


 N       0.00000  0      0.00000  0      0.00000  0     0   0   0   -0.31930
 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07210
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.28570
 O       1.22130  0    115.94220  0     35.04188  0     3   2   1   -0.38780
 N       1.33077  0    117.40408  0    215.46347  0     3   2   1   -0.35650
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.03500
 C       1.53773  0    111.93592  0    301.16164  0     6   5   3    0.17790
 O       1.25976  0    125.77695  0    157.62358  0     7   6   5   -0.30180
 H       1.11313  1    115.15967  1    337.62290  1     7   6   5    0.08340
 C       1.54274  1    113.34353  1    179.01685  1     6   5   3   -0.06940
 C       1.46267  1    111.75932  1    285.55764  1    10   6   5   -0.23800
 C       1.40582  1    127.16645  1     88.85055  1    11  10   6   -0.06490
 N       1.38238  1    110.80260  1    180.23380  1    12  11  10   -0.19340
 C       1.39377  1    107.95064  1      0.70821  1    13  12  11   -0.01520
 C       1.45096  1    108.62087  1    359.06718  1    14  13  12   -0.07670
 C       1.39725  1    119.42638  1    180.96326  1    15  14  13   -0.10310
 C       1.38488  1    119.00390  1    359.73191  1    16  15  14   -0.16580
 C       1.40865  1    121.32198  1      0.00000  1    17  16  15   -0.14400
 C       1.38378  1    121.64950  1      0.16985  1    18  17  16   -0.11950
 H       1.09883  1    121.67893  1    180.19462  1    19  18  17    0.14220
 H       1.09955  1    118.85857  1    180.25063  1    18  17  16    0.11390
 H       1.09905  1    119.80169  1    180.09863  1    17  16  15    0.11180
 H       1.09898  1    119.99771  1    179.83511  1    16  15  14    0.12200
 H       1.04676  1    125.40393  1    170.30586  1    13  12  11    0.33190
 H       1.09544  1    128.68783  1      1.19340  1    12  11  10    0.17580
 H       1.12271  1    110.04836  1     48.96637  1    10   6   5    0.08290
 H       1.12515  1    106.81604  1    165.81976  1    10   6   5    0.10470
 H       1.13408  1    108.30446  1     58.83557  1     6   5   3    0.13960
 H       0.99604  1    122.22530  1    354.11974  1     5   3   2    0.24990
 C       1.54757  1    116.22946  1    161.59038  1     2   3   4   -0.16410
 C       1.49680  1    113.94164  1     73.35301  1    30   2   3    0.29410
 O       1.23528  1    125.87742  1    230.31135  1    31  30   2   -0.36390
 O       1.36333  1    114.76962  1     51.19737  1    31  30   2   -0.25740
 C       1.38484  0    118.54774  1    176.68372  1    33  31  30   -0.03850
Cl       3.46367  1    149.34196  1     64.58502  1    34  33  31   -0.81060
 H       1.13213  1    112.02397  1     34.55844  1    34  33  31    0.13990
 H       1.12579  1    108.79121  1    274.93428  1    34  33  31    0.10430
 C       1.51768  1    108.40895  1    153.63222  1    34  33  31   -0.12380
 H       1.12451  1    108.13093  1    195.67517  1    38  34  33    0.17500
 H       1.11471  1    111.23261  1    317.41682  1    38  34  33    0.10880
Cl       1.76090  1    112.91852  1     76.89526  1    38  34  33   -0.15360
 H       1.12651  1    109.02922  1    191.88686  1    30   2   3    0.14290
 H       1.12117  1    110.92402  1    310.60486  1    30   2   3    0.11240
 H       1.14293  1    105.34023  1    278.42438  1     2   3   4    0.15060
 H       1.00253  1    110.86542  1     61.38530  1     1   2   3    0.13850
 H       1.00435  1    110.00498  1    301.55852  1     1   2   3    0.16730
 N      14.20335  0     59.28055  0    165.82135  0     3   2   1   -0.33130
 C       1.46213  0     44.41215  0     98.20624  0    47   3   2   -0.10510
 C       1.54890  0    109.51012  0    112.42708  0    48  47   3    0.21360
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27780
 H       1.11322  1    113.71570  1    305.23412  1    49  48  47    0.07630
 C       1.53965  1    113.14874  1    349.99072  1    48  47   3   -0.09380
 C       1.46242  1    115.19334  1    164.72930  1    52  48  47   -0.23360
 C       1.40623  1    124.66389  1    244.55879  1    53  52  48   -0.04810
 N       1.38208  1    110.93068  1    184.42189  1    54  53  52   -0.18950
 C       1.39338  1    107.95130  1      1.14472  1    55  54  53   -0.01510
 C       1.45362  1    108.52333  1    358.95074  1    56  55  54   -0.06490
 C       1.39657  1    119.29849  1    180.44510  1    57  56  55   -0.09670
 C       1.38525  1    119.13793  1    359.75551  1    58  57  56   -0.16610
 C       1.40786  1    121.29113  1      0.16085  1    59  58  57   -0.14050
 C       1.38426  1    121.62778  1      0.04389  1    60  59  58   -0.12520
 H       1.09840  1    121.42534  1    179.88245  1    61  60  59    0.13550
 H       1.09954  1    118.90726  1    179.96935  1    60  59  58    0.11380
 H       1.09897  1    119.81751  1    179.95932  1    59  58  57    0.11070
 H       1.09876  1    119.89190  1    179.37874  1    58  57  56    0.11560
 H       1.03795  1    123.26566  1    172.28549  1    55  54  53    0.32750
 H       1.09300  1    128.87900  1      4.20304  1    54  53  52    0.16620
 H       1.12559  1    107.48776  1    286.69206  1    52  48  47    0.07960
 H       1.12629  1    109.08388  1     42.49387  1    52  48  47    0.07080
 H       1.12849  1    107.85878  1    229.57477  1    48  47   3    0.12250
 H       1.00154  1     90.66185  1    340.94153  1    47   3   2    0.14080
 H       1.00227  1     79.09720  1    232.34586  1    47   3   2    0.13360

