REAL300007686192.mol2 37                                                        
   1       O    -0.70   -17.90    11.48     -27.83      -0.32   -18.22     16
   2       C     0.51    13.34     4.19      36.01       0.15    13.49     16
   3       O    -0.66   -20.70    17.88     -25.61      -0.46   -21.16     16
   4       C     0.08     1.58     3.33     -68.75      -0.23     1.35     16
   5       H     0.08     1.50     8.12     -51.93      -0.42     1.07     16
   6       C    -0.12    -1.91     5.33     -26.61      -0.14    -2.05     16
   7       C    -0.12    -1.41     5.88     -26.69      -0.16    -1.57     16
   8       C    -0.14    -1.39     6.08     -26.61      -0.16    -1.55     16
   9       C     0.12     1.36     6.36      -3.69      -0.02     1.33     16
  10       N    -0.97   -15.98     3.30    -107.67      -0.36   -16.33     16
  11       S     2.69    47.21     5.04    -107.50      -0.54    46.66     16
  12       O    -0.89   -20.44    12.61     -69.50      -0.88   -21.31     16
  13       O    -0.97   -16.32    16.61     -57.17      -0.95   -17.27     16
  14       C    -0.66    -9.57     5.65     -39.58      -0.22    -9.80     16
  15       C     0.02     0.26     9.57     -39.58      -0.38    -0.12     16
  16       C    -0.15    -1.70     8.62     -39.59      -0.34    -2.04     16
  17       C     0.41     5.93     4.82     -39.58      -0.19     5.74     16
  18       F    -0.15    -3.24    16.66       2.25       0.04    -3.21     16
  19       F    -0.15    -3.00    15.31       2.25       0.03    -2.97     16
  20       F    -0.18    -3.28    15.32       2.25       0.03    -3.25     16
  21       F    -0.17    -3.16    15.32       2.25       0.03    -3.13     16
  22       F    -0.17    -3.22    15.31       2.25       0.03    -3.18     16
  23       C    -0.14    -1.96     8.62     -39.58      -0.34    -2.31     16
  24       C     0.10     1.49     7.84     -39.59      -0.31     1.18     16
  25       H     0.07     1.14     8.14     -51.93      -0.42     0.72     16
  26       H     0.07     1.22     8.00     -51.93      -0.42     0.81     16
  27       H     0.06     0.71     8.14     -51.93      -0.42     0.29     16
  28       H     0.06     0.64     8.14     -51.93      -0.42     0.22     16
  29       H     0.07     0.56     8.14     -51.93      -0.42     0.13     16
  30       H     0.06     0.66     8.14     -51.93      -0.42     0.23     16
  31       H     0.07     0.81     8.14     -51.93      -0.42     0.39     16
  32       H     0.08     0.80     7.20     -51.93      -0.37     0.42     16
  33       H     0.18     1.26     8.05     -52.49      -0.42     0.84     16
  34       H     0.19     1.69     7.40     -52.49      -0.39     1.31     16
  35       H     0.19     2.37     7.40     -52.49      -0.39     1.98     16
  36       H     0.22     3.85     5.70     -52.49      -0.30     3.55     16
 Total:         -1.00   -36.85   321.87                 -6.07   -42.92