REAL300017819045.mol2 34                                                        
   1       C    -0.13    -2.18     9.20      37.16       0.34    -1.84     16
   2       C     0.10     2.04     1.56    -137.44      -0.21     1.83     16
   3       C     0.48    13.64     7.18      36.00       0.26    13.90     16
   4       O    -0.69   -21.91    17.62     -20.24      -0.36   -22.26     16
   5       O    -0.64   -20.06    13.79     -28.06      -0.39   -20.45     16
   6       C    -0.12    -1.95     7.58     -26.22      -0.20    -2.15     16
   7       C     0.12     1.52     8.35      -8.52      -0.07     1.45     16
   8       N    -1.00   -16.83     3.76    -112.11      -0.42   -17.26     16
   9       S     2.69    44.17     6.20    -107.50      -0.67    43.50     16
  10       O    -0.86   -18.68    13.50     -67.24      -0.91   -19.58     16
  11       O    -0.96   -15.97    17.29     -57.17      -0.99   -16.96     16
  12       C    -0.67    -7.65     5.97     -39.58      -0.24    -7.88     16
  13       C     0.03     0.27     9.52     -39.58      -0.38    -0.11     16
  14       C    -0.13    -1.15     8.62     -39.58      -0.34    -1.50     16
  15       C     0.41     4.60     4.82     -39.58      -0.19     4.41     16
  16       F    -0.14    -2.74    16.66       2.25       0.04    -2.70     16
  17       F    -0.16    -2.68    15.31       2.25       0.03    -2.64     16
  18       F    -0.17    -2.73    15.32       2.25       0.03    -2.70     16
  19       F    -0.16    -2.68    15.32       2.25       0.03    -2.65     16
  20       F    -0.17    -2.75    15.31       2.25       0.03    -2.72     16
  21       C    -0.13    -1.28     8.62     -39.58      -0.34    -1.62     16
  22       C     0.04     0.44     9.52     -39.59      -0.38     0.07     16
  23       H     0.05     0.62     7.07     -51.93      -0.37     0.25     16
  24       H     0.08     1.44     7.88     -51.93      -0.41     1.03     16
  25       H     0.05     0.75     8.14     -51.93      -0.42     0.32     16
  26       H     0.09     1.60     8.12     -51.93      -0.42     1.18     16
  27       H     0.08     1.10     8.11     -51.93      -0.42     0.68     16
  28       H     0.08     0.86     8.14     -51.93      -0.42     0.44     16
  29       H     0.08     0.73     7.35     -51.93      -0.38     0.35     16
  30       H     0.19     1.09     7.62     -52.49      -0.40     0.69     16
  31       H     0.19     1.28     7.40     -52.49      -0.39     0.89     16
  32       H     0.19     1.60     7.40     -52.49      -0.39     1.21     16
  33       H     0.20     2.04     7.62     -52.48      -0.40     1.64     16
 Total:         -1.00   -41.48   315.86                 -4.96   -46.44