REAL300017866837.mol2 37                                                        
   1       C    -0.13    -1.42     8.80      37.16       0.33    -1.09     16
   2       C    -0.17    -2.26     6.41     -90.62      -0.58    -2.84     16
   3       C    -0.15    -2.48     9.44     -26.73      -0.25    -2.73     16
   4       C    -0.14    -2.33     5.33     -90.62      -0.48    -2.82     16
   5       C     0.11     2.14     2.67     -69.08      -0.18     1.96     16
   6       N    -1.07   -18.45     5.02      -5.88      -0.03   -18.48     16
   7       S     2.69    42.19     5.65    -107.50      -0.61    41.58     16
   8       O    -0.95   -15.97    17.28     -57.17      -0.99   -16.96     16
   9       O    -0.92   -17.67    17.05     -57.17      -0.97   -18.65     16
  10       C    -0.63    -6.86     5.44     -39.58      -0.22    -7.08     16
  11       C    -0.01    -0.06     7.78     -39.58      -0.31    -0.37     16
  12       C    -0.08    -0.38     9.95     -39.58      -0.39    -0.77     16
  13       C    -0.06    -0.43     8.62     -39.58      -0.34    -0.77     16
  14       C     0.35     3.80     4.82     -39.58      -0.19     3.61     16
  15       F    -0.14    -2.70    16.65       2.25       0.04    -2.66     16
  16       F    -0.18    -2.75    15.31       2.25       0.03    -2.72     16
  17       F    -0.16    -2.62    15.31       2.25       0.03    -2.59     16
  18       F    -0.17    -2.67    15.31       2.25       0.03    -2.64     16
  19       F    -0.16    -2.64    15.32       2.25       0.03    -2.61     16
  20       C    -0.01    -0.12     8.10     -39.58      -0.32    -0.44     16
  21       C     0.50    14.07     7.16      36.01       0.26    14.33     16
  22       O    -0.69   -21.50    17.11     -20.23      -0.35   -21.84     16
  23       O    -0.68   -21.71    17.42     -20.23      -0.35   -22.06     16
  24       H     0.06     0.75     7.13     -51.93      -0.37     0.38     16
  25       H     0.06     0.57     8.14     -51.93      -0.42     0.14     16
  26       H     0.05     0.46     6.47     -51.93      -0.34     0.13     16
  27       H     0.10     1.19     8.14     -51.93      -0.42     0.77     16
  28       H     0.09     1.31     8.14     -51.93      -0.42     0.89     16
  29       H     0.11     2.02     7.45     -51.93      -0.39     1.64     16
  30       H     0.11     1.71     8.14     -51.93      -0.42     1.28     16
  31       H     0.08     1.34     5.01     -51.93      -0.26     1.08     16
  32       H     0.42     6.52     8.84     -34.47      -0.30     6.22     16
  33       H     0.19     1.38     7.62     -52.49      -0.40     0.98     16
  34       H     0.19     0.11     8.06     -52.49      -0.42    -0.31     16
  35       H     0.19     0.94     7.40     -52.48      -0.39     0.55     16
  36       H     0.19     2.12     6.96     -52.49      -0.37     1.75     16
 Total:         -1.00   -42.40   339.43                 -5.62   -48.02