


 N       0.00000  0      0.00000  0      0.00000  0     0   0   0   -0.31840
 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07450
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.28720
 O       1.22130  0    115.94220  0     35.04188  0     3   2   1   -0.40320
 N       1.33077  0    117.40408  0    215.46347  0     3   2   1   -0.36000
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.03040
 C       1.53773  0    111.93592  0    301.16164  0     6   5   3    0.17800
 O       1.25976  0    125.77695  0    157.62358  0     7   6   5   -0.30890
 H       1.11314  1    115.14413  1    337.62661  1     7   6   5    0.08610
 C       1.54243  1    113.87460  1    179.81615  1     6   5   3   -0.07370
 C       1.46354  1    112.72291  1    285.43156  1    10   6   5   -0.22270
 C       1.40226  1    126.56942  1     93.38212  1    11  10   6   -0.05680
 N       1.38766  1    110.67652  1    178.16128  1    12  11  10   -0.20230
 C       1.39520  1    108.01620  1      1.52720  1    13  12  11   -0.01480
 C       1.45123  1    108.44709  1    358.26703  1    14  13  12   -0.07370
 C       1.39594  1    119.40308  1    181.45528  1    15  14  13   -0.09880
 C       1.38616  1    119.02399  1    359.64638  1    16  15  14   -0.16640
 C       1.40712  1    121.30975  1      0.04117  1    17  16  15   -0.13930
 C       1.38514  1    121.62672  1      0.19422  1    18  17  16   -0.12940
 H       1.09828  1    121.46250  1    180.05620  1    19  18  17    0.13530
 H       1.09960  1    118.93816  1    180.25737  1    18  17  16    0.11440
 H       1.09911  1    119.75297  1    180.17125  1    17  16  15    0.11390
 H       1.09922  1    119.97601  1    179.77729  1    16  15  14    0.12650
 H       1.02664  1    123.95032  1    166.62639  1    13  12  11    0.31590
 H       1.09783  1    128.67727  1    358.63437  1    12  11  10    0.20030
 H       1.12315  1    109.84616  1     48.75842  1    10   6   5    0.08840
 H       1.12557  1    106.74177  1    165.48326  1    10   6   5    0.10140
 H       1.13330  1    108.35645  1     59.02029  1     6   5   3    0.13330
 H       0.99942  1    122.13851  1    356.44977  1     5   3   2    0.26670
 C       1.54410  1    116.83512  1    164.07335  1     2   3   4   -0.18590
 C       1.50906  1    111.65285  1     72.51913  1    30   2   3    0.30740
 O       1.25391  1    121.62501  1    238.49502  1    31  30   2   -0.49110
 O       1.30306  1    118.34532  1     57.56277  1    31  30   2   -0.47690
 C       1.93484  0    110.46107  1    188.83437  1    33  31  30    0.20650
Cl       2.48577  1    166.85796  1      7.93501  1    34  33  31   -0.78290
 H       1.10303  1     91.92927  1     48.67018  1    34  33  31    0.15580
 H       1.09998  1     93.52541  1    289.35551  1    34  33  31    0.16260
 C       1.48114  1     95.73768  1    167.22909  1    34  33  31   -0.14330
 H       1.12094  1    110.15600  1    211.53223  1    38  34  33    0.15140
 H       1.12177  1    109.88805  1    333.05514  1    38  34  33    0.13870
Cl       1.75561  1    113.56720  1     92.01645  1    38  34  33   -0.11520
 H       1.12340  1    109.33127  1    190.86783  1    30   2   3    0.12570
 H       1.11935  1    111.07925  1    309.91306  1    30   2   3    0.09510
 H       1.14512  1    104.59961  1    279.73851  1     2   3   4    0.14360
 H       1.00243  1    110.78732  1     68.30281  1     1   2   3    0.13300
 H       1.00458  1    110.07265  1    308.48284  1     1   2   3    0.16050
 N      14.20335  0     59.28055  0    165.82135  0     3   2   1   -0.33070
 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    0.21180
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27620
 H       1.11331  1    113.71770  1    305.23647  1    49  48  47    0.07490
 C       1.53836  1    113.47752  1    350.17319  1    48  47   3   -0.09580
 C       1.46288  1    114.54471  1    170.01242  1    52  48  47   -0.22540
 C       1.40397  1    124.81899  1    242.69897  1    53  52  48   -0.04360
 N       1.38420  1    110.79535  1    183.39886  1    54  53  52   -0.18970
 C       1.39434  1    108.03676  1      1.56691  1    55  54  53   -0.01090
 C       1.45246  1    108.42855  1    358.54782  1    56  55  54   -0.06340
 C       1.39624  1    119.27774  1    180.71435  1    57  56  55   -0.09610
 C       1.38558  1    119.11844  1    359.71540  1    58  57  56   -0.16390
 C       1.40747  1    121.30973  1      0.14179  1    59  58  57   -0.13620
 C       1.38463  1    121.61329  1      0.09465  1    60  59  58   -0.12620
 H       1.09837  1    121.39787  1    180.02010  1    61  60  59    0.13610
 H       1.09962  1    118.93994  1    180.12328  1    60  59  58    0.11610
 H       1.09906  1    119.81436  1    180.03984  1    59  58  57    0.11250
 H       1.09876  1    119.95596  1    179.44909  1    58  57  56    0.11640
 H       1.02437  1    123.30938  1    170.78989  1    55  54  53    0.31660
 H       1.09291  1    129.01762  1      3.14429  1    54  53  52    0.16700
 H       1.12563  1    107.72292  1    291.68316  1    52  48  47    0.08130
 H       1.12574  1    109.16237  1     47.74827  1    52  48  47    0.07190
 H       1.12880  1    107.86494  1    229.60003  1    48  47   3    0.12470
 H       1.00149  1     91.57740  1    341.95101  1    47   3   2    0.14180
 H       1.00217  1     78.43689  1    233.45570  1    47   3   2    0.13330

