REAL300007634199.mol2 39                                                        
   1       O    -0.70   -24.76    16.88     -20.23      -0.34   -25.11     16
   2       C     0.49    16.06     8.05      36.00       0.29    16.35     16
   3       O    -0.71   -26.00    18.00     -20.23      -0.36   -26.36     16
   4       C    -0.18    -4.44     5.78     -27.88      -0.16    -4.60     16
   5       C    -0.09    -1.82     4.50     -26.73      -0.12    -1.94     16
   6       C    -0.12    -1.48     5.21     -26.73      -0.14    -1.62     16
   7       C    -0.13    -1.14     5.36     -26.73      -0.14    -1.28     16
   8       C     0.11     0.59     6.22      -4.04      -0.03     0.56     16
   9       N    -1.11    -5.25     6.00     -10.61      -0.06    -5.32     16
  10       S     2.70    14.43     5.74    -107.50      -0.62    13.81     16
  11       O    -0.94    -7.86    17.28     -57.17      -0.99    -8.84     16
  12       O    -0.93    -6.87    16.76     -57.17      -0.96    -7.82     16
  13       C    -0.63    -2.17     5.95     -39.59      -0.24    -2.40     16
  14       C    -0.01     0.00     9.52     -39.59      -0.38    -0.38     16
  15       C    -0.08     0.04    10.05     -39.58      -0.40    -0.36     16
  16       C    -0.06    -0.15     8.62     -39.58      -0.34    -0.49     16
  17       C     0.36     2.33     4.82     -39.58      -0.19     2.14     16
  18       F    -0.12    -2.02    16.64       2.25       0.04    -1.98     16
  19       F    -0.18    -2.23    15.30       2.25       0.03    -2.19     16
  20       F    -0.16    -2.22    15.31       2.25       0.03    -2.18     16
  21       F    -0.17    -2.22    15.31       2.25       0.03    -2.19     16
  22       F    -0.16    -2.19    15.31       2.25       0.03    -2.16     16
  23       C    -0.01    -0.07     8.10     -39.58      -0.32    -0.39     16
  24       H     0.06     1.25     8.14     -51.93      -0.42     0.83     16
  25       H     0.05     1.24     8.14     -51.93      -0.42     0.81     16
  26       H     0.06     1.22     8.10     -51.93      -0.42     0.80     16
  27       H     0.06     1.24     8.10     -51.92      -0.42     0.82     16
  28       H     0.06     0.71     8.14     -51.93      -0.42     0.28     16
  29       H     0.06     0.67     8.14     -51.93      -0.42     0.25     16
  30       H     0.07     0.65     8.14     -51.93      -0.42     0.22     16
  31       H     0.08     0.71     8.14     -51.93      -0.42     0.28     16
  32       H     0.09     0.41     7.75     -51.93      -0.40     0.01     16
  33       H     0.07     0.23     8.14     -51.92      -0.42    -0.20     16
  34       H     0.43     1.63     8.65     -34.48      -0.30     1.34     16
  35       H     0.18    -0.28     7.62     -52.49      -0.40    -0.68     16
  36       H     0.19    -0.80     8.06     -52.48      -0.42    -1.23     16
  37       H     0.19     0.26     7.40     -52.48      -0.39    -0.12     16
  38       H     0.20     1.08     6.96     -52.49      -0.37     0.72     16
 Total:         -1.00   -49.22   360.34                 -5.97   -55.18