REAL300017085781.mol2 37                                                        
   1       O    -0.70   -23.50    16.65     -20.23      -0.34   -23.83     16
   2       C     0.49    15.46     8.05      36.00       0.29    15.75     16
   3       O    -0.71   -25.35    18.00     -20.23      -0.36   -25.71     16
   4       C    -0.17    -4.00     5.62     -27.88      -0.16    -4.15     16
   5       C    -0.08    -1.41     3.15     -89.81      -0.28    -1.69     16
   6       C    -0.13    -1.87     7.42     -25.92      -0.19    -2.07     16
   7       C     0.12     1.18     4.35     -67.12      -0.29     0.89     16
   8       N    -1.09    -8.03     5.79      -4.20      -0.02    -8.06     16
   9       S     2.69    18.96     5.68    -107.50      -0.61    18.35     16
  10       O    -0.95    -8.38    17.28     -57.17      -0.99    -9.36     16
  11       O    -0.94    -9.02    17.05     -57.17      -0.97    -9.99     16
  12       C    -0.67    -3.60     5.95     -39.58      -0.24    -3.84     16
  13       C     0.03     0.15     9.24     -39.58      -0.37    -0.22     16
  14       C    -0.13    -0.81     8.62     -39.59      -0.34    -1.16     16
  15       C     0.41     3.47     4.82     -39.58      -0.19     3.28     16
  16       F     0.00    -0.03    16.66       2.25       0.04     0.01     16
  17       F    -0.23    -3.33    15.30       2.25       0.03    -3.30     16
  18       F    -0.23    -3.22    15.32       2.25       0.03    -3.18     16
  19       F    -0.12    -1.60    15.31       2.25       0.03    -1.56     16
  20       F    -0.16    -2.41    15.31       2.25       0.03    -2.37     16
  21       C    -0.13    -0.75     8.62     -39.58      -0.34    -1.09     16
  22       C     0.03     0.15     9.52     -39.58      -0.38    -0.23     16
  23       C    -0.15    -1.88     7.44     -25.92      -0.19    -2.07     16
  24       H     0.06     1.23     7.84     -51.93      -0.41     0.82     16
  25       H     0.06     1.31     8.14     -51.93      -0.42     0.89     16
  26       H     0.10     1.93     7.67     -51.93      -0.40     1.53     16
  27       H     0.08     1.16     8.14     -51.93      -0.42     0.73     16
  28       H     0.08     1.15     7.90     -51.93      -0.41     0.74     16
  29       H     0.11     0.84     7.76     -51.93      -0.40     0.44     16
  30       H     0.42     2.50     8.94     -34.47      -0.31     2.19     16
  31       H     0.19     0.50     7.62     -52.49      -0.40     0.10     16
  32       H     0.19     1.04     7.40     -52.48      -0.39     0.65     16
  33       H     0.19     0.83     7.40     -52.49      -0.39     0.44     16
  34       H     0.19     0.30     7.62     -52.49      -0.40    -0.10     16
  35       H     0.09     1.02     8.10     -51.93      -0.42     0.60     16
  36       H     0.07     0.84     8.14     -51.93      -0.42     0.42     16
 Total:         -1.00   -45.17   343.82                 -5.81   -50.98