REAL300007991419.mol2 37                                                        
   1       O    -0.69   -22.06    18.00     -20.23      -0.36   -22.42     16
   2       C     0.49    13.78     7.36      36.00       0.26    14.05     16
   3       O    -0.67   -21.28    17.36     -20.23      -0.35   -21.63     16
   4       C     0.08     1.61     2.63     -69.09      -0.18     1.43     16
   5       C    -0.08    -1.27     5.08     -26.73      -0.14    -1.40     16
   6       C    -0.15    -1.82     5.61     -90.62      -0.51    -2.32     16
   7       C    -0.18    -2.10    10.18     -26.73      -0.27    -2.37     16
   8       C    -0.18    -1.95    10.25     -26.73      -0.27    -2.22     16
   9       N    -1.07   -16.81     4.41      -5.88      -0.03   -16.84     16
  10       S     2.69    38.27     5.65    -107.50      -0.61    37.66     16
  11       O    -0.95   -13.98    17.28     -57.17      -0.99   -14.97     16
  12       O    -0.92   -17.31    17.05     -57.17      -0.97   -18.28     16
  13       C    -0.67    -6.40     5.82     -39.58      -0.23    -6.63     16
  14       C     0.04     0.35     8.88     -39.58      -0.35     0.00     16
  15       C    -0.13    -1.11     8.62     -39.59      -0.34    -1.45     16
  16       C     0.42     4.25     4.82     -39.59      -0.19     4.06     16
  17       F    -0.13    -2.53    16.66       2.25       0.04    -2.49     16
  18       F    -0.17    -2.66    15.31       2.25       0.03    -2.62     16
  19       F    -0.17    -2.63    15.31       2.25       0.03    -2.60     16
  20       F    -0.17    -2.67    15.31       2.25       0.03    -2.63     16
  21       F    -0.16    -2.56    15.31       2.25       0.03    -2.53     16
  22       C    -0.13    -1.00     8.62     -39.59      -0.34    -1.34     16
  23       C     0.04     0.24     9.52     -39.58      -0.38    -0.13     16
  24       H     0.08     1.26     7.21     -51.92      -0.37     0.89     16
  25       H     0.08     1.47     7.88     -51.93      -0.41     1.06     16
  26       H     0.07     1.16     8.14     -51.93      -0.42     0.73     16
  27       H     0.10     0.98     7.69     -51.93      -0.40     0.59     16
  28       H     0.09     0.94     8.14     -51.93      -0.42     0.51     16
  29       H     0.10     1.14     8.03     -51.93      -0.42     0.73     16
  30       H     0.09     1.00     8.14     -51.93      -0.42     0.58     16
  31       H     0.09     0.84     8.14     -51.93      -0.42     0.41     16
  32       H     0.42     5.76     8.84     -34.47      -0.30     5.46     16
  33       H     0.20     1.60     7.62     -52.49      -0.40     1.20     16
  34       H     0.19     1.41     7.40     -52.49      -0.39     1.02     16
  35       H     0.19     1.11     7.40     -52.48      -0.39     0.72     16
  36       H     0.19     0.79     7.62     -52.49      -0.40     0.39     16
 Total:         -1.00   -42.17   347.29                 -6.01   -48.18