


 N       0.00000  0      0.00000  0      0.00000  0     0   0   0   -0.31890
 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07280
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.28580
 O       1.22130  0    115.94220  0     35.04188  0     3   2   1   -0.38990
 N       1.33077  0    117.40408  0    215.46347  0     3   2   1   -0.35670
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.03440
 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   -0.30270
 H       1.11314  1    115.16018  1    337.60791  1     7   6   5    0.08360
 C       1.54256  1    113.48717  1    179.13471  1     6   5   3   -0.06970
 C       1.46256  1    111.86624  1    285.46820  1    10   6   5   -0.23670
 C       1.40553  1    127.12952  1     89.53642  1    11  10   6   -0.06430
 N       1.38270  1    110.79626  1    180.03399  1    12  11  10   -0.19440
 C       1.39339  1    107.96988  1      0.69658  1    13  12  11   -0.01510
 C       1.45124  1    108.60904  1    359.08363  1    14  13  12   -0.07680
 C       1.39708  1    119.42977  1    180.89631  1    15  14  13   -0.10270
 C       1.38495  1    119.00757  1    359.76131  1    16  15  14   -0.16610
 C       1.40851  1    121.32238  1    359.97432  1    17  16  15   -0.14370
 C       1.38384  1    121.64741  1      0.16492  1    18  17  16   -0.12050
 H       1.09880  1    121.65354  1    180.19364  1    19  18  17    0.14160
 H       1.09955  1    118.86912  1    180.24122  1    18  17  16    0.11370
 H       1.09905  1    119.79736  1    180.10529  1    17  16  15    0.11180
 H       1.09901  1    119.99151  1    179.86587  1    16  15  14    0.12230
 H       1.04525  1    125.37635  1    170.58077  1    13  12  11    0.33110
 H       1.09567  1    128.65860  1      0.87807  1    12  11  10    0.17850
 H       1.12276  1    110.02807  1     48.88552  1    10   6   5    0.08330
 H       1.12523  1    106.80462  1    165.72587  1    10   6   5    0.10430
 H       1.13401  1    108.29324  1     58.85923  1     6   5   3    0.13890
 H       0.99654  1    122.20411  1    354.48917  1     5   3   2    0.25210
 C       1.54669  1    116.24648  1    162.23242  1     2   3   4   -0.16920
 C       1.49935  1    113.40338  1     73.82821  1    30   2   3    0.29390
 O       1.23849  1    124.96153  1    231.06473  1    31  30   2   -0.38440
 O       1.34794  1    115.24376  1     51.85714  1    31  30   2   -0.29180
 C       1.53484  0    115.31241  1    176.71931  1    33  31  30   -0.00330
Cl       3.35738  1    149.64556  1     65.76441  1    34  33  31   -0.81440
 H       1.12081  1    107.95791  1     39.52552  1    34  33  31    0.15320
 H       1.11367  1    105.08375  1    280.08730  1    34  33  31    0.11980
 C       1.50089  1    105.70612  1    158.43810  1    34  33  31   -0.12820
 H       1.12533  1    108.16276  1    197.32434  1    38  34  33    0.17460
 H       1.11584  1    111.23368  1    318.89097  1    38  34  33    0.11470
Cl       1.76047  1    113.17565  1     78.53143  1    38  34  33   -0.14710
 H       1.12604  1    109.10718  1    192.25582  1    30   2   3    0.14020
 H       1.12071  1    111.04648  1    311.02476  1    30   2   3    0.11050
 H       1.14344  1    105.16803  1    278.79297  1     2   3   4    0.14860
 H       1.00249  1    110.86324  1     62.27271  1     1   2   3    0.13780
 H       1.00440  1    109.98706  1    302.47162  1     1   2   3    0.16640
 N      14.20335  0     59.28055  0    165.82135  0     3   2   1   -0.33110
 C       1.46213  0     44.41215  0     98.20624  0    47   3   2   -0.10530
 C       1.54890  0    109.51012  0    112.42708  0    48  47   3    0.21340
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27750
 H       1.11323  1    113.71537  1    305.23257  1    49  48  47    0.07610
 C       1.53966  1    113.23667  1    350.02779  1    48  47   3   -0.09400
 C       1.46242  1    115.01659  1    165.01533  1    52  48  47   -0.23240
 C       1.40599  1    124.75024  1    245.26416  1    53  52  48   -0.04890
 N       1.38215  1    110.92849  1    184.21652  1    54  53  52   -0.19030
 C       1.39344  1    107.94797  1      1.10871  1    55  54  53   -0.01530
 C       1.45342  1    108.52563  1    359.00736  1    56  55  54   -0.06500
 C       1.39658  1    119.30441  1    180.41886  1    57  56  55   -0.09660
 C       1.38526  1    119.13272  1    359.76759  1    58  57  56   -0.16590
 C       1.40789  1    121.29103  1      0.16135  1    59  58  57   -0.14010
 C       1.38425  1    121.62782  1      0.03062  1    60  59  58   -0.12550
 H       1.09866  1    121.42896  1    179.88802  1    61  60  59    0.13580
 H       1.09955  1    118.90728  1    179.96993  1    60  59  58    0.11420
 H       1.09898  1    119.81782  1    179.96501  1    59  58  57    0.11090
 H       1.09876  1    119.89202  1    179.40942  1    58  57  56    0.11570
 H       1.03767  1    123.37066  1    172.22560  1    55  54  53    0.32720
 H       1.09294  1    128.86862  1      4.00719  1    54  53  52    0.16570
 H       1.12550  1    107.53191  1    286.93994  1    52  48  47    0.08000
 H       1.12616  1    109.10801  1     42.80587  1    52  48  47    0.07080
 H       1.12849  1    107.84705  1    229.58744  1    48  47   3    0.12280
 H       1.00155  1     90.72188  1    341.02860  1    47   3   2    0.14080
 H       1.00227  1     79.04531  1    232.42489  1    47   3   2    0.13350

