


 N       0.00000  0      0.00000  0      0.00000  0     0   0   0   -0.31660
 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07410
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.28930
 O       1.22130  0    115.94220  0     35.04188  0     3   2   1   -0.42220
 N       1.33077  0    117.40408  0    215.46347  0     3   2   1   -0.36390
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.02520
 C       1.53773  0    111.93592  0    301.16164  0     6   5   3    0.18030
 O       1.25976  0    125.77695  0    157.62358  0     7   6   5   -0.31860
 H       1.11320  1    115.13752  1    338.01320  1     7   6   5    0.08920
 C       1.54065  1    113.95734  1    179.47416  1     6   5   3   -0.07820
 C       1.46576  1    112.82395  1    280.91502  1    10   6   5   -0.19870
 C       1.39829  1    126.50172  1     80.28038  1    11  10   6   -0.03810
 N       1.39282  1    110.05902  1    178.42604  1    12  11  10   -0.21050
 C       1.39666  1    108.63957  1    359.51955  1    13  12  11   -0.01290
 C       1.44993  1    107.93075  1      0.56156  1    14  13  12   -0.06350
 C       1.39481  1    119.23346  1    179.63437  1    15  14  13   -0.09150
 C       1.38775  1    119.05367  1      0.13083  1    16  15  14   -0.16510
 C       1.40543  1    121.34345  1    359.95436  1    17  16  15   -0.13200
 C       1.38683  1    121.56763  1    359.96047  1    18  17  16   -0.14310
 H       1.09750  1    121.21870  1    180.15954  1    19  18  17    0.12570
 H       1.09962  1    119.05230  1    180.07141  1    18  17  16    0.11620
 H       1.09926  1    119.67755  1    180.11469  1    17  16  15    0.11730
 H       1.09951  1    120.00771  1    180.40596  1    16  15  14    0.13250
 H       0.98777  1    125.44784  1    182.43530  1    13  12  11    0.25920
 H       1.10346  1    128.83997  1    357.36200  1    12  11  10    0.23450
 H       1.12397  1    109.91958  1     43.95155  1    10   6   5    0.09720
 H       1.12526  1    107.22958  1    160.85777  1    10   6   5    0.09660
 H       1.13366  1    108.38976  1     58.46223  1     6   5   3    0.12690
 H       1.00561  1    121.33332  1    354.37525  1     5   3   2    0.28540
 C       1.54266  1    116.21064  1    164.74025  1     2   3   4   -0.21620
 C       1.52681  1    111.10354  1     76.31884  1    30   2   3    0.32330
 O       1.27536  1    118.05120  1    244.61587  1    31  30   2   -0.62750
 O       1.26183  1    119.81791  1     64.55991  1    31  30   2   -0.56280
 C       3.28484  0     97.33601  1    174.78562  1    33  31  30   -0.13400
Cl       1.76870  1    154.05898  1     43.47724  1    34  33  31   -0.17810
 H       1.13248  1     51.24862  1      1.33224  1    34  33  31    0.20330
 H       1.11527  1     97.05993  1    251.72755  1    34  33  31    0.09700
 C       1.50006  1     68.16506  1    140.99530  1    34  33  31   -0.12180
 H       1.11575  1    111.95385  1    259.01872  1    38  34  33    0.10860
 H       1.12655  1    108.59601  1     20.38333  1    38  34  33    0.19080
Cl       1.76740  1    112.67316  1    139.50494  1    38  34  33   -0.17500
 H       1.12182  1    109.32410  1    193.87196  1    30   2   3    0.10350
 H       1.11756  1    111.18577  1    312.68393  1    30   2   3    0.07190
 H       1.14551  1    104.70194  1    279.75309  1     2   3   4    0.14680
 H       1.00253  1    110.65030  1     71.09428  1     1   2   3    0.12490
 H       1.00465  1    110.13826  1    311.49539  1     1   2   3    0.15070
 N      14.20335  0     59.28055  0    165.82135  0     3   2   1   -0.32760
 C       1.46213  0     44.41215  0     98.20624  0    47   3   2   -0.10690
 C       1.54890  0    109.51012  0    112.42708  0    48  47   3    0.20300
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27700
 H       1.11380  1    113.78097  1    305.38288  1    49  48  47    0.07800
 C       1.53989  1    115.10293  1    350.19393  1    48  47   3   -0.10810
 C       1.46679  1    112.85857  1    210.17261  1    52  48  47   -0.17750
 C       1.39799  1    125.78149  1    235.55661  1    53  52  48   -0.04240
 N       1.39350  1    110.21850  1    181.77850  1    54  53  52   -0.20310
 C       1.39691  1    108.43657  1      1.35060  1    55  54  53   -0.00090
 C       1.44871  1    108.07734  1    358.82529  1    56  55  54   -0.06710
 C       1.39571  1    119.07195  1    180.21221  1    57  56  55   -0.09380
 C       1.38693  1    119.15198  1      0.15496  1    58  57  56   -0.15880
 C       1.40616  1    121.33536  1    359.96090  1    59  58  57   -0.12350
 C       1.38599  1    121.54753  1    359.94308  1    60  59  58   -0.13550
 H       1.09800  1    121.28453  1    180.25081  1    61  60  59    0.13390
 H       1.09994  1    119.03830  1    180.08823  1    60  59  58    0.12300
 H       1.09944  1    119.72174  1    180.01211  1    59  58  57    0.12090
 H       1.09917  1    120.12285  1    180.29607  1    58  57  56    0.12350
 H       0.98646  1    125.60632  1    173.82047  1    55  54  53    0.25970
 H       1.09563  1    129.19783  1      1.27960  1    54  53  52    0.18650
 H       1.12647  1    109.19454  1    330.57181  1    52  48  47    0.08730
 H       1.12375  1    109.58333  1     87.30359  1    52  48  47    0.08890
 H       1.13079  1    107.12758  1    229.12635  1    48  47   3    0.13440
 H       1.00158  1     93.70319  1    344.26188  1    47   3   2    0.14660
 H       1.00182  1     77.13225  1    236.04741  1    47   3   2    0.13510

