REAL300017548552.mol2 37                                                        
   1       O    -0.68   -24.59    17.40     -26.63      -0.46   -25.06     16
   2       C     0.50    16.58     8.13      36.00       0.29    16.87     16
   3       O    -0.70   -25.11    18.00     -20.23      -0.36   -25.47     16
   4       C     0.00    -0.03     6.50      36.00       0.23     0.21     16
   5       O    -0.36    -8.09     9.88     -55.08      -0.54    -8.63     16
   6       C     0.05     0.76     5.94      37.16       0.22     0.98     16
   7       C    -0.12    -1.23     5.73     -26.74      -0.15    -1.39     16
   8       C     0.11     0.59     6.22      -4.05      -0.03     0.56     16
   9       N    -1.11    -4.22     6.00     -10.62      -0.06    -4.28     16
  10       S     2.70    10.95     5.74    -107.50      -0.62    10.33     16
  11       O    -0.94    -5.98    17.28     -57.17      -0.99    -6.96     16
  12       O    -0.93    -6.42    16.76     -57.17      -0.96    -7.38     16
  13       C    -0.68    -1.41     5.95     -39.59      -0.24    -1.65     16
  14       C     0.04     0.06     9.52     -39.58      -0.38    -0.32     16
  15       C    -0.13    -0.41     8.62     -39.58      -0.34    -0.75     16
  16       C     0.42     2.44     4.82     -39.59      -0.19     2.25     16
  17       F    -0.12    -1.99    16.66       2.25       0.04    -1.96     16
  18       F    -0.16    -2.04    15.31       2.25       0.03    -2.00     16
  19       F    -0.17    -2.09    15.32       2.25       0.03    -2.06     16
  20       F    -0.17    -2.07    15.31       2.25       0.03    -2.04     16
  21       F    -0.16    -2.04    15.32       2.25       0.03    -2.00     16
  22       C    -0.13    -0.39     8.62     -39.58      -0.34    -0.74     16
  23       C     0.04     0.05     9.52     -39.58      -0.38    -0.32     16
  24       H     0.04     1.03     8.14     -51.93      -0.42     0.60     16
  25       H     0.04     1.01     8.14     -51.93      -0.42     0.59     16
  26       H     0.04     0.55     8.14     -51.93      -0.42     0.13     16
  27       H     0.04     0.52     8.14     -51.93      -0.42     0.10     16
  28       H     0.08     0.81     8.14     -51.93      -0.42     0.39     16
  29       H     0.08     0.89     8.14     -51.93      -0.42     0.47     16
  30       H     0.09     0.40     7.75     -51.93      -0.40     0.00     16
  31       H     0.07     0.21     8.14     -51.93      -0.42    -0.21     16
  32       H     0.43     1.18     8.65     -34.47      -0.30     0.89     16
  33       H     0.19    -0.17     7.62     -52.48      -0.40    -0.58     16
  34       H     0.19     0.44     7.40     -52.48      -0.39     0.05     16
  35       H     0.19     0.39     7.40     -52.48      -0.39     0.00     16
  36       H     0.19    -0.25     7.62     -52.48      -0.40    -0.65     16
 Total:         -1.00   -49.70   351.96                 -5.05   -54.75