REAL300010816017.mol2 36                                                        
   1       O    -0.70   -24.14    16.88     -20.23      -0.34   -24.49     16
   2       C     0.49    15.72     8.05      36.00       0.29    16.01     16
   3       O    -0.71   -25.56    18.00     -20.23      -0.36   -25.93     16
   4       C    -0.18    -4.28     5.78     -27.88      -0.16    -4.44     16
   5       C    -0.09    -1.69     4.50     -26.73      -0.12    -1.81     16
   6       C    -0.13    -1.45     5.36     -26.73      -0.14    -1.59     16
   7       C     0.11     0.84     6.22      -4.04      -0.03     0.81     16
   8       N    -1.11    -5.95     6.00     -10.61      -0.06    -6.02     16
   9       S     2.70    14.96     5.74    -107.50      -0.62    14.34     16
  10       O    -0.94    -7.01    17.28     -57.17      -0.99    -8.00     16
  11       O    -0.93    -7.99    16.76     -57.17      -0.96    -8.95     16
  12       C    -0.68    -2.50     5.95     -39.58      -0.24    -2.74     16
  13       C     0.04     0.13     9.52     -39.58      -0.38    -0.25     16
  14       C    -0.13    -0.62     8.62     -39.58      -0.34    -0.97     16
  15       C     0.41     2.99     4.82     -39.58      -0.19     2.80     16
  16       F    -0.12    -2.07    16.66       2.25       0.04    -2.03     16
  17       F    -0.17    -2.24    15.32       2.25       0.03    -2.21     16
  18       F    -0.17    -2.24    15.30       2.25       0.03    -2.21     16
  19       F    -0.18    -2.34    15.31       2.25       0.03    -2.30     16
  20       F    -0.15    -2.16    15.31       2.25       0.03    -2.13     16
  21       C    -0.13    -0.55     8.62     -39.59      -0.34    -0.90     16
  22       C     0.04     0.10     9.52     -39.58      -0.38    -0.28     16
  23       H     0.06     1.22     8.14     -51.93      -0.42     0.80     16
  24       H     0.06     1.25     8.14     -51.93      -0.42     0.82     16
  25       H     0.06     1.23     8.10     -51.93      -0.42     0.81     16
  26       H     0.06     1.18     8.10     -51.92      -0.42     0.76     16
  27       H     0.07     0.69     8.14     -51.93      -0.42     0.27     16
  28       H     0.07     0.77     8.14     -51.93      -0.42     0.34     16
  29       H     0.09     0.68     7.75     -51.93      -0.40     0.27     16
  30       H     0.07     0.43     8.14     -51.93      -0.42     0.01     16
  31       H     0.42     1.62     8.65     -34.46      -0.30     1.32     16
  32       H     0.20     0.26     7.62     -52.49      -0.40    -0.14     16
  33       H     0.19     0.78     7.40     -52.49      -0.39     0.39     16
  34       H     0.19     0.59     7.40     -52.49      -0.39     0.20     16
  35       H     0.19    -0.04     7.62     -52.49      -0.40    -0.44     16
 Total:         -1.00   -47.42   338.87                 -5.30   -52.72