42 7  2  o 18 36.0346 8.86238 36.3672     19.4182  35.3822     19.792   29.6896    276.608     10.1507     276.608     
1 1 1 42 7  3  o 10 43.9029 9.05043 50.8365     20.5649  54.6322     21.6975  40.5882    41.7137     19.233      41.7137     
1 1 1 42 7  4  o 4  20.3842 6.74445 -5.59317    16.5114  -5.364      17.8395  9.38249    73.2113     0.489338    73.2113     
1 1 1 42 7  5  o 6  29.2517 8.36834 15.7072     18.1024  25.9716     20.0455  14.4352    54.2828     11.7469     234.283     
1 1 1 42 7  6  o 3  20.9517 6.89551 3.45283     17.8619  -14.1728    17.8823  9.21201    182.754     6.66797     2.7539      
1 1 1 42 7  7  o 3  21.8684 7.1239  -10.4092    17.7723  6.50236     18.7382  11.4078    104.965     1.93579     284.965     
1 1 1 42 7  8  o 19 29.6849 8.42956 19.3383     18.8444  24.9986     19.5065  16.7199    263.111     7.33784     83.111      
1 1 1 42 7  9  o 2  38.5339 9.01863 32.4027     20.317   52.2343     21.2055  30.2942    36.6782     6.42648     36.6782     
1 1 1 42 7  10 o 17 21.2083 6.97774 5.4285      18.3569  -15.7563    18.4053  9.90639    96.8839     5.04004     276.884     
1 1 1 42 7  11 o 13 30.216  8.43161 9.71087     20.6418  34.7631     19.5561  23.2902    184.74      12.4564     184.74      
1 1 1 42 7  12 o 13 54.4773 10.6927 41.0353     24.9079  172.739     41.2738  52.3292    13.6872     26.3562     13.6872     
1 1 1 42 7  13 o 5  36.19   9.42005 33.1298     21.5463  48.0024     23.6536  31.4324    6.38649     16.2523     6.38649     
1 1 1 42 7  14 o 15 25.0725 8.30624 16.9328     28.2852  -9.39258    23.6908  14.5191    338.027     1.40973     158.027     
1 1 1 42 7  15 o 16 25.8455 8.19293 14.888      19.9001  5.68192     25.014   12.3836    183.275     6.6881      183.275     
1 1 1 42 7  16 o 2  27.1212 8.26572 26.1693     20.2301  1.96933     23.0752  11.9663    211.579     7.32008     211.579     
1 1 1 42 7  17 o 2  51.5586 9.85403 76.1258     24.8894  85.4912     27.2427  47.1675    201.659     20.2493     201.659     
1 1 1 42 7  18 o 5  27.2679 8.46536 18.7265     21.2204  16.7239     23.4192  12.948     347.741     10.5088     167.741     
1 1 1 42 7  19 o 12 20.5223 6.94383 -2.69751    19.3115  -16.2751    21.7712  7.26133    116.998     0.751517    116.998     
1 1 1 42 7  20 o 18 24.4109 7.91197 11.8635     21.437   4.22677     22.5965  5.643      66.2769     2.71713     66.2769     
1 1 1 42 7  21 f 0  43.1021 9.53747 64.8115     23.9918  55.4237     21.786   23.488     232.47      0           0           
1 1 1 42 7  22 o 15 28.7232 8.55058 33.2987     22.1879  16.8995     19.9725  15.7268    151.367     5.78233     331.367     
1 1 1 42 7  23 o 19 29.6991 8.55574 40.442      21.6537  14.9721     19.6158  15.2838    148.462     8.72723     328.462     
1 1 1 42 7  24 o 7  25.8127 7.93637 32.7084     21.2402  -1.63933    18.7576  14.2366    17.8316     2.49618     17.8316     
1 1 1 42 7  25 o 10 32.1128 8.57022 58.2209     22.4431  7.44593     20.5066  21.5867    217.058     12.1477     217.058     
1 1 1 42 7  26 o 1  24.3583 7.7363  23.3489     20.6243  1.48725     19.429   11.4645    156.862     1.82463     336.862     
1 1 1 42 7  27 o 19 25.2    7.98125 19.1681     21.33    14.1373     20.214   11.82      197.769     3.92036     17.7691     
1 1 1 42 7  28 o 7  21.9352 7.27646 4.40573     20.7829  3.40961     19.6579  3.67871    113.667     0.155367    293.667     
1 1 1 42 7  29 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 7  30 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 7  31 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 8  0  o 1  38.535  11.3706 48.1938     21.9556  48.1938     21.9556  25.2766    7.99337e-06 9.07559     180         
1 1 1 42 8  1  o 12 29.2389 8.58093 21.7304     20.5145  24.395      20.8067  15.8118    206.978     8.60517     26.9775     
1 1 1 42 8  2  o 3  22.1588 7.21154 -11.4526    18.6801  10.3979     19.041   7.77709    199.001     3.18643     199.001     
1 1 1 42 8  3  o 7  30.2812 8.54914 36.1205     20.6     13.6808     20.0326  23.2206    256.083     8.28001     256.083     
1 1 1 42 8  4  o 4  32.3004 8.83845 35.4189     20.5365  26.3263     20.4819  23.1159    277.051     2.36338     277.051     
1 1 1 42 8  5  o 10 24.4073 8.0763  9.76382     28.8114  0.566904    19.8506  4.49223    151.533     2.45168     151.533     
1 1 1 42 8  6  o 9  24.6601 8.08608 25.7728     26.9607  -13.3697    19.9228  13.4142    75.4239     5.70482     75.4239     
1 1 1 42 8  7  o 6  29.1854 9.02227 26.6167     29.5281  21.9267     21.1569  13.5999    232.616     13.1628     52.6162     
1 1 1 42 8  8  o 6  28.2325 9.59918 21.4738     63.2783  15.0758     26.0491  17.7942    226.614     8.48893     226.614     
1 1 1 42 8  9  o 16 25.7492 8.48174 33.9094     29.4464  -21.6829    24.64    12.8774    15.4767     6.36594     15.4767     
1 1 1 42 8  10 o 12 25.5172 8.47309 26.9071     29.6696  -13.2329    25.3252  12.884     114.089     5.95411     114.089     
1 1 1 42 8  11 o 13 30.5472 9.38442 10.8144     30.7105  44.5485     26.7105  18.7433    313.369     11.532      313.369     
1 1 1 42 8  12 o 10 26.3997 9.10056 7.47298     29.8795  3.10819     51.6872  15.5995    284.066     4.94715     284.066     
1 1 1 42 8  13 o 13 27.5791 8.97438 25.5587     30.6061  14.9213     26.3318  16.892     212.904     0.15586     32.9036     
1 1 1 42 8  14 o 8  30.2518 9.14242 24.4592     22.425   37.5078     26.6061  21.6217    187.581     7.61748     187.581     
1 1 1 42 8  15 o 16 22.9812 7.55824 11.0278     19.4298  -7.71238    24.5172  7.6553     90.0614     2.52389     90.0614     
1 1 1 42 8  16 o 14 36.4312 9.72267 55.7094     23.1849  43.3659     27.6155  22.2837    129.948     6.18894     309.948     
1 1 1 42 8  17 f 0  24.7046 7.89675 26.2076     21.0452  -15.2931    25.3881  9.48141    12.3827     0           0           
1 1 1 42 8  18 o 13 26.5862 8.40379 4.19452     21.4782  34.555      24.8785  11.4228    113.376     5.22678     113.376     
1 1 1 42 8  19 o 6  24.014  7.91759 6.84673     20.3113  13.3502     26.2426  9.34606    95.0577     2.35636     95.0577     
1 1 1 42 8  20 o 3  23.9552 7.86662 19.0461     21.85    -4.68152    25.5137  10.1719    238.437     1.5664      238.437     
1 1 1 42 8  21 o 18 24.7    8.10092 10.6961     21.5584  17.3632     26.234   5.5162     66.3087     1.91084     66.3087     
1 1 1 42 8  22 o 5  22.5862 7.53007 9.79564     20.134   -2.81051    25.3942  6.72356    87.2682     0.267586    87.2682     
1 1 1 42 8  23 o 6  21.7345 7.29489 7.2833      19.6645  -7.4739     24.4889  4.6182     233.034     0.2919      53.0342     
1 1 1 42 8  24 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 8  25 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 8  26 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 8  27 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 9  0  o 9  11.5101 5.9977  -58.8802    25.0237  -58.8802    25.0237  1.94643    180         11.2496     180         
1 1 1 42 9  1  o 10 23.9253 8.00964 -18.9857    34.7757  14.0282     21.9048  9.57917    318.393     11.3136     138.393     
1 1 1 42 9  2  o 15 32.232  9.77495 75.5337     34.6632  16.2463     20.8393  22.3959    94.7173     2.92814     94.7173     
1 1 1 42 9  3  o 8  24.4537 8.26545 28.1486     34.9222  -2.62464    18.7885  11.9453    45.4474     3.35144     45.4474     
1 1 1 42 9  4  o 17 19.1675 9.44303 0           0        -20.2008    22.7831  3.62132    345.371     4.08238     165.371     
1 1 1 42 9  5  o 10 21.7191 7.48372 -22.3726    30.0715  -1.45332    23.9934  9.39527    215.227     1.0659      35.2273     
1 1 1 42 9  6  o 18 35.4242 9.97247 14.0803     39.9386  79.2262     28.8354  21.4457    241.704     15.1899     241.704     
1 1 1 42 9  7  o 4  29.2066 9.47698 39.4        37.301   29.3324     26.7914  18.1063    48.8633     0.167086    228.863     
1 1 1 42 9  8  o 7  23.1026 10.9079 0           0        4.47435     23.3818  7.00714    227.96      1.87713     47.9596     
1 1 1 42 9  9  o 10 23.1729 8.19696 -3.04755    28.8986  -76.0345    65.814   9.192      267.862     1.32944     267.862     
1 1 1 42 9  10 o 2  27.8922 9.14946 25.2917     33.0526  29.9419     28.7064  15.1437    64.4378     4.80337     244.438     
1 1 1 42 9  11 o 9  27.0139 9.35841 27.3746     33.0081  8.39459     69.2575  13.3292    170.622     6.8813      350.622     
1 1 1 42 9  12 o 5  23.7813 8.12379 14.9165     30.8331  -5.5885     27.2613  10.585     152.171     0.889195    152.171     
1 1 1 42 9  13 o 12 38.6666 11.1483 80.3738     35.8302  80.4193     32.7685  27.9234    23.4331     3.80619     23.4331     
1 1 1 42 9  14 o 12 33.2506 10.1711 80.2441     33.8246  30.163      30.1712  23.5758    11.3043     7.24879     11.3043     
1 1 1 42 9  15 o 16 24.507  8.27655 36.4572     31.4103  -11.0968    23.65    6.01757    48.5689     1.8421      48.569      
1 1 1 42 9  16 o 8  27.2644 8.79515 -4.44901    32.9825  43.8705     26.6061  14.9499    308.971     1.08736     128.971     
1 1 1 42 9  17 o 10 20.2512 7.06737 -28.6684    30.0809  -7.195      23.1898  4.01156    135.795     1.54285     315.795     
1 1 1 42 9  18 o 14 27.2415 8.97111 22.9567     33.5964  32.7686     27.6311  12.6736    275.112     3.74011     275.112     
1 1 1 42 9  19 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 9  20 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 9  21 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 9  22 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 10 0  x 6  ?       ?       ?           ?        ?           ?        3.90921    180         0           0           
1 1 1 42 10 1  x 11 ?       ?       ?           ?        ?           ?        14.6003    132.848     0           0           
1 1 1 42 10 2  o 16 25.0432 12.1564 14.7127     33.825   0           0        6.63359    183.407     1.2966      3.40738     
1 1 1 42 10 3  o 4  29.0123 13.8661 47.8231     40.1372  0           0        12.4781    129.318     3.86601     309.318     
1 1 1 42 10 4  o 13 23.4918 11.5127 2.93149     32.4667  0           0        4.20349    263.455     1.35177     83.4547     
1 1 1 42 10 5  o 4  31.6697 14.621  63.1623     38.3334  0           0        14.9003    326.189     1.52481     326.189     
1 1 1 42 10 6  o 11 26.697  12.9142 28.5102     37.3297  0           0        7.26529    216.339     0.310297    36.339      
1 1 1 42 10 7  f 0  27.4956 13.885  -1252.06    444.143  53.9642     64.596   2.03791    197.797     0           0           
1 1 1 42 10 8  o 3  20.9133 7.23903 -47.3098    34.8128  4.92538     22.263   3.90858    345.358     0.713537    165.358     
1 1 1 42 10 9  o 12 26.9391 9.03475 47.2261     38.4076  16.7054     26.3404  13.7689    190.154     2.29785     190.154     
1 1 1 42 10 10 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 10 11 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 10 12 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 10 13 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 10 14 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 10 15 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 10 16 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 11 0  x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 11 1  x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 11 2  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 11 3  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 42 11 4  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 0  0  o 4  21.8961 9.10291 11.7677     16.9158  11.7677     16.9158  4.09774    360         5.42194     180         
1 1 1 43 0  1  o 4  24.5592 7.76124 16.9325     10.154   16.9325     10.154   15.5595    60          5.06439     240         
1 1 1 43 0  2  o 19 14.2125 6.35585 2.67319     9.6987   2.67319     9.6987   0.405554   120         17.3918     120         
1 1 1 43 0  3  o 17 17.7347 7.31346 8.29446     10.7719  8.29446     10.7719  6.58295    180         7.12625     8.68575e-06 
1 1 1 43 0  4  o 18 21.1217 7.63473 13.0936     10.2063  13.0936     10.2063  10.0629    60          9.90897     240         
1 1 1 43 0  5  o 2  12.0556 5.70006 -2.1287     9.49928  -2.1287     9.49928  0.0548788  300         1.00283     300         
1 1 1 43 0  6  o 12 49.3716 5.01711 47.7976     11.6702  47.7976     11.6702  41.5567    0           7.60237     0           
1 1 1 43 0  7  o 8  11.3325 5.49864 -5.50012    10.0641  -5.50012    10.0641  0.346756   240         2.42112     240         
1 1 1 43 0  8  o 19 90.9936 3.31125 151.25      15.0077  151.25      15.0077  88.1452    300         37.2282     300         
1 1 1 43 0  9  o 19 65.801  3.95941 80.8681     12.8304  80.8681     12.8304  61.5714    2.75062e-06 22.6287     2.75062e-06 
1 1 1 43 0  10 o 11 62.253  4.11071 72.8637     12.5527  72.8637     12.5527  64.0268    240         33.0093     240         
1 1 1 43 0  11 o 6  13.1328 6.09311 -0.135588   10.0503  -0.135588   10.0503  0.4275     120         11.9197     120         
1 1 1 43 0  12 o 12 12.1529 5.75981 -2.32087    9.80337  -2.32087    9.80337  0.363467   360         4.89656     360         
1 1 1 43 0  13 o 14 14.8555 6.59839 3.54799     10.2584  3.54799     10.2584  1.57357    240         11.9585     60          
1 1 1 43 0  14 o 11 41.109  6.95782 37.093      12.4342  37.093      12.4342  27.8237    300         6.94754     120         
1 1 1 43 0  15 o 2  9.64237 4.82698 -10.8686    9.62565  -10.8686    9.62565  3.9218     180         13.0987     180         
1 1 1 43 0  16 o 17 14.8786 6.78907 2.00227     11.7677  2.00227     11.7677  1.34925    60.0001     3.29333     240         
1 1 1 43 0  17 o 5  14.1856 6.57753 0.33609     11.6849  0.33609     11.6849  6.65665    300         32.6222     300         
1 1 1 43 0  18 o 1  137.611 3.47233 346.278     23.8769  346.278     23.8769  103.884    180         1.03214     8.65058e-06 
1 1 1 43 0  19 o 7  52.8192 5.7949  56.2685     14.24    56.2685     14.24    47.5723    240         15.0832     240         
1 1 1 43 0  20 o 4  14.8459 6.98431 -1.01669    13.9568  -1.01669    13.9568  0.938536   300         11.2796     120         
1 1 1 43 0  21 o 5  21.7889 8.30296 14.6307     12.5692  14.6307     12.5692  7.31159    180         1.86415     180         
1 1 1 43 0  22 o 7  21.7217 8.3568  14.594      12.8517  14.594      12.8517  10.1941    60          0.813535    60          
1 1 1 43 0  23 o 2  45.5848 7.16809 45.422      14.31    45.422      14.31    46.5032    300         24.3531     300         
1 1 1 43 0  24 o 14 18.3453 7.94861 8.29698     13.9985  8.29698     13.9985  2.05848    180         1.06283     3.41882e-05 
1 1 1 43 0  25 f 0  48.8964 6.5767  50.395      14.4217  50.395      14.4217  22.8915    240         0           0           
1 1 1 43 0  26 o 11 27.5334 9.33469 23.6776     14.8342  23.6776     14.8342  13.1798    120         14.304      300         
1 1 1 43 0  27 o 14 49.9008 7.63272 54.8528     16.7393  54.8528     16.7393  42.8824    360         10.8942     360         
1 1 1 43 0  28 o 10 21.7281 8.73094 14.7433     14.7681  14.7433     14.7681  10.9015    240         6.19516     60          
1 1 1 43 0  29 o 10 71.2285 5.25063 98.7287     18.2336  98.7287     18.2336  65.7067    120         24.8702     120         
1 1 1 43 0  30 o 6  30.1189 11.084  31.8122     21.7669  31.8122     21.7669  22.1338    0           14.1426     0           
1 1 1 43 0  31 o 6  15.0394 7.3394  -8.38323    18.5484  -8.38323    18.5484  1.3716     60          1.81457     240         
1 1 1 43 0  32 o 7  19.348  8.68796 8.09785     18.3364  8.09785     18.3364  7.73047    300         10.0992     120         
1 1 1 43 0  33 o 15 16.8352 7.74065 3.30633     15.6979  3.30633     15.6979  2.20346    180         28.2786     180         
1 1 1 43 0  34 o 1  13.8464 6.71086 -5.75423    14.8951  -5.75423    14.8951  0.225409   240         15.7844     240         
1 1 1 43 0  35 o 12 16.2455 7.62998 0.800801    16.5401  0.800801    16.5401  2.06747    120         16.559      300         
1 1 1 43 0  36 o 2  19.1788 8.49723 9.48082     16.8976  9.48082     16.8976  1.8385     8.62867e-06 31.4692     8.62867e-06 
1 1 1 43 0  37 o 4  12.6667 6.30353 -12.4944    15.6456  -12.4944    15.6456  1.6357     60          14.9985     60          
1 1 1 43 0  38 o 6  14.9769 7.16052 -1.94445    15.7871  -1.94445    15.7871  1.70341    300         8.41961     120         
1 1 1 43 0  39 o 6  21.0175 8.9276  14.9509     16.9308  14.9509     16.9308  9.4699     180         1.49411     8.62853e-06 
1 1 1 43 0  40 o 10 20.0992 8.80743 13.0019     17.6509  13.0019     17.6509  3.9615     240         0.457639    60          
1 1 1 43 0  41 o 19 12.7053 6.35547 -13.5134    16.5805  -13.5134    16.5805  2.7944     120         13.9332     120         
1 1 1 43 0  42 o 7  13.4532 6.68435 -10.8739    17.3803  -10.8739    17.3803  0.878782   180         6.08723     180         
1 1 1 43 0  43 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 0  44 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 0  45 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 1  0  o 15 54.5864 4.6869  57.5355     12.3183  57.5355     12.3183  61.4284    180         39.1648     180         
1 1 1 43 1  1  o 16 18.9823 5.76331 6.55878     10.1671  -4.17254    10.1846  6.63854    143.6       2.28095     323.6       
1 1 1 43 1  2  o 11 50.7339 4.80773 52.4057     11.9108  49.6363     11.9114  41.1988    339.457     7.52828     339.457     
1 1 1 43 1  3  o 7  25.4075 6.31016 20.1335     10.5749  3.45108     11.2481  9.34214    315.043     15.7185     135.043     
1 1 1 43 1  4  o 4  61.6534 4.26869 79.1039     13.3294  68.0952     12.6894  58.9159    200.012     26.2457     200.012     
1 1 1 43 1  5  o 19 32.9781 6.55727 21.1476     11.359   26.7457     11.3442  26.8139    337.155     10.2469     337.155     
1 1 1 43 1  6  f 0  36.005  6.48861 27.0901     11.5679  29.656      11.9217  27.6958    101.763     0           0           
1 1 1 43 1  7  o 2  27.405  6.75559 14.7025     11.7429  17.2851     11.1289  14.219     179.407     8.57708     179.407     
1 1 1 43 1  8  o 11 23.1308 6.50164 5.24053     10.7812  12.5102     11.946   10.6148    84.5741     3.55693     84.5741     
1 1 1 43 1  9  o 13 68.3269 4.11639 87.3911     13.8831  92.1736     14.0338  53.1814    155.776     3.73817     155.776     
1 1 1 43 1  10 o 11 37.028  6.3281  38.2712     11.9226  21.8554     11.8104  23.7707    96.4452     5.24569     276.445     
1 1 1 43 1  11 o 10 21.8116 6.40654 3.89742     12.2655  8.05332     10.9975  9.69905    136.672     5.48501     316.672     
1 1 1 43 1  12 o 18 21.0442 6.36871 2.69097     12.0373  5.37518     11.9146  8.45808    354.182     6.57486     174.182     
1 1 1 43 1  13 o 10 56.6343 5.94582 67.9405     16.7187  66.3391     16.0049  36.6326    26.8915     10.8894     206.892     
1 1 1 43 1  14 o 5  24.202  6.84229 13.6324     12.0842  5.62377     13.648   10.7968    43.7781     8.64669     223.778     
1 1 1 43 1  15 o 18 37.48   6.95474 27.1509     13.2663  36.6232     13.4027  9.348      195.359     35.7656     15.3595     
1 1 1 43 1  16 o 4  40.8082 6.78942 29.9468     13.8071  44.8625     13.7951  31.5441    49.658      5.65631     49.658      
1 1 1 43 1  17 o 1  30.287  6.85665 8.7883      13.0028  30.9784     12.8867  21.5152    16.3286     11.8643     16.3286     
1 1 1 43 1  18 o 18 61.3251 5.1972  90.5433     15.3872  62.7602     15.3156  52.3389    348.999     14.3874     348.999     
1 1 1 43 1  19 o 12 29.1254 7.39032 13.8233     14.686   23.8294     13.5345  13.636     23.2449     11.5587     203.245     
1 1 1 43 1  20 o 16 37.6765 6.92326 15.1959     13.7524  51.5308     15.3234  29.4331    282.419     7.82286     282.419     
1 1 1 43 1  21 o 9  45.3523 6.51971 46.2586     14.286   44.1174     14.3382  32.9517    337.946     1.16761     337.946     
1 1 1 43 1  22 o 4  22.4512 6.5642  14.0001     12.7608  -1.9885     12.4721  9.17787    319.922     0.0782662   139.921     
1 1 1 43 1  23 o 4  32.6615 6.74418 8.77376     13.4232  38.5813     13.3718  25.194     28.1987     9.56174     28.1987     
1 1 1 43 1  24 o 18 30.7298 7.11132 9.44979     13.6895  32.7072     13.9053  14.6084    30.7557     12.5778     210.756     
1 1 1 43 1  25 o 13 28.4825 6.84432 1.56702     13.6605  30.3164     13.4079  10.8629    207.524     16.9618     27.5242     
1 1 1 43 1  26 o 16 17.1018 5.67087 -6.31097    12.5141  -8.52311    12.0009  4.00623    131.955     5.77927     311.955     
1 1 1 43 1  27 o 5  20.2527 6.60133 -2.21097    15.1281  -5.49316    16.0162  6.31627    317.229     11.0342     137.229     
1 1 1 43 1  28 o 9  22.5015 7.06947 7.99681     17.0502  -1.77424    14.8941  11.6106    287.488     1.63773     287.488     
1 1 1 43 1  29 o 17 45.893  7.80253 58.156      17.6595  43.3334     18.0887  43.2088    287.411     23.0803     287.411     
1 1 1 43 1  30 o 10 39.6731 8.59899 51.6981     20.3481  31.7038     17.5639  26.9693    13.9079     1.29803     193.908     
1 1 1 43 1  31 o 13 41.3243 9.11124 38.2818     20.5867  56.809      21.8591  30.4722    237.985     3.7964      237.985     
1 1 1 43 1  32 o 13 21.6635 7.17197 -5.81235    19.2496  -2.90203    19.7108  9.56393    130.802     5.30153     310.802     
1 1 1 43 1  33 o 4  22.4553 7.29792 -7.68555    18.515   7.49405     19.396   10.9435    294.774     3.01869     114.774     
1 1 1 43 1  34 o 16 18.3214 6.37953 -21.7442    22.2045  -26.3494    18.5809  2.84808    192.834     0.214586    12.8335     
1 1 1 43 1  35 o 14 26.9262 8.06253 24.8838     18.3244  3.28075     21.9196  16.4841    98.5609     2.32002     98.5609     
1 1 1 43 1  36 o 17 29.1401 8.72541 16.8059     19.4707  32.5221     24.422   16.5969    6.57113     2.86108     186.571     
1 1 1 43 1  37 o 6  33.865  8.74922 40.5087     19.2178  30.4395     20.0592  19.5043    266.096     5.51221     86.096      
1 1 1 43 1  38 o 19 21.383  6.97798 -10.4146    17.2904  11.3854     18.2434  6.69056    223.114     1.10858     43.1143     
1 1 1 43 1  39 o 13 19.6168 6.57556 -13.0481    17.1657  2.18353     17.6858  4.63237    357.767     4.41167     177.767     
1 1 1 43 1  40 o 9  22.2712 7.22092 2.66144     17.8123  8.6809      18.707   7.38949    127.671     5.83594     307.671     
1 1 1 43 1  41 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 1  42 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 1  43 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 2  0  o 7  44.8882 6.85375 43.4566     13.5243  43.4566     13.5243  53.4933    0.000103731 39.018      0.000103731 
1 1 1 43 2  1  o 14 66.0808 4.48655 84.557      14.5604  86.4637     14.7904  57.9485    201.873     16.8523     201.873     
1 1 1 43 2  2  o 16 24.1924 6.65697 12.0164     11.4336  9.71134     11.8227  13.5122    167.004     0.565713    347.004     
1 1 1 43 2  3  o 4  51.4642 5.38993 57.7853     13.4389  50.7382     13.4606  40.4554    52.6983     4.8904      52.6983     
1 1 1 43 2  4  o 14 29.3898 6.83218 26.3599     12.2548  11.4233     12.2156  19.3959    196.029     0.32395     196.029     
1 1 1 43 2  5  o 11 46.1365 6.02275 45.6957     13.1303  44.6109     13.6826  38.1408    160.775     9.39599     160.775     
1 1 1 43 2  6  o 1  31.5709 7.1466  20.4328     13.5549  25.1218     12.2914  20.7408    170.688     1.11069     350.688     
1 1 1 43 2  7  o 4  28.1399 6.76636 5.44962     13.4116  26.0826     12.0694  19.4483    71.9116     5.22353     71.9116     
1 1 1 43 2  8  o 18 19.9711 6.2444  -5.17323    12.8977  5.37792     12.2754  7.15408    8.63362     2.96454     188.634     
1 1 1 43 2  9  o 10 50.1597 6.21054 49.5641     14.8482  58.2864     15.2024  29.4286    311.719     15.4401     131.719     
1 1 1 43 2  10 o 19 21.1069 6.54731 -0.946584   14.1569  5.39286     12.7154  7.81975    350.895     7.70291     170.895     
1 1 1 43 2  11 o 17 22.858  6.712   1.59412     13.2983  12.0946     12.6742  2.30513    183.203     25.7983     3.20291     
1 1 1 43 2  12 o 3  65.7817 5.50596 98.1749     18.4283  80.4307     17.1229  61.6136    211.329     25.7425     211.329     
1 1 1 43 2  13 o 5  28.2327 7.33134 24.3726     13.5184  8.43007     15.6061  18.2373    118.465     7.46395     118.465     
1 1 1 43 2  14 o 12 19.103  6.13793 2.32335     12.8717  -8.26269    13.1722  4.3386     252.158     1.93571     72.1581     
1 1 1 43 2  15 o 12 20.5228 6.43118 -3.39456    13.745   5.11186     12.9008  6.25122    268.212     9.76386     88.2117     
1 1 1 43 2  16 o 4  22.4509 6.71633 4.1172      13.2642  8.70534     12.9299  9.45366    220.504     0.899119    40.5044     
1 1 1 43 2  17 o 12 21.3961 6.60072 3.1309      13.3978  4.16967     13.2856  8.13548    300.862     4.92294     120.862     
1 1 1 43 2  18 o 11 24.004  7.1132  14.19       15.3281  3.40779     13.7213  11.9801    219.324     0.368668    219.324     
1 1 1 43 2  19 o 15 29.8821 7.34816 27.4897     14.0269  13.3346     13.9066  14.3921    121.167     11.6254     301.167     
1 1 1 43 2  20 o 19 36.9361 7.91166 36.9874     15.3731  30.1283     16.8318  29.6993    179.095     10.1321     179.095     
1 1 1 43 2  21 o 3  59.9919 5.70775 82.5508     16.6813  68.0939     16.5891  51.6033    194.201     15.0636     194.201     
1 1 1 43 2  22 o 2  37.7897 7.36084 24.799      14.8113  43.035      14.9007  26.3943    196.271     0.0495424   16.272      
1 1 1 43 2  23 o 4  34.6613 8.44095 27.6182     17.7912  33.8878     17.8795  26.16      205.072     18.4093     205.072     
1 1 1 43 2  24 o 15 32.1412 8.30117 30.0702     17.5823  21.3102     17.5476  20.6688    315.86      1.90241     135.86      
1 1 1 43 2  25 o 19 43.2791 8.25714 35.4382     18.8747  59.2885     18.949   23.9165    88.6858     14.6001     268.686     
1 1 1 43 2  26 o 18 41.3429 8.34513 34.8347     19.108   52.6891     18.2441  34.2154    161.206     11.0707     161.206     
1 1 1 43 2  27 f 0  26.1991 7.90308 17.6503     18.551   6.24166     18.4823  18.6591    135.192     0           0           
1 1 1 43 2  28 o 3  23.7358 7.27616 -7.83341    17.9085  16.3476     16.3077  8.61318    20.505      4.2024      20.505      
1 1 1 43 2  29 o 10 22.6176 7.09794 -16.1398    17.5609  15.8033     17.0984  10.2596    135.598     6.78301     315.598     
1 1 1 43 2  30 o 6  47.2064 8.97061 54.3791     21.9104  68.1578     21.7937  42.2831    219.668     19.0344     219.668     
1 1 1 43 2  31 o 19 19.7266 6.59281 -1.71745    17.4951  -13.4071    16.963   7.23902    90.2168     0.116329    270.217     
1 1 1 43 2  32 o 15 42.6545 9.03377 54.5831     21.1161  50.8764     20.5338  40.3096    168.559     28.4899     168.559     
1 1 1 43 2  33 o 7  23.2704 7.57016 -1.54154    23.4856  7.86889     18.0474  2.00966    280.004     0.815865    280.004     
1 1 1 43 2  34 o 14 27.6151 8.52473 16.0842     25.2234  23.4413     20.4124  14.4532    321.734     4.888       141.734     
1 1 1 43 2  35 o 16 25.3988 8.29471 2.67384     25.4299  19.7972     24.6157  12.371     59.9919     3.3166      239.992     
1 1 1 43 2  36 o 5  27.0817 8.7328  18.2841     25.3742  23.0337     27.0532  8.74674    106.907     3.81188     106.907     
1 1 1 43 2  37 o 16 26.6604 8.64987 19.1931     26.2742  20.8262     26.2505  13.2581    90.1866     0.781342    270.187     
1 1 1 43 2  38 o 18 27.3207 9.12565 14.5958     19.7045  52.2847     49.3355  4.3606     318.996     1.73597     318.996     
1 1 1 43 2  39 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 2  40 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 3  0  o 14 24.226  8.43998 18.0548     12.2421  18.0548     12.2421  16.1397    2.95683e-05 2.03921     2.95683e-05 
1 1 1 43 3  1  o 7  24.5761 6.70832 20.3009     12.9712  0.0744976   12.3197  12.5396    339.636     3.5417      339.636     
1 1 1 43 3  2  o 5  24.2873 6.80822 13.5328     12.7944  8.47601     11.9344  5.51683    175.087     21.3539     355.087     
1 1 1 43 3  3  o 11 41.5597 6.93921 28.7372     14.5632  50.95       14.5544  29.8353    267.398     0.0792672   267.398     
1 1 1 43 3  4  o 7  69.0461 4.93869 89.2341     16.7887  102.552     16.8297  63.0957    358.945     22.7978     358.945     
1 1 1 43 3  5  o 18 30.3477 7.31831 26.147      13.3141  16.3741     14.0329  18.5747    33.6036     3.0367      213.604     
1 1 1 43 3  6  o 14 26.9183 7.26321 19.5852     13.8501  11.0858     13.7656  15.9253    295.355     5.72387     295.355     
1 1 1 43 3  7  o 14 19.5436 6.16557 -7.69135    12.3691  5.91024     12.7901  5.08975    278.68      10.6612     98.6797     
1 1 1 43 3  8  o 18 19.2508 6.18346 -0.572245   13.0053  -3.09358    12.9976  2.81612    15.5562     30.2991     15.5561     
1 1 1 43 3  9  o 10 22.3271 6.7439  11.1848     13.9387  -0.331038   13.2447  6.73443    128.917     1.06579     128.917     
1 1 1 43 3  10 o 13 50.6735 6.40525 50.8829     15.8323  61.3712     15.3825  36.0027    327.043     2.52536     147.043     
1 1 1 43 3  11 o 4  24.5576 7.10614 1.66751     15.3409  16.624      13.8517  10.8843    20.8988     8.54908     200.899     
1 1 1 43 3  12 o 4  18.5022 6.01594 -5.27324    12.824   -2.32201    12.7989  4.8299     103.346     7.12496     283.346     
1 1 1 43 3  13 o 1  21.5252 6.74285 0.775098    13.0199  4.9733      15.697   8.52585    170.997     6.4885      350.997     
1 1 1 43 3  14 o 13 34.8885 7.5731  27.1727     14.385   31.6651     14.6895  17.2566    31.0034     14.9025     211.003     
1 1 1 43 3  15 o 6  30.0916 7.4056  13.4199     14.2532  28.2835     14.2285  12.7513    346.028     16.1789     166.028     
1 1 1 43 3  16 o 11 18.0571 5.92994 -4.85049    12.7719  -6.08681    13.0241  1.93211    167.185     17.4059     347.185     
1 1 1 43 3  17 o 12 24.5882 7.27471 14.2193     15.9204  5.71181     14.2234  3.78376    135.529     25.9427     315.529     
1 1 1 43 3  18 o 6  24.4211 7.02568 16.6143     13.9167  2.61635     14.0474  12.9655    54.2551     4.20122     234.255     
1 1 1 43 3  19 o 19 25.3416 7.36648 13.2953     15.4363  10.2812     14.6229  14.4898    301.446     2.48387     121.446     
1 1 1 43 3  20 o 3  52.8294 8.98219 74.096      27.1167  70.6279     20.1361  41.3064    90.6197     5.64298     90.6197     
1 1 1 43 3  21 o 15 37.3165 8.6889  47.3134     20.1437  27.0564     18.3573  15.72      335.565     22.1797     155.565     
1 1 1 43 3  22 o 7  44.3742 8.51563 40.5649     20.7507  61.5385     19.3587  35.5773    117.324     8.00006     117.324     
1 1 1 43 3  23 o 5  31.4045 8.50109 31.0937     18.9677  19.337      18.9715  24.0542    92.8025     8.64545     92.8025     
1 1 1 43 3  24 o 7  22.473  7.2099  4.51378     17.7571  -1.05717    17.4985  5.81698    9.83354     17.7556     189.834     
1 1 1 43 3  25 o 9  26.2647 7.75714 -6.25063    19.1233  26.3144     18.305   17.2775    352.61      4.73166     352.61      
1 1 1 43 3  26 o 15 27.1913 8.14259 16.0832     19.2955  16.3427     19.0727  18.292     99.2215     5.74672     99.2215     
1 1 1 43 3  27 o 13 22.2099 7.16565 1.5204      17.5525  2.33611     17.8264  8.49455    135.349     3.01185     135.349     
1 1 1 43 3  28 o 12 31.137  8.43323 39.8821     19.6969  11.2926     20.008   20.9141    252.904     1.10434     252.904     
1 1 1 43 3  29 o 11 23.8484 7.4663  -5.05702    18.6737  17.6766     18.1426  12.7812    83.0728     2.75773     83.0728     
1 1 1 43 3  30 o 13 22.5073 7.30154 10.0679     19.3959  -3.97614    18.2034  10.2707    39.3153     3.97043     219.315     
1 1 1 43 3  31 f 0  28.3843 8.33874 30.5837     19.8147  13.6436     20.3741  12.3903    303.887     0           0           
1 1 1 43 3  32 o 1  22.1226 7.1748  10.0128     18.2971  -2.67339    18.1153  6.6015     204.411     0.880871    204.411     
1 1 1 43 3  33 o 11 22.6783 7.42753 3.54229     19.973   6.49057     20.0867  6.19334    134.095     0.878067    134.095     
1 1 1 43 3  34 o 9  21.6152 7.31631 3.21677     25.7717  -5.0393     18.5351  5.99644    216.564     1.0802      36.5639     
1 1 1 43 3  35 o 8  22.268  7.2877  -2.54274    20.0376  11.1847     18.9834  7.59972    254.811     6.27768     74.8113     
1 1 1 43 3  36 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 3  37 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 3  38 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 4  0  o 16 14.9692 7.06891 -1.07697    14.5305  -1.07697    14.5305  1.36053    180         11.5411     5.04514e-05 
1 1 1 43 4  1  o 19 23.6425 7.03138 -7.12091    14.6929  18.6747     15.6447  8.44702    305.176     3.2196      305.176     
1 1 1 43 4  2  o 11 26.594  7.52394 20.1915     15.2913  7.52571     15.9865  16.7177    19.0559     4.98642     19.0559     
1 1 1 43 4  3  o 18 20.2084 6.45858 -0.564898   12.8874  -0.169677   14.9907  6.6129     89.2193     9.71553     269.219     
1 1 1 43 4  4  o 10 17.8415 5.95609 -13.3556    12.6499  -3.62311    14.9572  4.16007    330.312     2.79943     150.312     
1 1 1 43 4  5  o 4  23.8122 7.09043 11.127      13.6554  5.59446     15.511   9.14622    277.147     3.61494     277.147     
1 1 1 43 4  6  o 15 36.2801 7.94299 34.4137     14.5281  31.0071     17.8325  27.4538    103.499     4.81763     103.499     
1 1 1 43 4  7  o 18 25.7711 7.04533 1.57523     13.6767  22.6811     14.1266  11.9324    131.355     6.2377      131.355     
1 1 1 43 4  8  o 13 21.8073 6.68646 5.94611     13.4685  3.32003     13.5937  8.26922    351.648     10.1815     171.648     
1 1 1 43 4  9  o 9  27.78   7.65367 15.7659     14.6971  18.5268     15.9927  8.35677    220.462     21.9465     40.4625     
1 1 1 43 4  10 o 4  48.6244 7.04696 49.3839     16.7474  58.4105     16.434   29.2667    129.676     13.589      309.676     
1 1 1 43 4  11 o 14 20.5235 6.62629 0.365889    15.8965  -3.52249    14.3706  8.43084    317.142     6.04588     137.142     
1 1 1 43 4  12 o 14 24.0293 7.18405 12.9852     14.1255  2.39089     16.5702  9.0644     282.121     4.42634     282.121     
1 1 1 43 4  13 o 8  18.5189 6.09834 -8.59523    13.4618  -3.23053    14.1194  3.78378    122.206     14.8725     302.206     
1 1 1 43 4  14 o 18 22.3642 7.00788 2.43542     16.5371  4.61298     14.7077  7.03889    195.511     15.2038     15.5107     
1 1 1 43 4  15 o 5  20.9654 6.6504  4.75389     14.6526  -3.49316    14.542   9.693      91.3713     5.0696      271.371     
1 1 1 43 4  16 f 0  38.4995 9.28975 57.7779     25.9536  28.9159     17.0864  38.1169    307.519     0           0           
1 1 1 43 4  17 o 16 24.2256 7.42455 -12.0731    18.1685  19.6692     17.8586  13.5655    259.017     2.71307     79.0168     
1 1 1 43 4  18 o 15 27.718  8.05153 25.2797     18.877   7.1528      17.9205  16.2989    241.709     3.88153     61.7093     
1 1 1 43 4  19 o 16 21.2992 7.10356 -9.28596    17.2921  -2.15048    21.6923  9.96814    94.692      4.19642     274.692     
1 1 1 43 4  20 o 17 49.0669 8.61976 73.4218     21.3437  53.4435     21.3559  46.4531    305.407     23.1946     305.407     
1 1 1 43 4  21 o 7  22.5672 7.24695 -1.5237     18.3352  5.95862     17.5483  12.2003    295.168     0.0221468   295.168     
1 1 1 43 4  22 o 18 34.8463 9.02168 34.5059     21.7608  36.7473     19.6286  16.4412    286.986     16.3754     106.986     
1 1 1 43 4  23 o 5  18.1746 6.20204 -9.87636    17.1723  -18.7755    16.7883  6.24135    132.199     2.50142     312.199     
1 1 1 43 4  24 o 17 24.1945 7.56332 17.2436     18.7844  -1.60045    18.1138  13.093     274.53      4.98449     274.53      
1 1 1 43 4  25 o 7  33.9192 8.7752  43.871      20.2911  24.7615     19.7683  21.9869    279.197     2.16285     99.1968     
1 1 1 43 4  26 o 5  22.9953 7.36603 12.1759     18.5847  -2.31811    18.4606  7.12027    162.232     2.67527     162.232     
1 1 1 43 4  27 o 16 29.1622 8.47161 16.4081     21.333   31.7308     19.6877  15.1097    223.979     8.89366     223.979     
1 1 1 43 4  28 o 2  29.8769 8.36821 12.598      20.0285  38.8605     19.6635  19.9285    89.9803     9.51563     89.9803     
1 1 1 43 4  29 o 8  20.3475 6.7965  -4.67589    18.4367  -1.30037    17.9938  5.99674    352.492     1.44744     172.492     
1 1 1 43 4  30 o 1  23.148  7.23314 28.7572     19.2614  -25.9912    18.0402  9.5211     119.607     0.455102    119.607     
1 1 1 43 4  31 o 16 25.434  8.02215 8.89799     21.77    22.4475     20.5023  9.7316     358.864     2.89366     358.864     
1 1 1 43 4  32 o 12 20.2274 6.8501  -2.22121    19.9783  -7.42147    19.6482  5.26252    238.973     4.95928     58.9731     
1 1 1 43 4  33 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 4  34 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 4  35 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 5  0  o 19 15.6466 7.68931 -10.455     21.2806  -10.455     21.2806  0.724175   359.999     0.401685    179.999     
1 1 1 43 5  1  o 13 29.1255 7.88363 -4.58408    17.8699  37.0915     18.9742  22.2331    23.0389     8.66977     23.0389     
1 1 1 43 5  2  o 1  28.5656 8.51878 14.9697     18.0326  21.6425     23.6222  18.6349    199.261     0.0941405   19.2611     
1 1 1 43 5  3  o 18 22.2797 7.20086 4.75292     19.0972  -4.38386    16.738   12.2254    104.412     0.372425    104.413     
1 1 1 43 5  4  o 19 20.6058 6.93583 -16.275     16.2632  -1.0315     21.873   6.89207    282.48      1.87275     282.48      
1 1 1 43 5  5  o 15 21.2277 6.87281 -9.79553    17.1395  4.69091     16.4187  8.2339     306.397     10.2561     126.397     
1 1 1 43 5  6  o 3  27.5789 8.2505  8.44821     24.0857  19.4202     17.1705  18.7373    269.038     2.84996     269.038     
1 1 1 43 5  7  o 13 45.8158 8.83356 64.3058     22.8295  47.4268     18.9116  20.8078    102.557     26.5061     282.557     
1 1 1 43 5  8  o 4  36.012  8.32821 27.942      16.1108  40.2783     18.635   32.9183    242.531     20.8462     242.531     
1 1 1 43 5  9  o 2  19.4765 6.40249 -0.371372   14.1585  -11.6956    16.6216  8.26721    123.119     4.63519     303.119     
1 1 1 43 5  10 o 14 22.9944 7.34389 4.76155     18.1543  1.29641     17.8892  9.65397    7.39977     10.4301     187.4       
1 1 1 43 5  11 o 5  25.121  7.55536 2.16102     16.0723  18.8063     17.7877  9.56027    261.192     14.9692     81.1919     
1 1 1 43 5  12 o 16 24.4491 8.04503 19.3415     26.0009  -22.372     22.5334  14.0162    287.102     1.34057     107.102     
1 1 1 43 5  13 o 8  22.3126 7.32786 -20.9689    18.2924  13.2206     21.5942  8.66825    13.4934     11.1936     193.493     
1 1 1 43 5  14 o 17 23.8827 7.7199  -4.06988    18.8556  11.9778     22.306   11.9547    321.406     4.99552     321.406     
1 1 1 43 5  15 o 9  24.3091 7.57776 -39.084     28.0902  20.4072     17.5204  13.3136    205.281     3.70342     25.2814     
1 1 1 43 5  16 o 18 27.0637 8.23125 17.0627     20.1739  14.7843     20.1492  16.2602    80.2362     2.38995     260.236     
1 1 1 43 5  17 o 18 22.9632 7.52475 -3.20119    24.2324  3.84518     17.6108  9.80792    6.94894     3.90201     6.94894     
1 1 1 43 5  18 o 12 23.558  7.52082 7.82581     20.249   4.34009     17.405   12.193     69.7871     4.57047     69.7871     
1 1 1 43 5  19 o 9  24.9561 7.96209 -10.0848    20.824   23.7907     22.7736  14.0478    328.141     2.65915     148.141     
1 1 1 43 5  20 o 19 37.5172 9.14387 56.5518     22.4496  31.2822     20.4219  24.7339    86.6208     3.22648     266.621     
1 1 1 43 5  21 o 12 30.4123 8.49065 16.2515     21.1132  35.455      19.1554  13.0331    22.9988     8.97277     22.9988     
1 1 1 43 5  22 o 18 29.1011 8.46281 17.6585     21.4056  29.9713     19.3607  19.2583    260.73      2.31371     260.73      
1 1 1 43 5  23 o 8  35.4818 9.25246 40.7392     22.9113  43.7733     20.8278  24.3475    165.18      0.721544    165.18      
1 1 1 43 5  24 o 10 34.8225 9.33724 44.6235     23.6373  40.4673     21.2384  20.2395    120.597     7.1249      300.597     
1 1 1 43 5  25 o 12 22.5897 7.36641 5.4582      20.0773  5.43695     18.7028  7.73475    327.223     1.31167     327.223     
1 1 1 43 5  26 o 10 18.3905 6.31207 -0.250805   18.8466  -27.7679    17.5173  3.12013    355.162     2.17984     175.162     
1 1 1 43 5  27 o 19 20.7081 6.9563  3.84042     20.6706  -7.80059    18.2559  4.94552    50.4979     0.937427    230.498     
1 1 1 43 5  28 o 3  29.5255 8.57276 16.8194     21.9089  40.5105     20.9002  18.1972    284.988     2.72547     284.988     
1 1 1 43 5  29 o 13 26.5586 8.20751 13.5577     21.5356  27.8887     20.6574  13.4766    131.909     1.88595     311.909     
1 1 1 43 5  30 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 5  31 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 5  32 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 6  0  o 8  16.2977 7.76717 -0.998077   18.2914  -0.998077   18.2914  4.59181    2.49436e-05 2.32796     180         
1 1 1 43 6  1  o 12 22.8582 7.31209 11.9273     18.3789  -7.71293    18.4192  12.391     293.813     3.69803     293.813     
1 1 1 43 6  2  o 1  34.6604 8.94326 41.6809     20.1372  27.9905     21.2664  30.0928    77.541      16.2522     77.541      
1 1 1 43 6  3  o 15 21.092  6.92125 6.26693     17.6703  -15.4887    18.4119  10.5782    318.523     0.450234    318.523     
1 1 1 43 6  4  o 14 23.8979 7.69731 2.63175     21.5571  6.91285     19.2393  13.43      8.65461     4.83907     8.65461     
1 1 1 43 6  5  o 9  20.0728 6.6849  3.86056     17.5074  -23.8091    18.6332  5.93418    300.026     1.48264     300.026     
1 1 1 43 6  6  o 2  27.7906 8.78892 31.9801     28.9695  4.97187     20.4336  19.2639    304.753     7.71166     304.753     
1 1 1 43 6  7  o 8  26.0678 8.23625 -7.0155     28.6977  19.9391     19.722   16.7335    281.948     6.81961     281.948     
1 1 1 43 6  8  o 7  24.8118 8.0252  -5.64645    28.1558  12.7108     19.2992  14.867     79.5926     5.32908     79.5926     
1 1 1 43 6  9  o 9  23.1541 8.38637 -3.93709    60.9221  -30.8082    21.418   2.4381     304.98      26.7121     124.98      
1 1 1 43 6  10 o 14 28.8059 9.14691 33.7606     29.4378  9.09077     25.5863  18.4282    256.506     10.236      256.506     
1 1 1 43 6  11 o 6  26.7229 9.49976 -49.5563    58.7014  -0.588469   55.4524  12.5226    105.534     10.0986     285.534     
1 1 1 43 6  12 o 6  29.3867 9.25701 19.1754     29.982   29.1478     26.0653  21.1375    194.858     9.13124     194.858     
1 1 1 43 6  13 o 2  29.1358 8.73527 -2.10783    20.3593  47.4676     26.0679  6.8051     209.943     27.6564     29.9426     
1 1 1 43 6  14 o 16 28.5432 8.91267 -14.9483    29.3209  43.8117     26.7813  15.8483    96.6196     6.16201     276.62      
1 1 1 43 6  15 o 17 26.8183 8.11016 33.2902     20.3805  -17.7716    25.8979  17.34      63.9184     6.81954     63.9184     
1 1 1 43 6  16 o 4  25.5461 8.87843 1.25317     20.4111  22.6921     60.4207  14.4537    182.726     2.89968     182.726     
1 1 1 43 6  17 o 18 24.8803 8.09353 0.198226    20.2972  21.9714     25.5959  14.0535    142.491     1.78658     142.491     
1 1 1 43 6  18 o 7  21.4068 7.2607  -9.632      19.88    0.888037    24.4165  8.70459    238.318     0.425551    58.3176     
1 1 1 43 6  19 o 5  28.8773 8.97047 25.1418     23.085   30.8613     26.9804  18.3717    211.402     2.02348     211.402     
1 1 1 43 6  20 o 17 22.3059 7.48738 -3.36747    19.5372  6.94931     25.0928  9.55252    174.973     0.984278    354.973     
1 1 1 43 6  21 o 11 25.4809 8.2469  -0.489739   21.2426  31.6541     26.0101  13.6006    116.356     0.939001    116.356     
1 1 1 43 6  22 o 7  21.3334 7.24538 -3.32568    19.9514  -2.76319    25.0272  4.78898    137.802     0.0497746   137.803     
1 1 1 43 6  23 o 4  21.3851 7.28946 -9.27029    20.7438  3.91318     25.1711  5.37926    246.732     0.434177    66.7323     
1 1 1 43 6  24 o 6  25.1196 8.21883 0.374467    21.1917  32.4295     27.0526  8.99644    203.866     2.39067     203.866     
1 1 1 43 6  25 o 18 21.6271 7.17663 -12.1022    20.3448  13.7532     20.0718  7.05349    47.8022     3.09009     227.802     
1 1 1 43 6  26 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 6  27 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 6  28 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 6  29 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 7  0  o 6  28.0721 10.8409 31.5813     21.7116  31.5813     21.7116  23.1922    180         12.3225     180         
1 1 1 43 7  1  o 15 31.6413 8.99695 27.1005     22.3435  37.2318     21.7963  13.3923    354.569     18.047      174.569     
1 1 1 43 7  2  o 12 22.9254 7.45571 12.1478     20.6759  -3.31495    18.7352  12.307     168.581     1.08134     168.581     
1 1 1 43 7  3  o 6  22.7039 7.69086 -11.9761    33.1538  1.56335     18.9752  11.5749    137.65      1.01497     137.65      
1 1 1 43 7  4  o 9  29.0827 9.41161 8.03579     33.2498  41.1813     30.7231  19.8908    134.559     7.7321      134.559     
1 1 1 43 7  5  f 0  27.0075 8.91625 32.0945     34.0942  6.09635     24.2832  6.85607    240.51      0           0           
1 1 1 43 7  6  o 10 31.6115 10.1624 51.9285     37.7528  34.6888     32.428   22.2978    313.954     11.3689     313.954     
1 1 1 43 7  7  o 17 27.509  8.89295 -0.838751   30.2017  34.9302     27.4604  17.1552    43.2039     6.85533     43.2039     
1 1 1 43 7  8  o 13 26.5051 8.93618 -42.4452    60.9058  23.8199     25.9935  10.7949    86.4262     13.5922     266.426     
1 1 1 43 7  9  o 6  20.7286 7.19966 -7.27665    28.3719  -21.0658    21.7823  8.25649    201.372     5.55706     21.3718     
1 1 1 43 7  10 o 16 19.4485 6.84044 -12.4972    28.0498  -33.0362    21.2232  5.94755    323.58      1.49042     143.58      
1 1 1 43 7  11 o 10 27.6947 9.56075 21.2236     30.5699  31.8533     70.4999  16.6173    39.8206     1.43784     39.8207     
1 1 1 43 7  12 o 4  24.7259 8.291   17.9209     29.3029  1.1978      25.4763  12.621     205.951     2.65504     205.951     
1 1 1 43 7  13 f 0  29.5464 9.48883 32.9498     31.7481  36.8094     29.6379  21.0981    50.9134     0           0           
1 1 1 43 7  14 o 13 25.1437 8.35022 40.6743     29.7146  -18.6702    23.5615  11.272     356.532     3.56689     356.532     
1 1 1 43 7  15 o 15 34.9986 10.0336 24.8641     33.7344  79.2005     29.6014  26.6943    315.518     9.8489      315.518     
1 1 1 43 7  16 o 1  33.7035 10.2627 58.2152     32.7195  53.802      30.1514  22.5245    344.282     1.58547     344.282     
1 1 1 43 7  17 o 3  23.9239 8.11017 9.22427     30.1787  5.79366     25.6657  4.68503    21.5557     1.38099     21.5557     
1 1 1 43 7  18 o 2  22.3958 7.5182  8.01633     21.1559  -3.1258     25.2722  8.74137    166.864     2.04444     346.865     
1 1 1 43 7  19 o 17 35.3682 9.98771 45.5567     24.568   66.154      28.8439  26.2226    339.483     8.76983     339.483     
1 1 1 43 7  20 o 13 23.6669 7.84628 13.3629     21.2545  5.31026     26.6482  9.55382    336.696     0.670933    156.696     
1 1 1 43 7  21 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 7  22 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 7  23 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 7  24 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 8  0  o 2  26.3142 12.0845 41.0669     38.1013  41.0669     38.1013  14.323     180         5.80908     180         
1 1 1 43 8  1  o 5  32.4111 14.7643 60.1676     37.3561  0           0        15.9149    97.5695     3.87243     97.5695     
1 1 1 43 8  2  o 3  28.0248 13.3985 33.3007     37.5403  0           0        12.0106    327.802     2.03908     147.802     
1 1 1 43 8  3  o 14 22.0597 10.8586 -9.51024    29.9138  0           0        1.46127    213.182     0.452538    33.1821     
1 1 1 43 8  4  o 1  25.5185 8.54047 -34.5704    35.9578  39.0174     29.1195  13.5628    129.445     0.978107    309.445     
1 1 1 43 8  5  o 8  26.1014 8.71934 32.4688     33.2933  9.98763     25.8881  13.3865    15.2944     3.52049     15.2944     
1 1 1 43 8  6  o 2  23.4521 8.01277 19.3189     31.4918  -7.26624    24.0191  3.47395    272.083     1.02603     272.083     
1 1 1 43 8  7  o 14 20.1059 9.81342 0           0        -10.5281    22.8904  3.73748    324.476     4.78984     144.476     
1 1 1 43 8  8  o 6  27.4035 8.99044 18.2929     36.6379  33.5268     26.3715  14.3036    335.292     4.98553     335.292     
1 1 1 43 8  9  o 19 21.6135 7.45627 -20.0506    31.1662  2.17199     23.5373  5.44668    123.298     0.0383875   303.298     
1 1 1 43 8  10 o 14 36.4838 10.7036 54.8524     39.5664  90.8325     32.4943  27.9752    242.122     14.5951     242.122     
1 1 1 43 8  11 o 8  20.6171 7.17598 -44.1284    30.1347  3.24051     24.7777  4.42527    311.001     0.990461    131.001     
1 1 1 43 8  12 o 6  23.9478 8.19409 23.973      31.5515  -7.77888    28.0594  10.1596    44.7142     0.485752    224.714     
1 1 1 43 8  13 o 6  33.6828 10.4346 67.9965     38.9612  63.0582     30.4601  23.2204    224.849     5.76307     224.849     
1 1 1 43 8  14 o 3  35.6214 10.8999 112.125     39.8007  45.2066     32.6586  25.2585    174.752     6.26287     174.752     
1 1 1 43 8  15 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 8  16 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 8  17 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 8  18 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 8  19 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  0  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  1  x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  2  x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  3  x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  4  x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  5  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  6  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  7  x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  8  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  9  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  10 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 43 9  11 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 0  0  o 7  34.1444 10.3656 32.2487     18.1572  32.2487     18.1572  10.7768    360         6.01047     360         
1 1 1 44 0  1  o 14 15.2119 6.8874  2.88254     11.8138  2.88254     11.8138  2.23774    240         7.44391     60          
1 1 1 44 0  2  o 11 55.5671 5.24416 60.8703     13.8759  60.8703     13.8759  47.4794    120         9.64155     120         
1 1 1 44 0  3  o 18 11.3919 5.56944 -6.79066    10.7997  -6.79066    10.7997  1.84407    8.71772e-06 9.69121     8.71771e-06 
1 1 1 44 0  4  o 9  62.3698 4.70133 74.7536     14.2743  74.7536     14.2743  61.2835    60          26.837      60          
1 1 1 44 0  5  o 16 70.3435 4.18911 93.1635     14.5175  93.1635     14.5175  76.0576    120         44.1731     120         
1 1 1 44 0  6  o 6  38.1729 7.60581 33.9936     12.5956  33.9936     12.5956  30.6214    180         2.73306     180         
1 1 1 44 0  7  f 0  76.4413 4.7772  111.536     17.9568  111.536     17.9568  38.7473    60          0           0           
1 1 1 44 0  8  o 14 39.2721 8.36616 37.4001     14.3516  37.4001     14.3516  31.6537    120         3.1576      120         
1 1 1 44 0  9  o 7  72.6591 4.63208 100.589     16.5357  100.589     16.5357  74.7136    2.84131e-06 38.1043     2.84131e-06 
1 1 1 44 0  10 o 8  12.864  6.2185  -5.29392    12.606   -5.29392    12.606   0.485838   60          6.80966     60          
1 1 1 44 0  11 o 11 10.4618 5.25297 -13.4869    11.7016  -13.4869    11.7016  11.8911    120         35.6703     120         
1 1 1 44 0  12 o 8  18.5098 7.90054 8.99518     13.3892  8.99518     13.3892  3.41286    180         1.06538     8.60011e-06 
1 1 1 44 0  13 o 12 18.1412 8.03493 7.1558      15.0962  7.1558      15.0962  5.42313    60          6.06228     240         
1 1 1 44 0  14 o 12 12.4518 6.04269 -5.82572    12.1653  -5.82572    12.1653  0.374613   300         2.95745     300         
1 1 1 44 0  15 o 3  13.6293 6.51144 -3.24643    13.0081  -3.24643    13.0081  0.915109   180         11.8718     180         
1 1 1 44 0  16 o 8  74.1017 4.85487 105.471     17.6533  105.471     17.6533  58.5881    240         4.19087     240         
1 1 1 44 0  17 o 2  34.8143 8.94105 32.3274     14.3374  32.3274     14.3374  14.5922    300         23.8259     120         
1 1 1 44 0  18 o 4  16.1684 7.27111 4.26822     12.9001  4.26822     12.9001  15.0316    180         54.0398     180         
1 1 1 44 0  19 o 16 15.7405 7.37259 0.280029    15.2701  0.280029    15.2701  0.783051   60          20.8353     60          
1 1 1 44 0  20 o 8  44.6647 7.98526 45.8411     15.4552  45.8411     15.4552  28.2004    120         11.4299     300         
1 1 1 44 0  21 o 19 23.0564 8.74064 16.9599     13.8632  16.9599     13.8632  9.35622    180         14.95       8.75075e-06 
1 1 1 44 0  22 o 8  16.7206 7.51395 4.82549     13.7466  4.82549     13.7466  3.72698    240         11.9969     60          
1 1 1 44 0  23 o 14 45.5567 8.1433  47.8352     16.0759  47.8352     16.0759  49.3753    120         29.9516     120         
1 1 1 44 0  24 o 17 32.5556 10.281  32.9431     17.8173  32.9431     17.8173  31.7754    180         18.489      180         
1 1 1 44 0  25 o 3  35.2141 10.5904 37.8544     18.9786  37.8544     18.9786  36.0048    60          20.9558     60          
1 1 1 44 0  26 o 4  24.3943 9.56594 19.9725     17.191   19.9725     17.191   16.8815    300         0.408535    120         
1 1 1 44 0  27 o 5  17.3706 7.9707  4.14689     16.529   4.14689     16.529   5.50615    180         10.9174     360         
1 1 1 44 0  28 o 10 12.8781 6.4036  -13.0209    16.0463  -13.0209    16.0463  0.0675899  60.0001     10.9165     240         
1 1 1 44 0  29 o 16 29.6351 10.5672 30.6389     19.4021  30.6389     19.4021  7.34263    120         5.40161     120         
1 1 1 44 0  30 o 16 17.6957 8.14157 4.84841     17.4058  4.84841     17.4058  2.81823    180         18.8342     8.66936e-06 
1 1 1 44 0  31 o 19 12.5191 6.27879 -15.9604    16.5499  -15.9604    16.5499  0.115133   59.9999     7.10158     240         
1 1 1 44 0  32 o 7  21.3524 9.23227 14.8737     18.7964  14.8737     18.7964  11.6639    120         3.74406     300         
1 1 1 44 0  33 o 5  18.0969 8.66501 1.11371     23.2875  1.11371     23.2875  1.63236    180         21.411      360         
1 1 1 44 0  34 o 8  22.7866 10.2945 18.9899     26.2172  18.9899     26.2172  10.327     240         10.2934     60          
1 1 1 44 0  35 o 5  17.228  8.50149 -7.17229    26.7501  -7.17229    26.7501  1.42477    300         18.0315     120         
1 1 1 44 0  36 f 0  15.3566 7.62527 -10.8612    22.5103  -10.8612    22.5103  6.14763    1.45775e-06 0           0           
1 1 1 44 0  37 o 8  30.1631 11.8629 41.9226     26.5286  41.9226     26.5286  22.3932    60          6.08361     60          
1 1 1 44 0  38 o 19 19.2848 9.19991 7.29499     25.7842  7.29499     25.7842  4.6559     120         8.85652     300         
1 1 1 44 0  39 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 0  40 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 1  0  o 9  17.4408 7.44306 7.7274      11.8797  7.7274      11.8797  4.42304    2.55608e-05 10.2538     180         
1 1 1 44 1  1  o 12 48.8968 5.76992 52.491      13.8505  48.1645     13.4283  42.8972    33.45       14.7627     33.45       
1 1 1 44 1  2  o 13 25.3491 6.90348 18.696      13.4127  6.79822     11.8132  13.5039    186.738     3.78814     6.73783     
1 1 1 44 1  3  o 4  43.3016 6.8831  36.4489     14.8457  48.5093     14.4272  31.4845    186.821     0.471681    186.821     
1 1 1 44 1  4  o 1  50.7289 6.19952 47.5382     15.0437  63.588      15.1398  45.2083    343.215     16.6698     343.215     
1 1 1 44 1  5  o 9  52.661  5.95399 62.9613     15.2689  54.8058     15.0497  44.0363    299.544     10.7016     299.544     
1 1 1 44 1  6  o 12 59.4941 5.92959 91.4449     16.8203  59.1726     16.6834  52.6405    340.793     17.2206     340.793     
1 1 1 44 1  7  o 12 44.3213 6.90826 43.2111     15.2163  45.6016     14.6486  26.1448    238.486     12.4811     58.4863     
1 1 1 44 1  8  o 16 38.8136 7.31242 36.9078     14.6168  33.8782     14.3557  30.9458    264.828     8.32056     264.828     
1 1 1 44 1  9  f 0  42.3301 6.9966  32.3551     14.8799  50.1933     14.6709  21.5778    166.113     0           0           
1 1 1 44 1  10 o 15 21.9899 6.67392 4.12873     13.3959  6.55215     13.0401  7.40195    214.855     10.9515     34.8555     
1 1 1 44 1  11 o 18 19.0928 6.15835 -1.1177     12.9284  -3.7999     13.2178  4.36397    53.6633     2.19306     233.663     
1 1 1 44 1  12 o 2  23.6527 7.15771 14.5836     15.645   -2.2807     15.5967  11.4709    116.121     0.132629    116.121     
1 1 1 44 1  13 o 15 50.6158 6.99205 61.7732     18.5362  54.1658     15.6566  34.2028    221.838     5.98717     41.8382     
1 1 1 44 1  14 o 15 18.0968 5.92283 3.49761     12.9412  -25.4529    14.6468  2.88262    132.936     1.46715     312.936     
1 1 1 44 1  15 f 0  41.4251 7.14962 49.0248     15.0757  31.1344     14.8302  40.9188    39.2432     0           0           
1 1 1 44 1  16 o 15 27.4684 7.3997  14.9258     14.2487  18.165      14.0604  16.0116    101.08      8.22113     101.08      
1 1 1 44 1  17 o 5  28.6986 7.25834 7.75445     13.9777  28.0216     14.3195  4.14305    123.302     32.2427     303.302     
1 1 1 44 1  18 o 4  24.9026 7.2887  8.28198     15.9447  12.8074     14.0324  11.2359    128.157     9.56435     308.157     
1 1 1 44 1  19 o 15 24.8561 7.37038 11.2257     14.4759  9.07752     16.603   11.6856    38.0114     8.49516     218.011     
1 1 1 44 1  20 o 12 32.1396 8.29182 27.6289     17.4914  24.1924     17.2553  25.5442    7.29075     14.8455     7.29074     
1 1 1 44 1  21 o 19 47.2421 8.30766 53.9721     20.2441  57.089      18.9875  39.9889    37.3242     12.3191     37.3242     
1 1 1 44 1  22 o 7  34.138  8.60356 25.5539     18.6677  35.6968     18.8211  24.2777    55.8674     2.17987     55.8673     
1 1 1 44 1  23 o 12 28.5592 8.19987 8.48488     20.5313  25.5016     17.9347  20.3347    282.067     6.40608     282.067     
1 1 1 44 1  24 o 15 20.5153 6.75697 -1.93784    16.7333  -7.74247    17.2416  6.77381    239.866     1.58464     239.866     
1 1 1 44 1  25 o 6  20.0197 6.6875  -11.3789    17.709   -4.8198     17.613   8.58799    14.0167     1.25007     194.017     
1 1 1 44 1  26 o 5  31.1202 8.48067 18.0431     19.7767  32.4858     18.7158  21.3387    333.408     1.96224     333.408     
1 1 1 44 1  27 o 3  21.6767 7.05199 -6.7054     17.2521  5.39971     18.1599  3.04448    187.103     1.22362     187.103     
1 1 1 44 1  28 o 5  20.9453 6.87713 6.99283     18.0386  -14.9718    17.3035  9.16656    165.113     0.924229    165.113     
1 1 1 44 1  29 o 9  20.9401 6.89715 -1.37411    17.7779  -2.93357    17.5135  4.17998    339.724     1.16574     339.724     
1 1 1 44 1  30 o 14 30.1545 8.63803 21.3824     20.8063  31.0291     20.2325  20.7344    56.2499     10.524      56.2499     
1 1 1 44 1  31 o 18 23.0665 7.37934 13.8556     18.6896  -3.02503    18.5005  10.6703    40.1825     3.94769     220.183     
1 1 1 44 1  32 f 0  54.4141 8.7142  94.3766     23.2701  73.1499     23.4055  27.9354    311.656     0           0           
1 1 1 44 1  33 o 12 24.7622 7.78478 14.0628     19.9941  12.2718     18.7754  11.6111    97.9216     1.97752     97.9216     
1 1 1 44 1  34 o 17 21.763  7.15791 10.1976     19.5928  -5.69992    18.3877  7.48592    110.88      6.82836     290.88      
1 1 1 44 1  35 o 11 19.9506 6.72571 -1.55933    19.0858  -7.57506    18.1552  2.70868    208.345     1.19272     28.3452     
1 1 1 44 1  36 o 12 25.2279 8.08629 -4.22071    28.9962  24.3349     20.2327  10.4962    189.52      0.389553    189.52      
1 1 1 44 1  37 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 1  38 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 2  0  o 12 16.1321 7.49528 1.62657     15.2897  1.62657     15.2897  0.255795   1.00519e-05 21.3368     1.00519e-05 
1 1 1 44 2  1  o 3  26.0534 7.36796 2.53025     15.0133  22.2135     15.604   12.8633    293.649     5.81299     293.649     
1 1 1 44 2  2  o 7  44.5759 7.65194 54.3625     16.841   40.9533     17.2786  25.0344    332.961     15.407      152.961     
1 1 1 44 2  3  o 3  23.2115 6.95618 0.0913786   13.3016  14.2128     15.1915  4.39096    296.263     1.69442     296.263     
1 1 1 44 2  4  o 14 54.9335 6.44597 71.309      16.0316  60.6002     17.8446  49.4851    159.29      18.1236     159.29      
1 1 1 44 2  5  o 2  24.423  7.17315 6.29209     15.4887  13.0463     13.8441  12.1685    307.556     5.3775      127.556     
1 1 1 44 2  6  o 3  31.7168 7.52092 17.7587     14.2871  30.355      14.578   24.7713    95.9303     10.6736     95.9303     
1 1 1 44 2  7  o 9  16.2644 5.54147 -18.5975    13.9431  -10.6469    13.0724  0.777249   74.5076     15.7537     254.508     
1 1 1 44 2  8  o 3  22.8449 6.90591 3.2966      14.0518  9.71622     14.1747  10.0761    66.8094     7.39303     246.809     
1 1 1 44 2  9  o 5  20.3528 6.42138 1.69741     13.0979  0.282894    13.5473  8.21639    72.6838     4.01427     252.684     
1 1 1 44 2  10 o 6  17.4138 5.79087 -4.30552    13.1178  -12.1525    12.8897  4.20912    148.177     8.4665      328.177     
1 1 1 44 2  11 o 16 36.6404 7.74957 27.1844     16.4293  38.455      15.0073  31.8878    6.60978     15.0877     6.60978     
1 1 1 44 2  12 o 14 35.1213 7.81779 39.2477     15.5162  20.936      16.9972  24.7905    5.39062     0.76357     5.39063     
1 1 1 44 2  13 o 10 37.1443 7.98229 36.6719     16.6381  32.0813     15.7234  31.5153    354.948     12.5741     354.948     
1 1 1 44 2  14 f 0  29.8222 7.63003 17.6723     14.5859  24.2815     14.9033  16.9726    208.533     0           0           
1 1 1 44 2  15 f 0  26.0488 7.36338 18.9417     14.6787  7.0488      15.1887  19.5502    198.919     0           0           
1 1 1 44 2  16 o 16 24.3556 7.24183 6.46713     14.8223  12.5969     15.298   14.5096    15.7886     0.42443     195.789     
1 1 1 44 2  17 o 12 36.2286 9.35886 41.0186     24.4751  34.3508     19.86    28.7458    257.391     8.58781     257.391     
1 1 1 44 2  18 o 6  24.6485 7.51905 -3.48927    17.9543  17.4568     17.3946  15.2431    313.489     2.25313     313.489     
1 1 1 44 2  19 o 10 37.2045 9.46806 40.8142     20.509   40.4942     25.1295  20.5555    227.539     11.6886     47.5386     
1 1 1 44 2  20 o 10 29.633  8.39777 23.9108     18.9199  19.6632     19.0844  22.0925    297.26      11.011      297.26      
1 1 1 44 2  21 o 9  23.3366 7.41039 -2.23687    18.6162  9.92759     17.9673  9.45017    218.771     4.21904     218.771     
1 1 1 44 2  22 o 1  30.7567 8.53576 25.4142     18.8849  25.2779     19.5359  23.3789    275.568     8.77297     275.568     
1 1 1 44 2  23 o 6  24.2662 7.57776 19.5405     19.386   -7.11981    18.1362  7.74963    181.483     4.0813      181.483     
1 1 1 44 2  24 o 9  31.9714 8.64419 22.1126     20.2579  35.1617     19.2888  17.4538    180.202     9.03992     0.202079    
1 1 1 44 2  25 o 9  25.0772 7.76783 15.2569     18.7843  7.23089     18.6745  5.47758    252.272     23.023      72.2722     
1 1 1 44 2  26 o 11 24.6159 7.7242  12.2504     18.6855  8.11456     19.4125  11.3237    211.904     4.88198     211.904     
1 1 1 44 2  27 o 9  23.0417 7.46412 -12.1417    23.6098  12.7769     18.0814  10.5681    347.808     5.50909     167.808     
1 1 1 44 2  28 o 13 19.9043 6.78303 -6.37216    17.7235  -15.399     22.9587  2.90029    107.264     0.0330024   107.264     
1 1 1 44 2  29 o 14 35.7408 9.03521 50.8972     21.1715  33.2186     20.7054  28.4635    305.036     16.8989     305.036     
1 1 1 44 2  30 o 4  20.0862 6.72114 -22.3305    17.8787  9.0026      18.8196  1.91306    122.893     0.161961    302.893     
1 1 1 44 2  31 o 7  19.8305 6.67698 -4.53956    18.2456  -5.04138    18.2683  2.14908    283.015     0.542778    103.015     
1 1 1 44 2  32 o 9  27.2858 8.32801 27.9061     21.4061  17.7505     20.2436  13.8804    69.7145     4.06363     69.7145     
1 1 1 44 2  33 o 5  22.0638 7.17139 -15.7449    19.5866  18.4659     18.9432  5.63319    2.30584     0.71069     182.306     
1 1 1 44 2  34 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 2  35 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 2  36 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 3  0  o 14 30.8888 10.5301 31.6808     18.9076  31.6808     18.9076  22.6469    2.49352e-05 1.95359     180         
1 1 1 44 3  1  o 6  20.631  6.77697 -5.48719    17.1419  -3.4754     16.5937  9.47542    119.077     0.898845    299.077     
1 1 1 44 3  2  o 5  23.5324 7.36194 3.93431     17.2087  6.63364     17.081   10.4159    139.832     4.44981     139.832     
1 1 1 44 3  3  o 16 27.9098 8.40309 34.7032     24.5547  -3.33536    17.5474  17.696     103.126     0.535185    283.126     
1 1 1 44 3  4  f 0  25.1533 7.83594 10.5727     17.8219  5.1515      20.9711  23.3155    162.417     0           0           
1 1 1 44 3  5  o 1  40.1186 8.34145 58.3666     19.5842  25.4839     18.7498  32.9599    158.907     9.06329     158.907     
1 1 1 44 3  6  o 14 36.6542 8.74441 41.6793     19.7819  30.5764     18.5337  22.4259    280.034     7.57686     100.034     
1 1 1 44 3  7  o 9  24.9363 7.34122 14.8284     14.5992  5.68851     16.4531  15.9326    21.599      2.24227     21.5989     
1 1 1 44 3  8  o 13 26.8432 7.75216 14.8153     15.5002  15.0718     17.5568  15.1716    337.673     5.40115     157.673     
1 1 1 44 3  9  o 4  29.9973 8.10527 23.2105     16.2041  20.564      17.9242  22.2568    49.6399     5.59493     49.6399     
1 1 1 44 3  10 o 17 26.4131 7.96378 15.2176     19.0642  10.7652     18.078   17.6611    175.613     3.53981     175.613     
1 1 1 44 3  11 o 13 31.0507 8.19321 29.7061     16.6383  17.7847     18.7611  12.7716    193.648     18.549      13.6478     
1 1 1 44 3  12 o 11 25.6105 7.44726 14.9955     15.5551  10.66       15.2384  16.9289    231.278     6.767       231.278     
1 1 1 44 3  13 o 1  26.5555 7.62277 31.3448     19.1617  -5.20097    14.9591  15.1169    20.0092     8.72367     20.0092     
1 1 1 44 3  14 o 4  28.8813 8.39139 19.6655     20.6535  20.4123     18.4315  21.3082    255.736     9.20371     255.736     
1 1 1 44 3  15 o 7  22.0589 7.05953 -14.9696    19.0643  10.6428     16.5905  2.81284    260.002     1.29101     260.002     
1 1 1 44 3  16 o 15 29.6619 9.01533 31.3589     28.285   16.1621     19.727   12.0922    38.5554     8.17916     38.5554     
1 1 1 44 3  17 o 2  35.4141 7.83477 -2.68401    21.7357  59.0876     19.352   28.0202    16.5136     7.27094     16.5136     
1 1 1 44 3  18 o 16 22.6987 7.31783 11.3166     19.5438  -7.06294    17.5428  7.27556    165.653     3.22394     165.653     
1 1 1 44 3  19 o 14 23.1413 7.31037 -15.466     19.5317  17.0096     17.9315  11.7274    48.5942     4.85745     228.594     
1 1 1 44 3  20 o 14 25.4163 8.12222 4.54019     27.7044  12.9422     18.2351  15.8741    264.299     3.89732     264.299     
1 1 1 44 3  21 o 17 21.3264 7.0334  -10.3804    19.5322  4.39741     18.0244  1.03738    155.463     26.4238     335.463     
1 1 1 44 3  22 o 14 35.7751 9.25065 40.7388     22.4891  41.4319     20.8642  21.3271    38.5611     7.17656     218.561     
1 1 1 44 3  23 f 0  17.7599 6.13281 -17.7078    18.6341  -17.4125    17.221   1.11104    297.298     0           0           
1 1 1 44 3  24 o 2  22.4269 7.26574 -1.6522     19.3793  9.09316     17.9797  10.0479    145.402     4.93343     325.402     
1 1 1 44 3  25 o 14 23.969  7.58335 27.9431     21.1055  -14.6274    18.4106  12.2101    113.47      0.98348     293.47      
1 1 1 44 3  26 o 10 29.6117 8.57797 38.3766     21.5591  17.3375     19.8036  18.3202    301.157     0.0427074   121.158     
1 1 1 44 3  27 o 15 24.025  7.6946  14.4525     20.6671  7.90165     19.1776  3.77578    224.591     1.33286     224.591     
1 1 1 44 3  28 o 4  23.4905 7.49001 -4.25912    20.3692  19.7827     18.7513  10.3109    58.3454     1.73695     238.345     
1 1 1 44 3  29 o 16 29.3764 8.67424 28.4288     22.2898  31.225      20.5266  17.5619    223.606     1.25495     223.606     
1 1 1 44 3  30 o 10 27.5476 8.43656 28.0104     22.2303  21.6725     20.6724  12.826     197.797     4.31834     197.797     
1 1 1 44 3  31 x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 3  32 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 3  33 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 4  0  o 14 14.7583 7.21289 -7.754      18.0773  -7.754      18.0773  2.77469    6.09256e-05 10.8605     180         
1 1 1 44 4  1  o 7  18.5388 6.40412 -19.0393    22.2388  -18.4875    16.0373  6.64599    271.223     0.986129    91.2229     
1 1 1 44 4  2  o 6  26.1468 7.6783  26.7885     18.161   -5.74343    18.053   13.9065    107.04      8.01979     107.04      
1 1 1 44 4  3  o 5  26.5523 8.26188 12.4326     18.1343  13.6456     24.7491  15.4297    254.565     3.74361     74.5646     
1 1 1 44 4  4  o 7  18.7921 6.37674 -18.057     17.7361  -8.42488    17.1582  7.32161    83.6556     1.26767     263.656     
1 1 1 44 4  5  o 6  25.8211 7.83215 9.51837     17.902   15.6782     18.484   5.58491    43.5191     3.47748     43.5191     
1 1 1 44 4  6  o 3  27.0382 8.1208  17.5566     19.4315  14.0032     18.9387  17.9325    82.8035     1.8706      82.8035     
1 1 1 44 4  7  o 17 29.3473 8.42912 10.3119     19.6555  32.1461     20.4406  14.9576    269.264     10.7208     89.2642     
1 1 1 44 4  8  o 8  35.5511 8.43093 3.72986     22.2725  60.4383     21.4627  30.6703    143.585     13.7128     143.585     
1 1 1 44 4  9  f 0  22.1644 8.21247 13.2906     56.7028  -38.3528    16.7815  6.92703    33.1794     0           0           
1 1 1 44 4  10 o 3  27.2405 8.8053  19.2251     26.6615  6.86654     27.4555  12.5564    328.598     11.6847     148.598     
1 1 1 44 4  11 o 6  27.902  9.29276 26.513      28.1902  -48.708     56.5132  18.4354    129.228     3.07518     129.228     
1 1 1 44 4  12 o 8  31.4764 9.15968 -24.0871    30.6239  58.2004     27.1915  23.9591    157.715     13.9147     157.715     
1 1 1 44 4  13 o 12 22.5096 7.89499 -6.83962    18.1284  -50.1053    54.0528  11.7442    287.577     0.70715     287.577     
1 1 1 44 4  14 o 10 37.255  9.87711 50.761      22.997   44.1858     28.7092  28.5058    78.4429     5.73313     78.4429     
1 1 1 44 4  15 o 2  30.5867 9.56949 23.4169     30.1906  36.2589     28.3875  21.1953    20.789      11.8002     20.7891     
1 1 1 44 4  16 o 6  20.5578 7.0249  -21.3942    19.4304  -0.428442   23.5136  4.03886    157.138     18.277      337.138     
1 1 1 44 4  17 o 12 25.1086 8.13537 7.15349     20.2995  14.2059     25.754   14.74      175.95      3.39929     175.95      
1 1 1 44 4  18 o 3  20.2471 6.90536 -7.75352    19.5104  -13.7759    22.6021  1.34366    116.962     0.249696    116.962     
1 1 1 44 4  19 o 17 22.929  7.56584 11.8819     19.7355  -14.7336    25.8985  11.3021    176.997     1.74719     356.997     
1 1 1 44 4  20 o 4  23.7886 7.56361 -7.14929    20.0374  20.8895     19.5364  12.203     165.121     1.81959     345.121     
1 1 1 44 4  21 o 5  23.9665 7.7156  11.1815     20.8134  8.94338     19.9114  12.0006    52.6088     2.23746     232.609     
1 1 1 44 4  22 o 6  27.8772 8.45893 29.8675     21.7702  17.9516     20.8379  11.4124    144.454     14.006      324.454     
1 1 1 44 4  23 o 3  25.9323 8.14153 23.5363     21.7763  12.5085     20.6002  10.8056    336.44      11.0624     156.44      
1 1 1 44 4  24 o 13 24.9551 7.77272 -8.6735     20.9614  30.5807     20.2819  11.2651    335.899     6.92592     155.899     
1 1 1 44 4  25 o 12 23.3665 7.87305 -9.19754    21.3521  23.6899     28.1191  9.30635    112.521     0.930946    292.521     
1 1 1 44 4  26 o 1  25.1071 7.92907 32.5991     21.8489  -6.7609     21.556   8.7871     240.08      2.30359     240.079     
1 1 1 44 4  27 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 4  28 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 4  29 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 4  30 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 5  0  o 11 17.5996 8.22919 4.03328     18.8927  4.03328     18.8927  5.83858    180         11.9068     360         
1 1 1 44 5  1  o 12 24.1366 7.64997 -4.17386    19.7674  17.8825     19.6507  12.8797    124.282     5.41192     124.282     
1 1 1 44 5  2  o 9  24.3168 7.77816 7.51507     20.9651  9.23245     19.6792  14.573     338.955     0.757839    338.955     
1 1 1 44 5  3  o 1  28.0847 8.39454 25.6851     20.8229  15.8433     20.0121  9.59606    7.75306     6.33086     7.75306     
1 1 1 44 5  4  o 4  24.5053 7.64128 25.9163     20.1217  -15.2366    19.728   14.1387    183.023     5.52341     183.023     
1 1 1 44 5  5  f 0  30.4158 9.07049 14.7346     30.8305  36.4122     21.6594  22.8299    93.6849     0           0           
1 1 1 44 5  6  o 12 23.8043 8.00152 8.94207     26.4712  -9.63661    25.6794  13.4202    239.682     2.06432     239.682     
1 1 1 44 5  7  o 2  32.8248 9.93386 41.9781     30.6073  39.5221     27.6696  24.8351    302.693     7.76922     302.693     
1 1 1 44 5  8  o 17 28.0986 9.06439 19.2572     30.425   23.3743     26.5995  18.925     215.597     5.98591     215.597     
1 1 1 44 5  9  f 0  29.204  10.0249 85.8873     61.0789  6.56128     25.7941  9.90237    354.664     0           0           
1 1 1 44 5  10 o 18 23.2715 7.84401 14.5461     26.3226  -19.4452    24.6998  8.03953    147.225     14.0081     327.225     
1 1 1 44 5  11 o 4  24.3564 8.50662 2.22769     27.5942  -50.0371    59.8194  3.53718    54.7353     26.0149     234.735     
1 1 1 44 5  12 o 7  35.6651 10.1962 36.4061     32.6363  66.8771     28.3807  28.735     6.63079     12.5349     6.63079     
1 1 1 44 5  13 o 15 24.3707 8.19439 13.6774     28.8534  -1.50472    25.4304  13.0085    246.969     1.14144     246.969     
1 1 1 44 5  14 o 6  33.717  10.3428 65.6183     33.04    39.8959     32.728   22.9925    278.622     1.84879     278.622     
1 1 1 44 5  15 o 14 26.6595 8.80776 25.8679     30.6175  13.1813     27.4754  15.5219    331.037     1.20211     331.037     
1 1 1 44 5  16 o 16 26.6693 8.84758 18.3261     33.0816  21.3139     27.4083  15.2786    320.643     1.12623     320.643     
1 1 1 44 5  17 o 7  21.448  7.3784  -21.9455    26.7248  2.10359     24.6637  2.5235     291.899     0.341197    291.899     
1 1 1 44 5  18 o 18 25.8911 8.37498 21.717      21.9453  12.4331     28.4176  8.8172     37.2034     3.66124     37.2034     
1 1 1 44 5  19 o 15 30.1045 8.93337 44.6181     22.2099  17.0693     28.8175  14.7728    35.9315     8.24021     35.9315     
1 1 1 44 5  20 o 6  40.7171 10.5713 63.6692     25.2517  82.8649     31.4767  32.6899    311.231     11.6314     311.231     
1 1 1 44 5  21 o 4  24.1028 7.92732 17.2664     21.2995  3.39878     26.6612  10.3753    267.637     5.52282     87.637      
1 1 1 44 5  22 o 8  26.051  8.42491 3.96522     21.3797  38.9442     27.4571  12.7655    17.6864     1.04534     17.6864     
1 1 1 44 5  23 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 5  24 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 5  25 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 5  26 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 6  0  f 0  19.1127 9.34495 1.85469     30.4224  1.85469     30.4224  15.5794    0.000104977 0           0           
1 1 1 44 6  1  o 3  25.3519 8.26058 -6.85468    34.4992  22.0085     20.8955  13.3709    199.535     4.02102     199.535     
1 1 1 44 6  2  o 16 22.23   7.65585 7.64236     28.9493  -19.2031    24.985   6.51951    76.5722     1.38236     76.5722     
1 1 1 44 6  3  o 18 20.9769 7.28432 -7.26256    28.0793  -18.6231    24.1263  2.56042    215.922     0.386165    215.922     
1 1 1 44 6  4  o 3  21.6261 7.47482 3.97563     28.9222  -19.1947    23.2626  8.2193     252.179     0.0643659   72.1787     
1 1 1 44 6  5  f 0  24.7402 8.33252 -10.6585    33.0333  21.063      26.8577  7.37938    217.188     0           0           
1 1 1 44 6  6  o 12 31.0276 9.65906 10.5576     34.4046  63.1967     30.2934  17.7814    92.1383     5.69222     272.138     
1 1 1 44 6  7  o 14 21.1586 7.38594 -15.1661    31.9325  -14.3206    24.5546  7.54237    149.251     1.0094      329.251     
1 1 1 44 6  8  o 11 23.8842 11.2676 0           0        8.36692     24.8543  8.39313    328.654     5.09777     148.654     
1 1 1 44 6  9  o 19 30.5365 9.76051 63.6448     35.005   23.7326     28.4288  19.6275    134.273     1.59385     134.273     
1 1 1 44 6  10 o 17 25.3025 8.95312 0.75572     31.7687  26.7512     67.7502  11.7485    309.158     2.28868     309.158     
1 1 1 44 6  11 o 17 33.8787 10.5342 71.7252     37.002   55.522      32.1182  17.393     253.747     11.5768     73.7468     
1 1 1 44 6  12 o 17 23.8185 8.09861 7.47238     29.9761  6.42311     26.717   10.9531    81.5462     2.57541     261.546     
1 1 1 44 6  13 o 8  23.5814 8.01947 -14.0411    30.3201  18.9753     27.0786  10.4836    47.7806     2.46905     227.781     
1 1 1 44 6  14 f 0  29.5133 9.50892 40.495      33.341   40.3385     29.1537  17.9289    228.01      0           0           
1 1 1 44 6  15 o 11 38.6759 11.0636 81.3292     36.811   83.4887     31.4379  27.9857    148.158     4.57892     148.158     
1 1 1 44 6  16 o 11 26.1147 8.65619 16.0444     30.5303  27.1653     27.2991  9.30672    97.6356     3.01056     97.6356     
1 1 1 44 6  17 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 6  18 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 6  19 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 6  20 x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 6  21 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  0  x 19 ?       ?       ?           ?        ?           ?        4.544      180         0           0           
1 1 1 44 7  1  x 15 ?       ?       ?           ?        ?           ?        14.6229    184.592     0           0           
1 1 1 44 7  2  x 6  ?       ?       ?           ?        ?           ?        3.85267    12.8242     0           0           
1 1 1 44 7  3  o 7  23.103  11.4208 -1.98254    34.3262  0           0        4.30412    316.798     2.05275     136.798     
1 1 1 44 7  4  o 15 22.7811 11.1938 -1.34383    31.333   0           0        5.79542    327.594     9.40716     147.594     
1 1 1 44 7  5  o 14 18.2329 9.22272 -45.7844    29.2179  0           0        1.02672    207.698     2.98317     27.6981     
1 1 1 44 7  6  o 1  22.2136 7.72943 10.4156     32.9841  -14.4711    25.6565  3.11268    196.654     0.158503    196.654     
1 1 1 44 7  7  o 14 19.6389 9.67519 0           0        -14.3895    23.9159  0.985565   192.659     1.42437     12.6591     
1 1 1 44 7  8  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  9  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  10 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  11 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  12 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  13 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  14 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 44 7  15 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 0  0  o 8  12.6125 6.38493 -26.4263    18.6868  -26.4263    18.6868  6.5131     360         18.7154     360         
1 1 1 45 0  1  o 11 37.9977 9.48955 38.714      16.4145  38.714      16.4145  28.6425    240         1.16445     60.0002     
1 1 1 45 0  2  o 4  63.1715 6.09283 80.8661     18.2737  80.8661     18.2737  62.8661    300         28.4418     300         
1 1 1 45 0  3  o 13 37.3007 8.84446 35.8464     14.7512  35.8464     14.7512  20.0894    360         17.25       180         
1 1 1 45 0  4  o 19 86.5455 4.37906 141.395     18.7649  141.395     18.7649  84.9747    240         36.7049     240         
1 1 1 45 0  5  o 3  19.747  8.20695 11.4659     13.7426  11.4659     13.7426  2.67096    120         23.4459     300         
1 1 1 45 0  6  o 19 44.4119 7.69485 44.7968     14.8319  44.7968     14.8319  53.2356    180         40.2168     180         
1 1 1 45 0  7  o 4  26.5535 9.88473 23.8153     17.4603  23.8153     17.4603  18.0083    60          8.78382     60          
1 1 1 45 0  8  o 13 26.74   9.75614 23.8028     16.7648  23.8028     16.7648  19.2952    120         0.0178135   120.002     
1 1 1 45 0  9  o 12 14.4106 6.79476 -1.07934    13.3364  -1.07934    13.3364  1.21873    360         8.86987     180         
1 1 1 45 0  10 o 12 14.2847 6.7782  -1.99702    13.6498  -1.99702    13.6498  5.97992    240         31.5684     240         
1 1 1 45 0  11 o 12 19.5638 8.39982 10.5383     15.323   10.5383     15.323   4.32545    120         19.6018     300         
1 1 1 45 0  12 o 4  12.6361 6.17881 -7.5481     13.3068  -7.5481     13.3068  0.62972    180         10.7649     180         
1 1 1 45 0  13 o 13 18.8051 8.07285 9.41216     14.1487  9.41216     14.1487  4.7523     60          0.258965    60          
1 1 1 45 0  14 o 16 18.8522 8.11682 9.40043     14.3939  9.40043     14.3939  8.66128    120         2.16895     300         
1 1 1 45 0  15 o 5  21.1015 8.71319 13.725      15.3224  13.725      15.3224  12.7879    180         0.269148    360         
1 1 1 45 0  16 o 14 47.632  8.44387 52.792      17.4346  52.792      17.4346  27.275     60          18.2989     240         
1 1 1 45 0  17 o 15 13.7392 6.75557 -9.82751    16.4841  -9.82751    16.4841  1.55686    300         4.32698     120         
1 1 1 45 0  18 o 19 17.5043 8.47407 -4.8078     23.6004  -4.8078     23.6004  10.921     360         48.344      360         
1 1 1 45 0  19 o 10 19.8307 8.73285 10.3602     17.5689  10.3602     17.5689  10.5603    240         4.07423     60          
1 1 1 45 0  20 o 4  15.8583 7.52815 -1.14991    16.8708  -1.14991    16.8708  0.913329   120         24.1633     120         
1 1 1 45 0  21 o 11 38.1225 10.7112 43.6287     19.754   43.6287     19.754   39.7392    180         22.3532     180         
1 1 1 45 0  22 o 19 23.8951 9.73839 20.0332     18.7498  20.0332     18.7498  16.867     240         6.14894     240         
1 1 1 45 0  23 o 18 18.1967 8.37501 5.64712     18.441   5.64712     18.441   3.19808    120         0.20264     120         
1 1 1 45 0  24 o 2  30.0705 10.6842 32.3017     19.797   32.3017     19.797   27.0786    180         16.2707     180         
1 1 1 45 0  25 o 9  16.0533 7.68298 -1.57371    18.2663  -1.57371    18.2663  3.58677    240         2.61        60          
1 1 1 45 0  26 o 7  22.1079 9.44008 16.976      19.1317  16.976      19.1317  12.2374    120         5.75427     300         
1 1 1 45 0  27 o 5  18.6256 8.56877 7.4243      19.2752  7.4243      19.2752  0.883779   180         0.0192753   360         
1 1 1 45 0  28 o 8  17.396  8.18697 3.5224      19.2064  3.5224      19.2064  4.27758    60          3.27264     240         
1 1 1 45 0  29 o 18 32.8507 11.1371 40.0737     21.1156  40.0737     21.1156  25.4085    300         17.2401     300         
1 1 1 45 0  30 o 17 14.3851 7.05333 -6.58602    17.643   -6.58602    17.643   0.34697    180         3.15769     8.63048e-06 
1 1 1 45 0  31 o 12 16.2765 7.80979 0.105141    19.1186  0.105141    19.1186  2.06561    240         7.34601     60          
1 1 1 45 0  32 o 18 21.5492 9.4139  17.6644     20.016   17.6644     20.016   5.81728    120         0.0469809   300         
1 1 1 45 0  33 o 8  26.2792 10.499  29.5182     21.1904  29.5182     21.1904  16.1322    3.27843e-06 0.908085    180         
1 1 1 45 0  34 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 0  35 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 0  36 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 1  0  o 1  26.4878 9.99418 23.9881     18.049   23.9881     18.049   5.12389    180.001     3.34347     180.001     
1 1 1 45 1  1  o 15 35.9672 8.07817 13.7019     18.1413  50.8303     18.6551  32.4095    56.8985     20.5484     56.8985     
1 1 1 45 1  2  o 17 37.1732 8.11971 52.3568     18.7484  17.9616     17.7232  25.6919    122.835     1.51076     302.835     
1 1 1 45 1  3  o 15 21.6696 6.80911 16.2856     17.0368  -24.3171    15.428   9.95681    37.5042     2.07988     37.5042     
1 1 1 45 1  4  o 12 38.6911 8.60023 37.7575     18.9015  40.8916     18.3461  26.3085    53.7747     2.76595     233.775     
1 1 1 45 1  5  o 2  46.8019 7.93403 72.5161     19.0124  36.5722     19.377   35.2287    129.85      1.74475     129.85      
1 1 1 45 1  6  o 15 16.7771 5.81955 -25.1418    18.7119  -19.4071    14.3932  3.70587    213.207     10.3022     33.2065     
1 1 1 45 1  7  o 7  27.9453 8.01683 -0.964009   21.5767  26.7325     17.4324  19.0822    32.0172     2.8468      32.0172     
1 1 1 45 1  8  o 15 25.5262 7.40222 2.54144     14.3631  21.0833     16.6866  16.2371    280.549     1.0353      280.549     
1 1 1 45 1  9  o 10 24.8832 7.1937  19.7478     15.229   0.170164    14.6918  16.2815    264.586     4.31885     264.586     
1 1 1 45 1  10 o 14 22.4982 6.92257 2.01001     14.711   8.35497     14.6387  6.38711    320.34      17.3333     140.34      
1 1 1 45 1  11 o 18 22.092  7.2347  1.3912      20.979   -4.56424    16.6479  5.33248    264.832     18.7257     84.8316     
1 1 1 45 1  12 o 1  19.3587 6.31301 -9.1362     14.102   1.06681     14.5817  8.25694    208.742     3.87679     28.7417     
1 1 1 45 1  13 o 18 29.9295 7.76959 13.9259     15.9535  28.7791     15.6971  21.7932    68.2709     4.25224     68.2709     
1 1 1 45 1  14 o 4  20.8001 6.81844 -11.9917    17.5409  2.83987     16.8919  9.61248    299.342     4.40785     119.342     
1 1 1 45 1  15 o 3  23.0846 7.29691 -5.56165    18.2383  11.4062     17.3004  7.83586    212.728     14.818      32.7284     
1 1 1 45 1  16 o 1  32.147  8.58766 25.1542     19.0886  30.8795     18.9075  23.1502    247.847     3.22233     247.847     
1 1 1 45 1  17 o 15 31.1921 9.06078 33.7032     25.1131  21.7665     20.2116  20.9644    356.993     0.480169    356.993     
1 1 1 45 1  18 o 14 36.4492 10.0095 41.658      27.0647  47.1728     25.6003  29.1416    296.219     9.7944      296.219     
1 1 1 45 1  19 o 15 21.3487 6.97971 -1.5739     17.3791  -0.527597   17.7508  4.80744    134.734     1.81928     134.734     
1 1 1 45 1  20 o 8  27.7656 8.08284 5.96089     18.8902  28.9654     19.0656  18.7849    113.242     3.03986     113.242     
1 1 1 45 1  21 o 16 20.4885 6.97539 -0.669402   23.5059  -17.1688    17.2601  9.1038     261.129     0.860679    81.1289     
1 1 1 45 1  22 o 3  30.3164 8.57365 25.1223     20.028   27.7605     19.4769  22.6091    47.9933     10.1312     47.9933     
1 1 1 45 1  23 o 6  18.5174 6.27384 -3.31952    16.5961  -19.8656    17.1649  4.32865    70.5993     0.724384    250.599     
1 1 1 45 1  24 o 7  26.9455 7.97721 1.00355     19.8786  30.8267     19.1578  16.0524    28.7032     0.799338    208.703     
1 1 1 45 1  25 o 8  21.5075 7.0059  -20.0326    19.3634  14.0892     18.009   7.8766     60.1015     0.56919     60.1015     
1 1 1 45 1  26 o 16 22.3417 7.26548 -4.66557    20.5005  10.8407     17.9229  0.747672   61.0048     0.217493    61.0048     
1 1 1 45 1  27 o 14 23.9848 7.59676 -0.253668   20.0425  19.3709     18.8881  1.08585    256.255     0.417398    256.255     
1 1 1 45 1  28 o 10 23.5562 7.57442 2.21937     20.4599  15.657      19.3032  4.48828    311.843     1.27591     311.843     
1 1 1 45 1  29 o 13 32.2798 8.97842 46.0841     22.1145  28.7384     21.1294  21.4726    127.116     3.61765     127.116     
1 1 1 45 1  30 o 7  23.8746 7.73207 13.506      22.1607  9.55356     19.5017  9.12499    286.122     0.054075    286.121     
1 1 1 45 1  31 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 1  32 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 1  33 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 2  0  o 12 22.1405 9.32236 15.9853     18.151   15.9853     18.151   10.2734    360         4.59337     360         
1 1 1 45 2  1  o 15 27.3283 8.04891 17.9932     18.0276  14.3482     18.596   10.0524    308.252     6.55742     308.252     
1 1 1 45 2  2  o 11 21.8173 6.98128 -14.1961    16.816   11.4596     17.2959  10.8447    122.765     4.42153     302.765     
1 1 1 45 2  3  o 11 31.0925 8.49137 21.5666     19.2198  29.0126     18.6299  24.3815    285.569     9.01983     285.569     
1 1 1 45 2  4  o 19 38.6169 8.81849 52.5065     20.4552  30.6036     19.6775  23.7473    308.712     8.39716     128.712     
1 1 1 45 2  5  o 17 34.1803 8.59555 19.7878     20.1171  42.9809     19.22    27.7869    319.886     9.623       319.886     
1 1 1 45 2  6  o 14 23.2911 7.40273 8.45968     18.0336  -0.0767727  18.2961  13.6038    94.51       1.19857     94.5101     
1 1 1 45 2  7  o 8  29.9795 8.46278 33.2083     20.0484  11.2465     19.9113  22.1494    233.487     5.73498     233.487     
1 1 1 45 2  8  o 2  29.1559 8.4146  28.8725     19.6027  11.9046     20.5067  17.8757    120.028     3.53595     300.028     
1 1 1 45 2  9  o 4  28.4005 8.3022  28.6981     20.066   8.51026     19.585   20.755     191.22      9.19184     191.22      
1 1 1 45 2  10 o 19 25.7034 9.12573 47.1164     55.4346  -18.0817    18.6422  15.4596    97.2824     3.98874     97.2824     
1 1 1 45 2  11 o 6  27.2938 9.77175 -7.37996    24.3348  47.5275     102.68   15.5869    59.0835     3.19416     239.083     
1 1 1 45 2  12 o 3  33.0757 9.85356 46.2619     29.1428  26.298      26.9232  22.4573    194.713     15.1418     194.713     
1 1 1 45 2  13 o 4  22.3594 7.4592  2.17776     19.4385  -13.4433    25.3858  11.7619    250.013     1.67041     70.013      
1 1 1 45 2  14 o 1  31.4097 9.29814 28.6612     21.6989  32.1092     27.895   21.2677    65.5479     0.701557    65.548      
1 1 1 45 2  15 o 11 29.0203 8.8661  21.6998     21.0894  24.2767     26.3478  18.5771    48.7394     0.717443    228.739     
1 1 1 45 2  16 o 19 23.9468 7.9363  13.0779     27.2995  -4.01346    19.5215  10.835     146.08      4.56668     146.08      
1 1 1 45 2  17 o 18 23.6009 7.57287 7.63721     19.2084  5.52478     19.6614  12.5504    146.599     2.88585     326.599     
1 1 1 45 2  18 o 12 22.3546 7.48421 -1.52534    18.8786  -1.3839     25.6581  9.11087    130.026     9.04909     310.026     
1 1 1 45 2  19 o 11 27.7882 8.37024 28.6317     20.9348  12.2988     20.7638  17.9711    60.5505     2.39436     60.5505     
1 1 1 45 2  20 o 13 26.3948 8.01895 32.5695     20.9252  -3.10255    19.8356  14.8759    242.415     2.86515     62.4148     
1 1 1 45 2  21 o 1  26.7562 8.24949 21.4143     21.2702  17.0607     20.3439  14.4666    43.8552     4.37539     223.855     
1 1 1 45 2  22 o 2  26.9137 8.2441  28.8269     21.3302  10.8806     20.259   15.8384    229.016     0.39359     229.016     
1 1 1 45 2  23 o 2  22.7731 7.42527 11.1878     20.0877  1.12488     19.3846  8.1642     291.315     1.28006     291.315     
1 1 1 45 2  24 o 12 21.4598 7.14413 9.89438     20.2725  -10.5128    19.77    7.71581    327.021     6.76741     147.02      
1 1 1 45 2  25 o 11 27.3815 8.22153 38.5663     21.1176  1.45272     21.8228  15.2383    94.5297     4.56364     94.5297     
1 1 1 45 2  26 o 16 26.195  8.12157 9.73224     21.4404  28.3324     20.569   9.1333     97.8079     3.4662      97.8079     
1 1 1 45 2  27 f 0  24.087  7.81038 16.4485     21.3941  8.13762     21.4895  10.2969    188.119     0           0           
1 1 1 45 2  28 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 2  29 x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 2  30 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 3  0  o 7  40.314  11.532  52.1918     22.7648  52.1918     22.7648  25.3068    180         11.786      360         
1 1 1 45 3  1  o 5  23.7877 7.59884 0.402686    19.4677  11.8844     19.4466  14.2427    96.7682     3.12555     96.7682     
1 1 1 45 3  2  o 6  23.2061 7.39412 -14.9568    19.7196  17.5545     18.9453  13.1183    276.231     1.18589     96.2314     
1 1 1 45 3  3  f 0  33.2883 8.70016 46.5618     20.6309  17.2124     20.6446  5.80461    66.7145     0           0           
1 1 1 45 3  4  o 13 24.9874 7.80114 2.44659     19.7836  17.7742     19.2576  15.9649    304.842     3.74254     304.842     
1 1 1 45 3  5  o 4  19.4591 6.59882 -5.93541    18.752   -15.8374    18.3372  8.38954    70.6048     2.00188     250.605     
1 1 1 45 3  6  o 10 24.5476 7.9099  -11.6351    27.2251  16.3356     19.5545  14.6866    113.572     4.9592      113.572     
1 1 1 45 3  7  o 13 31.1112 9.62242 38.8077     28.4609  25.5172     29.0154  22.5054    118.326     5.13072     118.326     
1 1 1 45 3  8  f 0  23.2091 7.87722 -1.14674    27.272   -7.99441    25.6792  17.116     228.531     0           0           
1 1 1 45 3  9  o 10 26.9217 9.46735 65.1        59.2102  -12.6676    24.2159  16.5709    277.364     5.24454     277.364     
1 1 1 45 3  10 f 0  26.1278 9.06279 4.17726     28.1523  -3.1324     58.6173  14.7258    270.581     0           0           
1 1 1 45 3  11 o 14 26.0817 8.5981  9.74585     28.6998  14.0062     26.5132  13.4658    340.183     6.52411     160.183     
1 1 1 45 3  12 o 2  29.1956 9.15271 13.3332     28.0399  37.4676     26.723   16.3726    33.9821     5.98065     213.982     
1 1 1 45 3  13 o 9  21.9735 7.50798 -19.3964    25.2876  1.72144     25.1389  8.05924    134.925     1.73405     134.925     
1 1 1 45 3  14 o 18 27.4325 8.9062  22.2682     29.4542  19.5787     26.3878  17.1538    254.61      5.30752     254.61      
1 1 1 45 3  15 o 18 30.2852 9.61917 45.6038     30.5872  24.4725     31.1067  19.9237    213.164     2.26621     213.164     
1 1 1 45 3  16 o 8  29.6496 9.41757 43.9106     30.3859  22.1009     28.1275  8.73802    50.3274     5.37708     50.3273     
1 1 1 45 3  17 o 5  24.9177 8.37325 3.34628     30.8474  14.5399     26.7704  13.062     320.445     0.88718     320.445     
1 1 1 45 3  18 o 10 30.0549 9.18512 12.3246     22.488   56.1097     28.7739  19.8074    345.461     8.00631     345.461     
1 1 1 45 3  19 o 7  26.2411 8.42561 22.3262     21.65    14.73       27.9966  13.8052    298.092     3.28678     118.092     
1 1 1 45 3  20 o 15 27.4215 8.74267 7.66171     21.507   44.6327     28.7562  12.9467    55.9801     8.70929     235.98      
1 1 1 45 3  21 o 4  34.163  9.80878 49.973      23.4713  51.8878     30.9822  22.5735    267.18      0.852156    267.18      
1 1 1 45 3  22 o 3  22.1354 7.49119 2.7056      20.5432  -0.340309   27.1035  7.93512    248.803     2.5619      68.8035     
1 1 1 45 3  23 o 14 19.2932 6.63549 2.11321     18.8932  -43.7428    25.8408  3.80884    143.655     3.49315     323.656     
1 1 1 45 3  24 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 3  25 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 3  26 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 3  27 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 4  0  o 19 19.9961 9.05957 12.2988     20.4831  12.2988     20.4831  9.20602    6.70048e-05 1.13129     180         
1 1 1 45 4  1  o 14 23.9364 7.68993 13.8958     20.2189  5.13424     20.1504  12.4039    264.017     3.02519     264.017     
1 1 1 45 4  2  o 3  20.8011 7.26631 2.34248     30.6172  -24.5531    19.5321  4.19664    79.4155     0.664519    79.4155     
1 1 1 45 4  3  o 6  28.3588 9.24245 30.8452     32.2827  23.8073     28.5919  13.285     2.39803     7.24854     2.39803     
1 1 1 45 4  4  o 19 25.2682 8.46967 21.1037     30.2859  0.762551    26.844   3.59249    264.063     1.77537     264.063     
1 1 1 45 4  5  o 6  28.7709 9.43784 48.595      35.0826  12.8109     29.5461  15.8279    258.899     5.78853     78.8991     
1 1 1 45 4  6  o 7  23.6767 7.98782 -22.0626    29.5258  18.066      25.8672  3.25753    354.229     1.31906     354.229     
1 1 1 45 4  7  o 14 27.117  8.85049 0.158347    34.3836  33.296      26.4716  15.3828    119.943     5.9637      119.943     
1 1 1 45 4  8  o 7  28.9623 9.8887  77.5632     80.7502  28.1895     28.2926  11.5671    27.9291     15.9124     207.929     
1 1 1 45 4  9  o 3  23.7696 8.03852 15.163      27.6255  -7.32701    26.6741  11.3834    174.122     1.29925     174.122     
1 1 1 45 4  10 o 7  23.8863 8.604   -24.1338    26.931   36.3659     67.1504  10.0913    185.836     1.49778     185.836     
1 1 1 45 4  11 o 15 21.9753 7.56519 5.35613     28.15    -16.1296    24.5723  8.76089    255.464     6.39602     75.4637     
1 1 1 45 4  12 o 6  33.775  10.2887 56.54       33.3637  56.1988     30.1588  24.703     199.938     8.34776     199.938     
1 1 1 45 4  13 o 5  23.3841 7.93432 3.27342     27.5991  5.30201     26.1791  10.5964    96.4465     1.24218     276.447     
1 1 1 45 4  14 o 1  30.1691 9.63622 31.685      30.1892  51.6849     32.0039  11.5733    63.628      6.56866     63.628      
1 1 1 45 4  15 o 9  25.2499 8.44263 24.423      28.7508  6.92349     27.7676  12.4584    154.346     0.847418    154.346     
1 1 1 45 4  16 o 13 23.9191 8.10638 -1.7292     30.1174  15.7947     26.6148  10.6227    339.101     1.61214     159.101     
1 1 1 45 4  17 o 1  24.1379 8.21365 4.10662     31.8737  13.4142     27.3737  5.90226    134.77      1.35922     134.77      
1 1 1 45 4  18 o 13 23.9669 8.06555 -27.6178    29.1851  31.6111     27.2175  8.10079    212.675     0.918165    212.675     
1 1 1 45 4  19 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 4  20 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 4  21 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 4  22 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 5  0  x 16 ?       ?       ?           ?        ?           ?        3.08813    360         0           0           
1 1 1 45 5  1  x 12 ?       ?       ?           ?        ?           ?        6.2071     91.3934     0           0           
1 1 1 45 5  2  o 9  27.4499 13.0055 30.8205     33.7858  0           0        11.3005    187.615     3.24184     7.61512     
1 1 1 45 5  3  o 17 21.9676 10.7943 -6.87937    29.141   0           0        5.11057    123.445     4.15394     303.445     
1 1 1 45 5  4  o 19 27.7043 9.1946  67.693      35.2726  -15.6538    31.3837  13.6016    7.65044     5.21689     7.65043     
1 1 1 45 5  5  o 11 21.8497 7.58962 -16.4664    29.1849  1.06903     28.49    6.61506    294.859     0.399456    114.859     
1 1 1 45 5  6  o 14 24.6544 8.44293 27.5099     33.4223  -3.94778    30.3981  7.96316    292.739     2.11813     292.739     
1 1 1 45 5  7  o 14 24.085  11.6082 0           0        9.64698     29.4946  4.59815    352.802     0.935084    172.802     
1 1 1 45 5  8  o 10 29.1141 9.46976 48.5872     34.8739  33.1029     28.584   16.2961    187.006     6.10483     187.006     
1 1 1 45 5  9  o 9  20.7521 7.26266 -5.83485    30.8448  -18.2712    24.0146  0.383796   265.328     0.0440073   85.3279     
1 1 1 45 5  10 o 16 24.6428 8.38307 8.51689     34.3292  16.9622     27.7066  10.9196    7.31844     0.0352911   7.31821     
1 1 1 45 5  11 o 17 22.7647 7.85795 -18.0405    33.467   11.4768     27.4589  8.57696    211.306     2.57251     31.3058     
1 1 1 45 5  12 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 5  13 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 5  14 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 5  15 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 5  16 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 5  17 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  0  x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  1  x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  2  x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  3  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  4  x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  5  x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  6  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  7  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  8  x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 45 6  9  x 9  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 0  0  o 10 16.3272 8.0234  -15.4188    23.1624  -15.4188    23.1624  0.0976653  180         5.53361     180         
1 1 1 46 0  1  o 8  13.6946 6.76307 -10.9828    17.02    -10.9828    17.02    0.109164   59.9998     0.216708    240         
1 1 1 46 0  2  o 9  15.7997 7.54528 -2.16332    17.4318  -2.16332    17.4318  3.46619    300         2.04705     120         
1 1 1 46 0  3  o 19 16.5453 8.04818 -6.24411    21.8764  -6.24411    21.8764  0.278488   180         23.2933     360         
1 1 1 46 0  4  o 1  11.5796 5.86024 -19.7461    15.6935  -19.7461    15.6935  0.0151932  60          1.70386     60          
1 1 1 46 0  5  o 1  89.1503 7.74306 169.887     33.1969  169.887     33.1969  71.2713    300         4.89154     300         
1 1 1 46 0  6  o 14 21.5375 9.26653 14.5493     18.7321  14.5493     18.7321  1.75371    180         0.819533    180         
1 1 1 46 0  7  o 8  33.7849 11.1407 38.8037     20.9978  38.8037     20.9978  33.6345    240         16.8853     240         
1 1 1 46 0  8  o 14 20.4392 9.53677 7.75201     25.1621  7.75201     25.1621  8.08515    300         2.20818     300         
1 1 1 46 0  9  o 11 28.9436 10.895  31.0761     21.4058  31.0761     21.4058  13.3865    180         9.52766     180         
1 1 1 46 0  10 o 10 24.9513 10.9492 23.4632     27.3754  23.4632     27.3754  18.3996    240         2.24942     240         
1 1 1 46 0  11 o 11 26.8412 11.3933 29.3996     27.5361  29.3996     27.5361  18.6908    120         10.5274     120         
1 1 1 46 0  12 o 15 21.9426 10.1087 13.3272     26.9563  13.3272     26.9563  7.30633    5.35389e-06 3.05059     5.35389e-06 
1 1 1 46 0  13 o 13 14.6724 7.35524 -18.3331    22.6171  -18.3331    22.6171  0.361129   59.9999     0.406213    240         
1 1 1 46 0  14 o 17 18.4177 8.47233 6.3704      18.8378  6.3704      18.8378  8.42514    300         1.9533      120         
1 1 1 46 0  15 o 17 16.8247 8.01266 0.0610352   19.4006  0.0610352   19.4006  4.9493     360         1.85447     180         
1 1 1 46 0  16 o 13 22.6676 9.73953 18.2351     20.6327  18.2351     20.6327  13.8802    240         4.23042     60          
1 1 1 46 0  17 o 14 24.5562 11.1569 24.2273     31.3409  24.2273     31.3409  12.5843    120         6.01326     120         
1 1 1 46 0  18 o 5  25.6425 10.3731 25.7888     21.0424  25.7888     21.0424  7.68718    2.4773e-07  23.6337     180         
1 1 1 46 0  19 o 14 22.6044 9.71587 18.8058     20.5483  18.8058     20.5483  12.5686    60          6.41612     240         
1 1 1 46 0  20 f 0  16.7671 7.9745  1.31712     19.0958  1.31712     19.0958  6.01688    300         0           0           
1 1 1 46 0  21 o 15 16.8475 7.99455 2.07501     18.9916  2.07501     18.9916  2.42542    360         1.86436     180         
1 1 1 46 0  22 o 7  16.5656 7.8951  1.30894     18.9015  1.30894     18.9015  1.34614    240         18.0071     60          
1 1 1 46 0  23 o 12 16.3824 7.88999 -0.469718   19.8936  -0.469718   19.8936  1.69559    300         2.52805     120         
1 1 1 46 0  24 o 16 16.9049 8.04935 2.43723     19.5613  2.43723     19.5613  2.99386    360         5.19343     180         
1 1 1 46 0  25 o 4  24.0381 10.1263 24.5206     21.4359  24.5206     21.4359  12.6873    240         2.30655     240         
1 1 1 46 0  26 o 10 19.1453 8.76163 10.9971     19.7916  10.9971     19.7916  2.28128    120         1.03937     300         
1 1 1 46 0  27 o 3  16.2547 7.84757 -0.196094   19.9372  -0.196094   19.9372  0.834145   360         2.9588      180         
1 1 1 46 0  28 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 0  29 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 0  30 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 1  0  o 18 11.8216 6.01742 -24.0649    17.6037  -24.0649    17.6037  0.0510786  359.999     2.15766     179.999     
1 1 1 46 1  1  o 1  29.5519 8.62215 20.9086     19.9451  26.9308     21.4309  19.2596    181.138     1.02995     1.13767     
1 1 1 46 1  2  o 17 26.7417 8.23981 12.2356     20.3606  18.799      21.1513  15.2706    308.892     4.70207     128.892     
1 1 1 46 1  3  o 1  21.409  7.07259 2.41575     17.958   -9.04742    20.1342  10.5389    132.912     1.72456     132.912     
1 1 1 46 1  4  o 14 25.0101 7.83865 14.91       19.4086  5.5468      19.9231  14.6453    151.597     2.09772     331.597     
1 1 1 46 1  5  o 3  18.8905 6.42999 -15.6553    18.4236  -9.79139    17.6026  4.77493    86.1106     13.7432     266.111     
1 1 1 46 1  6  o 6  27.9961 8.19459 33.4173     20.3473  1.93379     19.8133  17.3743    3.61034     2.39132     183.61      
1 1 1 46 1  7  o 8  26.0797 8.5208  9.3642      25.4018  12.0703     26.8111  16.9023    133.63      4.58954     133.63      
1 1 1 46 1  8  o 1  25.7595 8.48227 18.9828     27.9529  -1.40264    25.3335  14.5886    45.5726     6.67154     45.5726     
1 1 1 46 1  9  o 16 26.102  8.495   15.5113     26.1248  8.08218     25.0751  16.2736    11.7918     1.06136     11.7918     
1 1 1 46 1  10 o 8  23.5871 8.34508 -16.7891    25.0947  -20.6292    54.8487  12.4336    143.653     2.1334      323.653     
1 1 1 46 1  11 o 17 21.8623 7.39604 13.1379     23.9539  -38.8675    23.5281  4.09515    320.263     1.51384     320.263     
1 1 1 46 1  12 o 13 31.6826 9.76726 39.7473     29.3545  34.0926     29.0066  23.5718    16.8977     8.76677     16.8977     
1 1 1 46 1  13 o 16 23.2072 7.84704 -12.6163    26.5496  6.56074     25.5236  7.37263    194.959     2.80109     194.959     
1 1 1 46 1  14 o 1  31.8881 9.48621 66.2514     29.6889  -0.0544921  27.3201  23.1354    115.698     6.07191     115.698     
1 1 1 46 1  15 o 4  26.0023 8.53059 24.3277     26.6149  1.32825     27.4735  15.1011    332.447     0.218664    332.446     
1 1 1 46 1  16 f 0  27.2528 9.32201 -13.5221    66.5138  25.7902     30.053   7.74361    113.797     0           0           
1 1 1 46 1  17 o 1  23.3378 7.95744 -5.72926    29.4162  3.90121     26.565   10.8649    225.582     0.655268    225.582     
1 1 1 46 1  18 o 12 27.8997 9.08053 32.5378     29.3652  19.21       29.3969  16.9456    128.623     2.83009     128.623     
1 1 1 46 1  19 o 10 25.4619 8.27116 15.8198     20.5196  15.2164     28.7023  11.4575    286.574     8.49858     106.574     
1 1 1 46 1  20 o 17 22.5914 7.63186 -8.8775     20.0903  16.0122     26.9772  9.39149    61.5281     4.40176     241.528     
1 1 1 46 1  21 o 17 22.1482 7.32773 1.3762      20.1924  7.2027      20.4112  5.34592    225.423     0.535386    225.423     
1 1 1 46 1  22 o 18 22.3762 7.37664 0.735443    20.4566  10.2644     20.2407  7.83203    128.952     0.637716    308.952     
1 1 1 46 1  23 o 14 20.8564 7.0319  -7.04978    20.9205  3.23092     20.0987  6.39297    110.59      4.57618     290.59      
1 1 1 46 1  24 o 14 23.7222 7.58323 28.3769     20.703   -14.1457    20.8804  9.92232    194.102     3.42715     14.1019     
1 1 1 46 1  25 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 1  26 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 1  27 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 2  0  o 16 14.432  7.1289  -9.31454    18.9427  -9.31454    18.9427  1.21931    0.000335314 3.21064     180         
1 1 1 46 2  1  o 8  23.4814 7.60133 10.3513     20.2221  3.94624     20.1072  12.5971    301.533     1.04027     121.533     
1 1 1 46 2  2  o 13 26.5011 8.1696  7.08763     21.1913  26.5525     20.7466  13.609     176.699     6.84894     176.699     
1 1 1 46 2  3  o 16 26.441  8.64875 44.8064     31.9685  -4.98096    19.5285  8.78346    53.0584     4.7068      53.0584     
1 1 1 46 2  4  o 1  28.4024 9.0203  -1.57984    30.5227  42.3833     27.2941  18.3505    125.366     1.82393     125.366     
1 1 1 46 2  5  o 17 25.27   8.41109 0.327674    29.7266  17.5988     26.2208  14.0873    203.762     3.77846     203.762     
1 1 1 46 2  6  o 8  22.3188 7.64174 -8.9563     28.3845  -3.48296    24.4673  10.2373    228.857     4.33045     48.8569     
1 1 1 46 2  7  o 12 23.0562 7.83043 10.431      26.2152  -15.8775    27.1114  11.3215    301.197     2.4151      121.197     
1 1 1 46 2  8  o 15 22.1122 7.59757 -4.6534     28.4132  -8.63525    24.5944  9.80856    270.077     4.46063     90.0774     
1 1 1 46 2  9  o 1  28.013  9.7312  86.5624     72.4275  12.4166     27.1529  15.0755    86.329      6.30638     86.329      
1 1 1 46 2  10 o 10 26.9694 8.87381 6.12002     29.4885  33.9089     29.5468  14.3525    343.79      5.76621     343.79      
1 1 1 46 2  11 o 17 25.6666 8.50142 15.5587     29.0216  15.1968     25.9453  12.8495    167.728     5.70735     347.728     
1 1 1 46 2  12 o 15 21.8958 7.50295 -22.5356    25.3974  8.69512     25.879   8.2499     182.134     8.35862     2.13439     
1 1 1 46 2  13 o 13 19.2703 6.75933 -13.4174    25.9014  -30.6136    22.8273  4.99813    59.3174     2.47414     239.317     
1 1 1 46 2  14 o 8  26.1626 8.7111  38.8175     31.1633  -3.00661    27.995   13.8571    281.738     2.92378     281.738     
1 1 1 46 2  15 o 18 27.8506 9.12283 39.5472     30.0056  17.1067     31.4901  13.0369    166.728     5.62524     166.728     
1 1 1 46 2  16 o 10 28.8115 9.25826 26.3186     30.8115  41.1566     28.4686  17.443     318.572     3.8413      318.572     
1 1 1 46 2  17 o 7  26.7778 8.83161 12.8612     29.1958  35.3142     29.4715  5.91469    290.499     2.6327      290.499     
1 1 1 46 2  18 o 14 25.7031 8.55345 36.2728     29.1717  -2.53333    28.6561  12.615     287.991     2.62352     107.991     
1 1 1 46 2  19 o 9  29.6566 9.29506 -1.00858    31.3649  65.4465     29.8713  17.0811    147.507     1.56244     327.507     
1 1 1 46 2  20 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 2  21 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 2  22 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 2  23 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 3  0  x 13 ?       ?       ?           ?        ?           ?        17.3188    360         0           0           
1 1 1 46 3  1  o 6  27.0779 12.9212 26.5901     34.5639  0           0        4.40988    158.633     0.769263    158.633     
1 1 1 46 3  2  o 11 23.8626 11.548  5.48332     29.9274  0           0        5.90768    72.2668     1.28407     252.267     
1 1 1 46 3  3  o 13 23.4457 8.05078 4.91147     29.454   0.313062    30.0898  8.66451    178.793     1.44837     178.793     
1 1 1 46 3  4  o 16 22.7983 11.1227 0           0        -1.58089    29.3131  5.81866    91.8463     2.93539     271.846     
1 1 1 46 3  5  o 5  23.5756 8.08883 2.22673     29.15    5.83792     30.5568  6.74469    359.065     1.61713     359.065     
1 1 1 46 3  6  o 3  23.4939 8.07106 30.1659     30.9172  -35.3919    29.573   7.28327    303.759     1.49091     303.759     
1 1 1 46 3  7  o 9  22.9624 7.87801 16.554      29.2676  -14.853     27.0625  8.49604    4.93141     0.43751     4.93141     
1 1 1 46 3  8  o 18 20.7014 10.125  0           0        -9.26763    24.7379  1.5633     128.736     1.13609     308.736     
1 1 1 46 3  9  o 5  22.4478 8.02738 -12.1755    27.3429  -45.4622    70.2039  5.65831    307.621     0.264603    307.621     
1 1 1 46 3  10 o 18 23.8151 8.17352 6.77257     32.9871  6.86377     28.3244  7.81908    76.4759     13.5136     256.476     
1 1 1 46 3  11 o 3  22.8043 7.86456 18.2689     31.5235  -13.7262    25.2224  3.59646    142.11      0.516367    142.11      
1 1 1 46 3  12 o 3  24.9958 8.45521 25.9994     31.3192  6.04413     28.3858  10.2959    300.324     1.61222     300.324     
1 1 1 46 3  13 o 10 26.7318 8.6778  51.593      28.7142  -13.1252    28.0298  10.5126    256.811     3.67486     256.811     
1 1 1 46 3  14 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 3  15 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 3  16 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 3  17 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 3  18 x 19 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  0  x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  1  x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  2  x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  3  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  4  x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  5  x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  6  x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  7  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  8  x 15 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  9  x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  10 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  11 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 46 4  12 x 5  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 0  0  o 4  20.9189 9.86985 0.932705    28.2183  0.932705    28.2183  2.57231    180         4.87528     360         
1 1 1 47 0  1  o 7  16.3744 7.8821  -1.17817    19.8004  -1.17817    19.8004  3.7        60          12.1199     240         
1 1 1 47 0  2  o 8  24.1673 11.1625 24.9624     33.1764  24.9624     33.1764  15.516     120         2.25133     300         
1 1 1 47 0  3  o 9  26.4887 11.8743 34.9254     34.0855  34.9254     34.0855  17.1957    2.80365e-06 4.54017     180         
1 1 1 47 0  4  o 13 22.7987 10.5621 19.4713     30.0329  19.4713     30.0329  7.03145    240         2.7126      240         
1 1 1 47 0  5  f 0  16.1484 8.00894 -10.1908    24.6137  -10.1908    24.6137  28.6179    120         0           0           
1 1 1 47 0  6  f 0  17.0927 8.37885 -4.55656    24.858   -4.55656    24.858   15.1418    180         0           0           
1 1 1 47 0  7  o 1  19.5217 9.40011 5.27694     28.2088  5.27694     28.2088  6.90372    60          0.706512    240         
1 1 1 47 0  8  o 16 19.8235 9.42207 8.37614     26.578   8.37614     26.578   3.30929    120         0.267196    120         
1 1 1 47 0  9  o 14 19.6853 10.2215 -58.5703    67.7023  -58.5703    67.7023  7.96467    180         6.21631     8.65136e-06 
1 1 1 47 0  10 o 2  18.3587 8.88394 2.04899     25.8779  2.04899     25.8779  5.58609    60          11.5081     240         
1 1 1 47 0  11 o 15 14.5856 7.38925 -22.3909    25.2199  -22.3909    25.2199  0.363437   120         1.38983     300         
1 1 1 47 0  12 o 7  32.8592 12.6998 52.6159     29.8205  52.6159     29.8205  24.6947    180         0.322746    360         
1 1 1 47 0  13 o 14 17.6067 8.64603 -2.65145    26.7723  -2.65145    26.7723  2.41071    240         1.72064     60          
1 1 1 47 0  14 o 15 18.6537 9.04839 3.296       27.2085  3.296       27.2085  5.54263    300         4.17697     120         
1 1 1 47 0  15 o 4  31.6178 12.73   52.8433     31.4803  52.8433     31.4803  19.7072    180         12.2676     180         
1 1 1 47 0  16 o 14 29.4881 12.4183 48.2415     32.2198  48.2415     32.2198  22.6434    60          6.32221     60          
1 1 1 47 0  17 f 0  13.6262 6.94115 -25.1005    23.6221  -25.1005    23.6221  0.280777   300         0           0           
1 1 1 47 0  18 o 10 24.3754 11.0353 30.2045     30.32    30.2045     30.32    13.4405    180         0.21435     180         
1 1 1 47 0  19 o 7  16.5163 8.18447 -6.38328    25.5435  -6.38328    25.5435  0.716306   240         1.89297     60          
1 1 1 47 0  20 x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 0  21 x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 0  22 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 0  23 x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 0  24 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 1  0  x 7  ?       ?       ?           ?        ?           ?        8.58238    0.000496761 0           0           
1 1 1 47 1  1  o 19 25.9556 12.3086 18.3995     30.3937  0           0        9.77981    0.883346    1.6602      180.883     
1 1 1 47 1  2  o 4  23.1265 7.95236 -3.79707    28.0689  4.15558     30.3789  4.75849    149.433     1.29478     149.433     
1 1 1 47 1  3  o 3  26.3912 8.8492  23.948      30.3302  17.8856     32.7896  10.2108    194.7       4.27588     194.7       
1 1 1 47 1  4  o 8  25.3167 8.57151 14.9787     32.6334  14.1197     29.4146  13.1523    319.017     1.26219     319.017     
1 1 1 47 1  5  o 5  31.9325 14.564  57.2517     36.4913  0           0        16.605     269.31      0.0720839   89.3097     
1 1 1 47 1  6  o 18 21.8534 7.55587 -0.904485   27.7846  -12.3261    27.1663  3.6708     116.288     0.487621    116.288     
1 1 1 47 1  7  o 5  21.2056 7.41028 -53.8515    30.1638  9.82868     28.4766  6.69392    43.0473     1.09793     223.047     
1 1 1 47 1  8  o 11 22.6655 10.9992 0           0        -0.00201231 27.6425  2.64577    110.476     0.756069    290.476     
1 1 1 47 1  9  o 12 25.0799 9.00274 -10.8839    31.3915  74.8202     79.2643  7.29803    258.485     2.12888     258.485     
1 1 1 47 1  10 o 8  23.1718 7.89122 -11.8864    26.9253  18.1571     27.647   8.28146    299.248     0.629425    299.248     
1 1 1 47 1  11 o 16 23.1797 7.87742 -20.793     29.2656  20.8598     26.3947  8.79583    297.055     0.0334419   297.055     
1 1 1 47 1  12 o 13 21.2932 7.40743 -19.7346    28.3723  -1.27312    27.3222  6.10402    353.587     1.54449     173.587     
1 1 1 47 1  13 o 3  18.8952 6.65799 -31.3987    24.3795  -17.6969    25.7068  1.48642    145.958     1.00053     325.958     
1 1 1 47 1  14 o 18 23.7355 8.05554 9.1303      28.9189  8.78488     26.5841  8.14276    238.292     0.522597    238.292     
1 1 1 47 1  15 x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 1  16 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 1  17 x 10 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 1  18 x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 1  19 x 6  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  0  x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  1  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  2  x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  3  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  4  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  5  x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  6  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  7  x 1  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  8  x 8  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  9  x 0  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  10 x 17 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  11 x 11 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  12 x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 47 2  13 x 16 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  0  x 2  ?       ?       ?           ?        ?           ?        19.7441    180         0           0           
1 1 1 48 0  1  x 7  ?       ?       ?           ?        ?           ?        16.3798    240         0           0           
1 1 1 48 0  2  x 7  ?       ?       ?           ?        ?           ?        7.92915    300         0           0           
1 1 1 48 0  3  x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  4  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  5  x 13 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  6  x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  7  x 14 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  8  x 7  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  9  x 18 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  10 x 3  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  11 x 2  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  12 x 4  ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
1 1 1 48 0  13 x 12 ?       ?       ?           ?        ?           ?        ?          ?           ?           ?           
# 
#END OF REFLECTIONS
