


 N       0.00000  0      0.00000  0      0.00000  0     0   0   0   -0.31700
 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07460
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.28960
 O       1.22130  0    115.94220  0     35.04188  0     3   2   1   -0.42210
 N       1.33077  0    117.40408  0    215.46347  0     3   2   1   -0.36350
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.02540
 C       1.53773  0    111.93592  0    301.16164  0     6   5   3    0.18020
 O       1.25976  0    125.77695  0    157.62358  0     7   6   5   -0.31860
 H       1.11320  1    115.13829  1    338.02625  1     7   6   5    0.08920
 C       1.54080  1    113.83980  1    179.42697  1     6   5   3   -0.07780
 C       1.46591  1    112.77592  1    281.55556  1    10   6   5   -0.20040
 C       1.39862  1    126.47043  1     81.22040  1    11  10   6   -0.03690
 N       1.39257  1    110.06734  1    178.30660  1    12  11  10   -0.21020
 C       1.39663  1    108.64389  1    359.92413  1    13  12  11   -0.01360
 C       1.45001  1    107.92648  1      0.12734  1    14  13  12   -0.06320
 C       1.39483  1    119.22855  1    179.96132  1    15  14  13   -0.09190
 C       1.38776  1    119.05701  1      0.08977  1    16  15  14   -0.16510
 C       1.40542  1    121.34432  1    359.96033  1    17  16  15   -0.13230
 C       1.38684  1    121.56688  1      0.00000  1    18  17  16   -0.14310
 H       1.09757  1    121.21541  1    180.13846  1    19  18  17    0.12550
 H       1.09962  1    119.05352  1    180.22347  1    18  17  16    0.11610
 H       1.09925  1    119.67810  1    180.12990  1    17  16  15    0.11720
 H       1.09951  1    120.00219  1    180.37215  1    16  15  14    0.13240
 H       0.98771  1    125.45319  1    180.33112  1    13  12  11    0.25990
 H       1.10364  1    128.95419  1    357.38794  1    12  11  10    0.23570
 H       1.12387  1    109.91595  1     44.58051  1    10   6   5    0.09710
 H       1.12513  1    107.15963  1    161.48211  1    10   6   5    0.09650
 H       1.13360  1    108.39791  1     58.47251  1     6   5   3    0.12690
 H       1.00530  1    121.38226  1    354.58295  1     5   3   2    0.28480
 C       1.54289  1    116.26025  1    164.63589  1     2   3   4   -0.21520
 C       1.52585  1    110.99759  1     75.64045  1    30   2   3    0.32170
 O       1.27500  1    118.22867  1    243.20682  1    31  30   2   -0.62360
 O       1.26259  1    119.95031  1     63.03633  1    31  30   2   -0.56840
 C       3.08484  0    103.03104  1    175.19430  1    33  31  30   -0.13050
Cl       1.77131  1    152.01980  1     36.53299  1    34  33  31   -0.18610
 H       1.13301  1     47.02940  1      5.18296  1    34  33  31    0.20830
 H       1.11525  1     96.36303  1    254.24541  1    34  33  31    0.10080
 C       1.49947  1     73.17955  1    143.32426  1    34  33  31   -0.11460
 H       1.11545  1    112.06455  1    260.95626  1    38  34  33    0.10900
 H       1.12479  1    108.43666  1     22.46722  1    38  34  33    0.18160
Cl       1.76785  1    112.75912  1    141.35589  1    38  34  33   -0.17610
 H       1.12169  1    109.34312  1    193.20303  1    30   2   3    0.10380
 H       1.11755  1    111.16613  1    312.13408  1    30   2   3    0.07240
 H       1.14545  1    104.70330  1    279.67089  1     2   3   4    0.14710
 H       1.00253  1    110.64030  1     71.09844  1     1   2   3    0.12510
 H       1.00465  1    110.14963  1    311.49454  1     1   2   3    0.15060
 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   -0.10680
 C       1.54890  0    109.51012  0    112.42708  0    48  47   3    0.20340
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27680
 H       1.11379  1    113.77446  1    305.36939  1    49  48  47    0.07770
 C       1.53967  1    115.02953  1    350.24730  1    48  47   3   -0.10780
 C       1.46675  1    112.95154  1    206.62194  1    52  48  47   -0.17890
 C       1.39829  1    125.72604  1    235.94744  1    53  52  48   -0.04250
 N       1.39316  1    110.20915  1    181.68963  1    54  53  52   -0.20240
 C       1.39675  1    108.45505  1      1.30200  1    55  54  53   -0.00110
 C       1.44873  1    108.07466  1    358.93462  1    56  55  54   -0.06650
 C       1.39583  1    119.05944  1    180.05160  1    57  56  55   -0.09380
 C       1.38693  1    119.15306  1      0.20303  1    58  57  56   -0.15890
 C       1.40615  1    121.34063  1    359.94326  1    59  58  57   -0.12370
 C       1.38596  1    121.54838  1    359.91708  1    60  59  58   -0.13510
 H       1.09736  1    121.29178  1    180.31388  1    61  60  59    0.13420
 H       1.09994  1    119.03920  1    180.08856  1    60  59  58    0.12290
 H       1.09944  1    119.71764  1    180.01585  1    59  58  57    0.12070
 H       1.09909  1    120.14937  1    180.38701  1    58  57  56    0.12340
 H       0.98666  1    125.60162  1    174.51329  1    55  54  53    0.26100
 H       1.09572  1    129.33616  1      1.12547  1    54  53  52    0.18660
 H       1.12640  1    109.03509  1    327.08090  1    52  48  47    0.08730
 H       1.12381  1    109.49678  1     83.77407  1    52  48  47    0.08810
 H       1.13059  1    107.20614  1    229.21462  1    48  47   3    0.13370
 H       1.00154  1     93.60339  1    344.12181  1    47   3   2    0.14650
 H       1.00184  1     77.19523  1    235.89393  1    47   3   2    0.13510

