REAL300007749409.mol2 39                                                        
   1       C    -0.14    -2.15     9.91      37.16       0.37    -1.78     16
   2       C    -0.13    -2.36     5.67     -26.73      -0.15    -2.51     16
   3       C    -0.09    -1.54     4.33     -26.73      -0.12    -1.66     16
   4       C    -0.17    -3.41     2.43     -91.77      -0.22    -3.63     16
   5       C     0.14     2.15     5.60      -4.04      -0.02     2.13     16
   6       N    -1.09   -16.37     5.76     -10.61      -0.06   -16.43     16
   7       S     2.69    31.74     5.74    -107.50      -0.62    31.12     16
   8       O    -0.95   -13.05    17.28     -57.17      -0.99   -14.04     16
   9       O    -0.95   -12.12    16.76     -57.17      -0.96   -13.08     16
  10       C    -0.67    -6.07     5.95     -39.58      -0.24    -6.31     16
  11       C     0.04     0.26     9.52     -39.58      -0.38    -0.12     16
  12       C    -0.13    -1.06     8.62     -39.58      -0.34    -1.40     16
  13       C     0.41     4.40     4.82     -39.59      -0.19     4.21     16
  14       F    -0.13    -2.57    16.67       2.25       0.04    -2.53     16
  15       F    -0.16    -2.59    15.30       2.25       0.03    -2.56     16
  16       F    -0.17    -2.73    15.32       2.25       0.03    -2.69     16
  17       F    -0.17    -2.66    15.31       2.25       0.03    -2.63     16
  18       F    -0.16    -2.65    15.32       2.25       0.03    -2.61     16
  19       C    -0.13    -1.12     8.62     -39.59      -0.34    -1.46     16
  20       C     0.04     0.36     9.52     -39.59      -0.38    -0.02     16
  21       C     0.50    13.54     7.10      36.01       0.26    13.80     16
  22       O    -0.68   -20.77    14.86     -20.23      -0.30   -21.07     16
  23       O    -0.70   -20.43    15.78     -20.23      -0.32   -20.75     16
  24       H     0.04     0.62     8.14     -51.93      -0.42     0.20     16
  25       H     0.05     0.77     8.14     -51.93      -0.42     0.35     16
  26       H     0.04     0.55     8.14     -51.93      -0.42     0.13     16
  27       H     0.09     2.11     5.94     -51.93      -0.31     1.80     16
  28       H     0.04     0.76     8.14     -51.93      -0.42     0.33     16
  29       H     0.04     0.62     8.14     -51.93      -0.42     0.20     16
  30       H     0.06     1.20     7.95     -51.93      -0.41     0.79     16
  31       H     0.07     1.45     8.14     -51.93      -0.42     1.03     16
  32       H     0.07     0.88     7.75     -51.93      -0.40     0.48     16
  33       H     0.06     0.84     8.14     -51.93      -0.42     0.42     16
  34       H     0.44     7.73     6.66     -34.46      -0.23     7.50     16
  35       H     0.19     0.87     7.62     -52.49      -0.40     0.47     16
  36       H     0.19     1.23     7.40     -52.48      -0.39     0.84     16
  37       H     0.19     1.36     7.40     -52.48      -0.39     0.97     16
  38       H     0.20     1.19     7.62     -52.49      -0.40     0.79     16
 Total:         -1.00   -39.00   351.54                 -5.41   -44.42