REAL300007686191.mol2 37                                                        
   1       O    -0.69   -19.73    11.48     -27.82      -0.32   -20.05     16
   2       C     0.50    14.27     4.19      36.01       0.15    14.42     16
   3       O    -0.66   -22.08    17.88     -25.61      -0.46   -22.54     16
   4       C     0.08     1.67     3.33     -68.75      -0.23     1.44     16
   5       H     0.08     1.57     8.12     -51.93      -0.42     1.15     16
   6       C    -0.12    -2.02     5.33     -26.62      -0.14    -2.17     16
   7       C    -0.12    -1.46     5.88     -26.69      -0.16    -1.62     16
   8       C    -0.13    -1.40     6.08     -26.61      -0.16    -1.56     16
   9       C     0.12     1.41     6.36      -3.69      -0.02     1.38     16
  10       N    -0.97   -16.93     3.30    -107.67      -0.36   -17.28     16
  11       S     2.69    51.16     5.04    -107.50      -0.54    50.62     16
  12       O    -0.89   -22.30    12.61     -69.50      -0.88   -23.18     16
  13       O    -0.96   -17.12    16.61     -57.17      -0.95   -18.07     16
  14       C    -0.61    -9.95     5.65     -39.58      -0.22   -10.17     16
  15       C    -0.02    -0.20     9.57     -39.58      -0.38    -0.57     16
  16       C    -0.11    -0.92    10.05     -39.58      -0.40    -1.32     16
  17       C    -0.06    -0.77     8.62     -39.59      -0.34    -1.12     16
  18       C     0.34     5.97     4.82     -39.58      -0.19     5.78     16
  19       F    -0.03    -0.81    16.66       2.25       0.04    -0.77     16
  20       F    -0.27    -5.78    15.32       2.25       0.03    -5.75     16
  21       F    -0.13    -3.31    15.30       2.25       0.03    -3.27     16
  22       F    -0.22    -4.62    15.31       2.25       0.03    -4.59     16
  23       F    -0.12    -2.84    15.32       2.25       0.03    -2.80     16
  24       C     0.04     0.77     6.42     -39.58      -0.25     0.52     16
  25       H     0.07     1.21     8.14     -51.93      -0.42     0.79     16
  26       H     0.07     1.30     8.01     -51.93      -0.42     0.88     16
  27       H     0.06     0.73     8.14     -51.93      -0.42     0.31     16
  28       H     0.06     0.65     8.14     -51.93      -0.42     0.23     16
  29       H     0.07     0.55     8.14     -51.93      -0.42     0.12     16
  30       H     0.06     0.65     8.14     -51.93      -0.42     0.23     16
  31       H     0.07     0.84     8.14     -51.93      -0.42     0.41     16
  32       H     0.08     0.82     7.20     -51.93      -0.37     0.44     16
  33       H     0.16     1.15     8.05     -52.49      -0.42     0.72     16
  34       H     0.17     0.62     8.06     -52.49      -0.42     0.20     16
  35       H     0.18     1.87     7.40     -52.49      -0.39     1.48     16
  36       H     0.22     5.07     5.05     -52.49      -0.26     4.81     16
 Total:         -1.00   -39.97   321.87                 -6.07   -46.04