REAL300007985029.mol2 34                                                        
   1       C     0.04     0.70    10.78     101.05       1.09     1.79     16
   2       O    -0.37    -7.85     9.75     -55.08      -0.54    -8.39     16
   3       C     0.02     0.36     2.69     -27.88      -0.07     0.28     16
   4       H     0.06     1.21     7.79     -51.93      -0.40     0.80     16
   5       C     0.13     2.16     5.83      -4.04      -0.02     2.14     16
   6       N    -1.10   -13.70     5.86     -10.61      -0.06   -13.76     16
   7       S     2.69    29.68     5.74    -107.50      -0.62    29.06     16
   8       O    -0.94   -12.06    17.28     -57.17      -0.99   -13.04     16
   9       O    -0.93   -12.30    16.76     -57.17      -0.96   -13.26     16
  10       C    -0.63    -5.28     5.95     -39.58      -0.24    -5.52     16
  11       C     0.00    -0.02     9.52     -39.58      -0.38    -0.39     16
  12       C    -0.08    -0.29    10.05     -39.58      -0.40    -0.69     16
  13       C    -0.06    -0.37     8.62     -39.58      -0.34    -0.72     16
  14       C     0.35     3.57     4.82     -39.58      -0.19     3.37     16
  15       F    -0.13    -2.50    16.66       2.25       0.04    -2.46     16
  16       F    -0.18    -2.70    15.31       2.25       0.03    -2.66     16
  17       F    -0.16    -2.63    15.31       2.25       0.03    -2.60     16
  18       F    -0.17    -2.65    15.32       2.25       0.03    -2.62     16
  19       F    -0.16    -2.63    15.31       2.25       0.03    -2.59     16
  20       C    -0.01    -0.13     8.10     -39.58      -0.32    -0.45     16
  21       C     0.48    14.11     7.42      36.01       0.27    14.38     16
  22       O    -0.67   -22.19    17.37     -26.63      -0.46   -22.65     16
  23       O    -0.69   -21.96    17.83     -20.23      -0.36   -22.33     16
  24       H     0.04     0.88     8.14     -51.93      -0.42     0.46     16
  25       H     0.08     1.15     8.14     -51.93      -0.42     0.73     16
  26       H     0.03     0.39     8.08     -51.93      -0.42    -0.03     16
  27       H     0.09     1.51     7.75     -51.93      -0.40     1.11     16
  28       H     0.09     1.26     8.08     -51.93      -0.42     0.84     16
  29       H     0.42     4.72     8.65     -34.47      -0.30     4.42     16
  30       H     0.19     0.80     7.62     -52.49      -0.40     0.40     16
  31       H     0.19    -0.03     8.06     -52.49      -0.42    -0.45     16
  32       H     0.19     0.87     7.40     -52.49      -0.39     0.48     16
  33       H     0.20     1.80     6.96     -52.48      -0.37     1.43     16
 Total:         -1.00   -44.15   328.96                 -3.82   -47.97