
 -176.707905 

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 C       1.43303  0      0.00000  0      0.00000  0     1   0   0   -0.07170
 C       1.48960  0    114.37444  0      0.00000  0     2   1   0    0.28610
 O       1.22130  0    115.94220  0     35.04188  0     3   2   1   -0.38680
 N       1.33077  0    117.40408  0    215.46347  0     3   2   1   -0.35790
 C       1.45261  0    123.47676  0    179.50902  0     5   3   2   -0.03450
 C       1.53773  0    111.93592  0    301.16164  0     6   5   3    0.17770
 O       1.25976  0    125.77695  0    157.62358  0     7   6   5   -0.30210
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 C       1.45143  1    108.54956  1    359.28366  1    14  13  12   -0.07530
 C       1.39709  1    119.41237  1    180.75934  1    15  14  13   -0.10340
 C       1.38497  1    119.00656  1    359.80140  1    16  15  14   -0.16530
 C       1.40847  1    121.32152  1      0.00000  1    17  16  15   -0.14340
 C       1.38391  1    121.66457  1      0.11202  1    18  17  16   -0.11940
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 H       0.99638  1    122.30799  1    354.16296  1     5   3   2    0.25330
 C       1.54881  1    116.48901  1    161.57644  1     2   3   4   -0.16400
 C       1.49530  1    113.43259  1     74.51337  1    30   2   3    0.29360
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 C       1.33484  0    120.26321  1    182.44890  1    33  31  30   -0.03340
Cl       3.94533  1    145.35939  1     29.75068  1    34  33  31   -0.80030
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 H       1.13365  1    105.06079  1    205.08649  1    34  33  31    0.12250
 C       1.52368  1    113.48661  1     84.53936  1    34  33  31   -0.18630
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 H       1.14307  1    105.33326  1    278.42936  1     2   3   4    0.14980
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 H       1.00442  1    109.97091  1    300.79569  1     1   2   3    0.16760
 N      14.20335  0     59.28055  0    165.82135  0     3   2   1   -0.33120
 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    0.21220
 O       1.23101  0    125.00583  0    126.76891  0    49  48  47   -0.27630
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 C       1.54039  1    113.11997  1    350.53548  1    48  47   3   -0.09400
 C       1.46217  1    114.92891  1    167.99861  1    52  48  47   -0.23450
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 H       1.00222  1     79.05811  1    232.41911  1    47   3   2    0.13360

