


 N       0.00000  0      0.00000  0      0.00000  0     0   0   0   -0.31800
 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07400
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.29030
 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   -0.36300
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.02560
 C       1.53773  0    111.93592  0    301.16164  0     6   5   3    0.17980
 O       1.25976  0    125.77695  0    157.62358  0     7   6   5   -0.31860
 H       1.11320  1    115.13663  1    338.03223  1     7   6   5    0.08930
 C       1.54072  1    113.83927  1    179.37800  1     6   5   3   -0.07800
 C       1.46586  1    112.79535  1    282.89678  1    10   6   5   -0.20010
 C       1.39851  1    126.41515  1     82.38078  1    11  10   6   -0.03750
 N       1.39262  1    110.06807  1    178.33470  1    12  11  10   -0.21100
 C       1.39670  1    108.64451  1      0.00000  1    13  12  11   -0.01370
 C       1.45010  1    107.92319  1      0.00000  1    14  13  12   -0.06310
 C       1.39480  1    119.22902  1    180.09249  1    15  14  13   -0.09210
 C       1.38776  1    119.05866  1      0.05305  1    16  15  14   -0.16490
 C       1.40537  1    121.34235  1    359.96966  1    17  16  15   -0.13220
 C       1.38686  1    121.56765  1      0.00000  1    18  17  16   -0.14310
 H       1.09758  1    121.21335  1    180.14205  1    19  18  17    0.12570
 H       1.09962  1    119.05677  1    180.10074  1    18  17  16    0.11620
 H       1.09925  1    119.67554  1    180.13856  1    17  16  15    0.11730
 H       1.09950  1    119.99833  1    180.32168  1    16  15  14    0.13240
 H       0.98772  1    125.43795  1    179.42049  1    13  12  11    0.25980
 H       1.10406  1    128.95239  1    357.39072  1    12  11  10    0.23640
 H       1.12386  1    109.88285  1     45.88711  1    10   6   5    0.09760
 H       1.12514  1    107.12649  1    162.73908  1    10   6   5    0.09660
 H       1.13352  1    108.36485  1     58.47916  1     6   5   3    0.12690
 H       1.00450  1    121.67395  1    356.00270  1     5   3   2    0.28440
 C       1.54335  1    116.22163  1    164.08327  1     2   3   4   -0.21330
 C       1.52348  1    111.41729  1     73.37919  1    30   2   3    0.31940
 O       1.27529  1    117.95343  1    240.99492  1    31  30   2   -0.61870
 O       1.26390  1    120.72836  1     60.64557  1    31  30   2   -0.57380
 C       2.83484  0    109.48625  1    175.36749  1    33  31  30   -0.12400
Cl       1.77903  1    152.26424  1     23.35112  1    34  33  31   -0.20490
 H       1.13097  1     46.19986  1      5.94910  1    34  33  31    0.21320
 H       1.11478  1     92.48267  1    250.66914  1    34  33  31    0.11230
 C       1.49880  1     78.16242  1    138.83173  1    34  33  31   -0.10860
 H       1.11564  1    112.08746  1    261.07966  1    38  34  33    0.10680
 H       1.12336  1    108.44332  1     22.83000  1    38  34  33    0.17550
Cl       1.76878  1    112.82778  1    141.45115  1    38  34  33   -0.17720
 H       1.12164  1    109.29177  1    191.32195  1    30   2   3    0.10440
 H       1.11812  1    110.93247  1    310.12966  1    30   2   3    0.07420
 H       1.14472  1    104.78261  1    279.31872  1     2   3   4    0.14620
 H       1.00253  1    110.63378  1     71.00691  1     1   2   3    0.12600
 H       1.00464  1    110.16834  1    311.38988  1     1   2   3    0.15070
 N      14.20335  0     59.28055  0    165.82135  0     3   2   1   -0.32830
 C       1.46213  0     44.41215  0     98.20624  0    47   3   2   -0.10620
 C       1.54890  0    109.51012  0    112.42708  0    48  47   3    0.20520
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27560
 H       1.11368  1    113.75098  1    305.36776  1    49  48  47    0.07660
 C       1.53807  1    114.68271  1    350.06571  1    48  47   3   -0.10590
 C       1.46595  1    113.03798  1    193.85075  1    52  48  47   -0.18680
 C       1.39876  1    125.54778  1    238.36716  1    53  52  48   -0.04340
 N       1.39162  1    110.27708  1    181.40518  1    54  53  52   -0.19830
 C       1.39656  1    108.42507  1      1.26576  1    55  54  53   -0.00160
 C       1.44914  1    108.09669  1    359.10571  1    56  55  54   -0.06430
 C       1.39593  1    119.07873  1    179.92549  1    57  56  55   -0.09370
 C       1.38669  1    119.13581  1      0.19034  1    58  57  56   -0.15880
 C       1.40640  1    121.34935  1    359.95268  1    59  58  57   -0.12450
 C       1.38599  1    121.56256  1    359.94935  1    60  59  58   -0.13300
 H       1.09817  1    121.32219  1    180.37827  1    61  60  59    0.13590
 H       1.09993  1    119.02674  1    180.12662  1    60  59  58    0.12260
 H       1.09941  1    119.72363  1    180.00831  1    59  58  57    0.11980
 H       1.09895  1    120.16953  1    180.36256  1    58  57  56    0.12250
 H       0.98851  1    125.39311  1    175.78486  1    55  54  53    0.26700
 H       1.09504  1    129.37855  1      0.58108  1    54  53  52    0.18380
 H       1.12616  1    108.58014  1    314.43248  1    52  48  47    0.08710
 H       1.12389  1    109.32553  1     71.10776  1    52  48  47    0.08380
 H       1.13031  1    107.43185  1    229.28560  1    48  47   3    0.13080
 H       1.00148  1     93.33004  1    343.77458  1    47   3   2    0.14610
 H       1.00190  1     77.34893  1    235.35996  1    47   3   2    0.13510

