REAL300007959884.mol2 39                                                        
   1       C    -0.14    -2.23     8.04      37.16       0.30    -1.93     16
   2       C    -0.05    -0.89     0.62    -154.51      -0.10    -0.98     16
   3       C    -0.14    -1.95     8.32      37.16       0.31    -1.64     16
   4       C    -0.14    -2.48     7.97      37.16       0.30    -2.19     16
   5       C     0.08     1.49     2.09     -69.08      -0.14     1.34     16
   6       H     0.08     1.54     7.50     -51.93      -0.39     1.15     16
   7       N    -1.07   -17.35     4.18      -5.88      -0.02   -17.37     16
   8       S     2.70    40.01     5.72    -107.50      -0.61    39.39     16
   9       O    -0.96   -14.63    17.28     -57.17      -0.99   -15.62     16
  10       O    -0.95   -15.08    16.63     -57.17      -0.95   -16.03     16
  11       C    -0.65    -9.51     5.89     -39.58      -0.23    -9.74     16
  12       C     0.04     0.57     9.52     -39.58      -0.38     0.20     16
  13       C    -0.13    -1.84     8.62     -39.58      -0.34    -2.18     16
  14       C     0.42     6.83     4.82     -39.58      -0.19     6.63     16
  15       F    -0.03    -0.54    16.66       2.25       0.04    -0.50     16
  16       F    -0.21    -4.24    15.31       2.25       0.03    -4.21     16
  17       F    -0.25    -4.97    15.32       2.25       0.03    -4.94     16
  18       F    -0.20    -3.88    15.32       2.25       0.03    -3.84     16
  19       F    -0.11    -2.17    15.31       2.25       0.03    -2.13     16
  20       C    -0.13    -1.80     8.62     -39.58      -0.34    -2.14     16
  21       C     0.05     0.68     9.52     -39.58      -0.38     0.30     16
  22       C     0.48    12.10     5.89      36.01       0.21    12.31     16
  23       O    -0.68   -18.34    17.31     -20.23      -0.35   -18.69     16
  24       O    -0.68   -19.60    15.58     -20.22      -0.32   -19.92     16
  25       H     0.05     0.72     6.51     -51.93      -0.34     0.38     16
  26       H     0.07     1.31     7.22     -51.93      -0.37     0.93     16
  27       H     0.05     0.68     8.14     -51.93      -0.42     0.26     16
  28       H     0.05     0.63     8.14     -51.93      -0.42     0.20     16
  29       H     0.05     0.76     8.14     -51.93      -0.42     0.33     16
  30       H     0.05     0.67     7.60     -51.93      -0.39     0.27     16
  31       H     0.09     1.89     5.88     -51.93      -0.31     1.58     16
  32       H     0.05     0.83     8.14     -51.93      -0.42     0.41     16
  33       H     0.04     0.63     8.14     -51.93      -0.42     0.20     16
  34       H     0.42     6.07     7.03     -34.47      -0.24     5.82     16
  35       H     0.19     2.16     7.62     -52.49      -0.40     1.76     16
  36       H     0.18     2.34     7.40     -52.48      -0.39     1.95     16
  37       H     0.18     2.19     7.40     -52.49      -0.39     1.80     16
  38       H     0.19     1.87     7.62     -52.49      -0.40     1.47     16
 Total:         -1.00   -35.55   347.01                 -4.56   -40.11