REAL300024351415.mol2 34                                                        
   1       O    -0.51    -7.38    15.86       5.55       0.09    -7.29     16
   2       C     0.54     5.85     7.85     -10.98      -0.09     5.77     16
   3       C    -0.15    -2.06     5.67      36.01       0.20    -1.85     16
   4       S     0.06     1.17    21.45    -107.50      -2.31    -1.14     16
   5       C     0.20     5.15     8.33     -88.19      -0.73     4.41     16
   6       N    -0.40    -9.89    11.98      30.72       0.37    -9.52     16
   7       N    -0.58   -15.61     7.39      27.70       0.20   -15.41     16
   8       C     0.58    18.22     9.41     -86.79      -0.82    17.41     16
   9       O    -0.65   -22.04    18.06       5.07       0.09   -21.95     16
  10       N    -0.65   -19.95    11.63     -16.34      -0.19   -20.14     16
  11       N    -0.73    -4.12     5.55     -61.47      -0.34    -4.46     16
  12       C     0.16     0.53     5.80      -5.19      -0.03     0.50     16
  13       C    -0.05    -0.07     5.25    -104.62      -0.55    -0.62     16
  14       C    -0.08     0.09     9.70     -39.59      -0.38    -0.30     16
  15       C    -0.06     0.09    10.05     -39.58      -0.40    -0.31     16
  16       C    -0.10    -0.21     8.62     -39.58      -0.34    -0.55     16
  17       C     0.38     2.12     4.82     -39.58      -0.19     1.93     16
  18       F    -0.13    -2.19    16.67       2.25       0.04    -2.15     16
  19       F    -0.18    -2.24    15.32       2.25       0.03    -2.21     16
  20       F    -0.16    -2.19    15.30       2.25       0.03    -2.16     16
  21       F    -0.17    -2.21    15.31       2.25       0.03    -2.17     16
  22       F    -0.17    -2.26    15.32       2.25       0.03    -2.22     16
  23       C    -0.10    -0.36     8.28     -39.58      -0.33    -0.68     16
  24       H     0.12     1.53     8.14     -51.91      -0.42     1.11     16
  25       H     0.12     1.46     8.14     -51.92      -0.42     1.03     16
  26       H     0.40     9.33     8.96    -182.55      -1.64     7.70     16
  27       H     0.41     1.39     8.46     -40.82      -0.35     1.05     16
  28       H     0.09     0.38     8.09     -51.93      -0.42    -0.04     16
  29       H     0.10     0.26     8.09     -51.93      -0.42    -0.16     16
  30       H     0.17    -0.55     8.06     -52.49      -0.42    -0.97     16
  31       H     0.18    -0.83     8.06     -52.49      -0.42    -1.26     16
  32       H     0.18     0.29     7.40     -52.49      -0.39    -0.10     16
  33       H     0.19     0.79     7.40     -52.48      -0.39     0.40     16
 Total:         -1.00   -45.50   334.41                 -5.81   -51.32