


 N       0.00000  0      0.00000  0      0.00000  0     0   0   0   -0.31680
 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07420
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.28940
 O       1.22130  0    115.94220  0     35.04188  0     3   2   1   -0.42220
 N       1.33077  0    117.40408  0    215.46347  0     3   2   1   -0.36380
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.02520
 C       1.53773  0    111.93592  0    301.16164  0     6   5   3    0.18030
 O       1.25976  0    125.77695  0    157.62358  0     7   6   5   -0.31860
 H       1.11320  1    115.13879  1    338.00531  1     7   6   5    0.08920
 C       1.54069  1    113.87062  1    179.51705  1     6   5   3   -0.07820
 C       1.46580  1    112.78706  1    280.94856  1    10   6   5   -0.19910
 C       1.39832  1    126.43659  1     80.64357  1    11  10   6   -0.03780
 N       1.39275  1    110.06674  1    178.48146  1    12  11  10   -0.21040
 C       1.39671  1    108.63612  1    359.53775  1    13  12  11   -0.01310
 C       1.44999  1    107.92927  1      0.52502  1    14  13  12   -0.06330
 C       1.39480  1    119.23242  1    179.68175  1    15  14  13   -0.09160
 C       1.38777  1    119.05394  1      0.12803  1    16  15  14   -0.16510
 C       1.40542  1    121.34419  1    359.94390  1    17  16  15   -0.13210
 C       1.38685  1    121.56903  1    359.94828  1    18  17  16   -0.14310
 H       1.09758  1    121.21470  1    180.15600  1    19  18  17    0.12560
 H       1.09962  1    119.05251  1    180.05706  1    18  17  16    0.11610
 H       1.09926  1    119.67828  1    180.11949  1    17  16  15    0.11730
 H       1.09951  1    120.00570  1    180.48161  1    16  15  14    0.13250
 H       0.98768  1    125.44428  1    182.21421  1    13  12  11    0.25920
 H       1.10351  1    128.88202  1    357.34162  1    12  11  10    0.23490
 H       1.12387  1    109.92786  1     43.96392  1    10   6   5    0.09740
 H       1.12515  1    107.22948  1    160.90455  1    10   6   5    0.09650
 H       1.13350  1    108.42932  1     58.51751  1     6   5   3    0.12700
 H       1.00555  1    121.34397  1    354.37749  1     5   3   2    0.28530
 C       1.54314  1    116.21362  1    164.65093  1     2   3   4   -0.21580
 C       1.52663  1    111.00623  1     76.22595  1    30   2   3    0.32280
 O       1.27542  1    118.09174  1    244.35500  1    31  30   2   -0.62680
 O       1.26192  1    119.86201  1     64.32663  1    31  30   2   -0.56380
 C       3.23484  0     98.60832  1    174.72092  1    33  31  30   -0.13390
Cl       1.76880  1    153.67992  1     41.10869  1    34  33  31   -0.17960
 H       1.13280  1     50.15076  1      2.09872  1    34  33  31    0.20490
 H       1.11531  1     96.75652  1    252.07718  1    34  33  31    0.09760
 C       1.49988  1     69.48151  1    141.26492  1    34  33  31   -0.11980
 H       1.11565  1    111.98092  1    259.56563  1    38  34  33    0.10870
 H       1.12607  1    108.49644  1     20.95623  1    38  34  33    0.18830
Cl       1.76766  1    112.70649  1    140.00024  1    38  34  33   -0.17550
 H       1.12162  1    109.35680  1    193.82915  1    30   2   3    0.10360
 H       1.11754  1    111.16385  1    312.69739  1    30   2   3    0.07200
 H       1.14540  1    104.72636  1    279.70344  1     2   3   4    0.14690
 H       1.00253  1    110.64800  1     71.10581  1     1   2   3    0.12500
 H       1.00466  1    110.14861  1    311.49980  1     1   2   3    0.15060
 N      14.20335  0     59.28055  0    165.82135  0     3   2   1   -0.32770
 C       1.46213  0     44.41215  0     98.20624  0    47   3   2   -0.10690
 C       1.54890  0    109.51012  0    112.42708  0    48  47   3    0.20300
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27700
 H       1.11380  1    113.78018  1    305.37704  1    49  48  47    0.07800
 C       1.53999  1    115.08345  1    350.24932  1    48  47   3   -0.10810
 C       1.46673  1    112.89170  1    209.89574  1    52  48  47   -0.17770
 C       1.39802  1    125.77255  1    235.57020  1    53  52  48   -0.04230
 N       1.39343  1    110.21618  1    181.72867  1    54  53  52   -0.20290
 C       1.39682  1    108.44387  1      1.36377  1    55  54  53   -0.00100
 C       1.44868  1    108.07336  1    358.81948  1    56  55  54   -0.06710
 C       1.39581  1    119.07409  1    180.17936  1    57  56  55   -0.09380
 C       1.38693  1    119.15065  1      0.15486  1    58  57  56   -0.15880
 C       1.40613  1    121.33534  1    359.95960  1    59  58  57   -0.12350
 C       1.38599  1    121.54833  1    359.94600  1    60  59  58   -0.13540
 H       1.09801  1    121.28221  1    180.29703  1    61  60  59    0.13390
 H       1.09995  1    119.04052  1    180.09926  1    60  59  58    0.12300
 H       1.09945  1    119.72024  1    180.01688  1    59  58  57    0.12090
 H       1.09916  1    120.12184  1    180.30636  1    58  57  56    0.12350
 H       0.98650  1    125.59766  1    173.94152  1    55  54  53    0.25990
 H       1.09569  1    129.22662  1      1.26297  1    54  53  52    0.18660
 H       1.12645  1    109.17758  1    330.33753  1    52  48  47    0.08730
 H       1.12380  1    109.55595  1     87.04645  1    52  48  47    0.08880
 H       1.13071  1    107.13316  1    229.17652  1    48  47   3    0.13430
 H       1.00157  1     93.69128  1    344.24773  1    47   3   2    0.14660
 H       1.00182  1     77.13957  1    236.02992  1    47   3   2    0.13510

