REAL300007959883.mol2 39                                                        
   1       C    -0.14    -2.37     7.93      37.16       0.29    -2.07     16
   2       C    -0.05    -0.95     0.62    -154.51      -0.10    -1.04     16
   3       C    -0.14    -1.98     8.32      37.16       0.31    -1.67     16
   4       C    -0.14    -2.34     8.11      37.16       0.30    -2.03     16
   5       C     0.08     1.54     2.05     -69.08      -0.14     1.40     16
   6       H     0.08     1.56     7.50     -51.93      -0.39     1.17     16
   7       N    -1.07   -18.53     4.34      -5.88      -0.03   -18.56     16
   8       S     2.70    43.10     5.72    -107.50      -0.61    42.48     16
   9       O    -0.95   -16.34    17.28     -57.17      -0.99   -17.33     16
  10       O    -0.94   -15.35    16.63     -57.17      -0.95   -16.30     16
  11       C    -0.62    -9.77     5.94     -39.58      -0.24   -10.00     16
  12       C     0.01     0.09     9.52     -39.58      -0.38    -0.28     16
  13       C    -0.08    -0.87    10.05     -39.58      -0.40    -1.27     16
  14       C    -0.06    -0.79     8.62     -39.58      -0.34    -1.13     16
  15       C     0.35     5.91     4.82     -39.58      -0.19     5.72     16
  16       F    -0.02    -0.47    16.66       2.25       0.04    -0.43     16
  17       F    -0.20    -3.94    15.32       2.25       0.03    -3.90     16
  18       F    -0.10    -2.12    15.30       2.25       0.03    -2.09     16
  19       F    -0.21    -4.48    15.31       2.25       0.03    -4.44     16
  20       F    -0.24    -5.07    15.32       2.25       0.03    -5.03     16
  21       C     0.00    -0.01     8.10     -39.58      -0.32    -0.33     16
  22       C     0.48    12.34     5.54      36.01       0.20    12.54     16
  23       O    -0.67   -19.24    16.61     -20.23      -0.34   -19.57     16
  24       O    -0.69   -19.66    17.01     -20.22      -0.34   -20.00     16
  25       H     0.05     0.79     6.51     -51.93      -0.34     0.45     16
  26       H     0.07     1.53     6.64     -51.93      -0.34     1.18     16
  27       H     0.05     0.67     8.14     -51.93      -0.42     0.24     16
  28       H     0.05     0.64     8.14     -51.93      -0.42     0.22     16
  29       H     0.05     0.76     8.14     -51.93      -0.42     0.34     16
  30       H     0.05     0.70     7.60     -51.93      -0.39     0.31     16
  31       H     0.07     1.50     6.64     -51.93      -0.34     1.15     16
  32       H     0.05     0.86     8.14     -51.93      -0.42     0.44     16
  33       H     0.05     0.69     8.14     -51.93      -0.42     0.26     16
  34       H     0.42     6.67     7.03     -34.47      -0.24     6.43     16
  35       H     0.18     1.97     7.62     -52.49      -0.40     1.57     16
  36       H     0.18     1.19     8.06     -52.48      -0.42     0.76     16
  37       H     0.18     2.00     7.40     -52.49      -0.39     1.61     16
  38       H     0.19     3.03     6.96     -52.48      -0.37     2.67     16
 Total:         -1.00   -36.71   347.78                 -4.58   -41.29