REAL300018723298.mol2 34                                                        
   1       C    -0.17    -2.23     8.30      71.98       0.60    -1.63     16
   2       C     0.06     1.19     0.86     -53.67      -0.05     1.15     16
   3       C    -0.17    -2.22     8.29      71.98       0.60    -1.62     16
   4       C     0.52    10.52     6.71      71.24       0.48    11.00     16
   5       O    -0.19    -5.08    15.07      26.48       0.40    -4.68     16
   6       O    -0.35    -6.68    17.67      19.04       0.34    -6.35     16
   7       C     0.51    16.72     6.46      87.65       0.57    17.29     16
   8       O    -0.40   -15.28    13.93      20.99       0.29   -14.98     16
   9       N    -0.97   -37.75    10.75    -173.53      -1.87   -39.61     16
  10       S     2.68   133.86     4.87     -56.49      -0.28   133.58     16
  11       O    -0.99   -52.12    17.22    -127.65      -2.20   -54.32     16
  12       O    -0.99   -52.35    17.23    -127.64      -2.20   -54.55     16
  13       C    -0.67   -39.27     5.97      22.27       0.13   -39.13     16
  14       C     0.04     2.44     9.52      22.27       0.21     2.65     16
  15       C    -0.17   -14.75     8.62      22.27       0.19   -14.56     16
  16       C     0.48    48.09     4.82      22.27       0.11    48.20     16
  17       F    -0.35   -48.66    16.66      44.97       0.75   -47.91     16
  18       F    -0.55   -69.92    15.30      44.97       0.69   -69.23     16
  19       F    -0.60   -79.17    15.32      44.97       0.69   -78.48     16
  20       F    -0.56   -72.87    15.31      44.97       0.69   -72.18     16
  21       F    -0.59   -75.99    15.31      44.97       0.69   -75.30     16
  22       C    -0.18   -14.68     8.62      22.27       0.19   -14.49     16
  23       C     0.04     2.52     9.52      22.27       0.21     2.73     16
  24       H     0.18     2.37     8.06      -2.39      -0.02     2.35     16
  25       H     0.10     1.31     8.14      -2.39      -0.02     1.29     16
  26       H     0.16     0.84     8.09      -2.39      -0.02     0.83     16
  27       H     0.16     0.83     8.09      -2.39      -0.02     0.82     16
  28       H     0.10     1.30     8.14      -2.39      -0.02     1.28     16
  29       H     0.18     2.35     8.06      -2.39      -0.02     2.33     16
  30       H     0.21    10.81     7.62      -2.91      -0.02    10.79     16
  31       H     0.14    12.31     7.40      -2.91      -0.02    12.29     16
  32       H     0.14    12.32     7.40      -2.91      -0.02    12.30     16
  33       H     0.21    10.77     7.62      -2.91      -0.02    10.75     16
 Total:         -2.00  -318.44   330.95                  1.03  -317.41