REAL300007707375.mol2 39                                                        
   1       C    -0.15    -1.98     9.67      37.16       0.36    -1.62     16
   2       C    -0.12    -1.96     4.90     -26.73      -0.13    -2.09     16
   3       C    -0.08    -1.36     2.40     -90.62      -0.22    -1.58     16
   4       C    -0.15    -2.50     8.40      37.16       0.31    -2.19     16
   5       C     0.08     1.59     2.47     -69.08      -0.17     1.42     16
   6       N    -1.07   -18.75     5.10      -5.88      -0.03   -18.78     16
   7       S     2.69    42.96     5.65    -107.50      -0.61    42.35     16
   8       O    -0.95   -16.24    17.28     -57.17      -0.99   -17.22     16
   9       O    -0.92   -18.04    17.05     -57.17      -0.97   -19.01     16
  10       C    -0.63    -7.26     5.82     -39.58      -0.23    -7.49     16
  11       C     0.00    -0.04     8.88     -39.58      -0.35    -0.39     16
  12       C    -0.08    -0.48    10.05     -39.58      -0.40    -0.88     16
  13       C    -0.06    -0.49     8.62     -39.59      -0.34    -0.84     16
  14       C     0.34     3.95     4.82     -39.59      -0.19     3.76     16
  15       F    -0.01    -0.18    16.67       2.25       0.04    -0.14     16
  16       F    -0.19    -3.00    15.32       2.25       0.03    -2.96     16
  17       F    -0.12    -1.86    15.30       2.25       0.03    -1.82     16
  18       F    -0.23    -3.64    15.32       2.25       0.03    -3.60     16
  19       F    -0.22    -3.82    15.31       2.25       0.03    -3.79     16
  20       C    -0.01    -0.15     8.10     -39.58      -0.32    -0.47     16
  21       C     0.50    13.94     5.56      36.00       0.20    14.14     16
  22       O    -0.69   -21.55    17.15     -20.23      -0.35   -21.90     16
  23       O    -0.68   -21.17    16.61     -20.23      -0.34   -21.51     16
  24       H     0.05     0.55     8.14     -51.93      -0.42     0.13     16
  25       H     0.05     0.61     8.14     -51.93      -0.42     0.19     16
  26       H     0.05     0.71     6.56     -51.93      -0.34     0.37     16
  27       H     0.08     1.66     6.96     -51.93      -0.36     1.30     16
  28       H     0.06     0.95     8.14     -51.93      -0.42     0.53     16
  29       H     0.06     0.87     8.14     -51.93      -0.42     0.44     16
  30       H     0.05     0.70     6.56     -51.93      -0.34     0.36     16
  31       H     0.07     1.58     6.64     -51.93      -0.34     1.23     16
  32       H     0.05     0.77     6.51     -51.93      -0.34     0.44     16
  33       H     0.07     1.26     7.21     -51.93      -0.37     0.88     16
  34       H     0.42     6.73     7.03     -34.47      -0.24     6.49     16
  35       H     0.18     1.53     7.62     -52.49      -0.40     1.13     16
  36       H     0.19     0.30     8.06     -52.48      -0.42    -0.13     16
  37       H     0.18     1.12     7.40     -52.49      -0.39     0.73     16
  38       H     0.19     2.17     6.96     -52.48      -0.37     1.80     16
 Total:         -1.00   -40.52   346.52                 -4.98   -45.49