REAL300010774374.mol2 37                                                        
   1       O    -0.69   -21.69    17.16     -20.23      -0.35   -22.04     16
   2       C     0.50    13.92     5.82      36.00       0.21    14.13     16
   3       O    -0.66   -20.84    15.28     -27.42      -0.42   -21.26     16
   4       C     0.10     1.98     0.80    -131.31      -0.11     1.88     16
   5       N    -1.07   -17.22     5.20       0.95       0.00   -17.22     16
   6       S     2.69    42.79     5.23    -107.50      -0.56    42.22     16
   7       O    -0.96   -15.71    17.63     -57.17      -1.01   -16.71     16
   8       O    -0.89   -18.86    13.66     -66.46      -0.91   -19.77     16
   9       C    -0.67    -7.29     4.87     -39.58      -0.19    -7.49     16
  10       C     0.04     0.42     7.03     -39.58      -0.28     0.14     16
  11       C    -0.13    -1.25     8.62     -39.58      -0.34    -1.59     16
  12       C     0.42     4.52     4.82     -39.58      -0.19     4.33     16
  13       F    -0.14    -2.65    16.66       2.25       0.04    -2.61     16
  14       F    -0.17    -2.71    15.31       2.25       0.03    -2.68     16
  15       F    -0.17    -2.73    15.32       2.25       0.03    -2.69     16
  16       F    -0.17    -2.77    15.32       2.25       0.03    -2.74     16
  17       F    -0.16    -2.63    15.31       2.25       0.03    -2.60     16
  18       C    -0.13    -1.10     8.62     -39.58      -0.34    -1.44     16
  19       C     0.03     0.26     9.53     -39.58      -0.38    -0.12     16
  20       C    -0.14    -2.20     5.68     -24.74      -0.14    -2.34     16
  21       C    -0.12    -1.55     6.79     -25.07      -0.17    -1.72     16
  22       C    -0.12    -1.54     6.80     -25.61      -0.17    -1.72     16
  23       C    -0.10    -1.71     6.05     -25.61      -0.15    -1.86     16
  24       H     0.41     5.24     8.40     -34.47      -0.29     4.95     16
  25       H     0.20     1.96     7.13     -52.49      -0.37     1.58     16
  26       H     0.19     1.54     7.40     -52.49      -0.39     1.15     16
  27       H     0.19     1.21     7.40     -52.49      -0.39     0.82     16
  28       H     0.19     0.87     7.91     -52.49      -0.42     0.45     16
  29       H     0.05     0.69     2.52     -51.93      -0.13     0.56     16
  30       H     0.10     1.87     7.51     -51.93      -0.39     1.48     16
  31       H     0.06     0.59     8.14     -51.93      -0.42     0.17     16
  32       H     0.06     0.74     8.14     -51.93      -0.42     0.31     16
  33       H     0.06     0.63     8.14     -51.93      -0.42     0.21     16
  34       H     0.06     0.80     8.14     -51.93      -0.42     0.38     16
  35       H     0.08     1.56     7.75     -51.93      -0.40     1.16     16
  36       H     0.06     0.94     7.72     -51.93      -0.40     0.54     16
 Total:         -1.00   -41.92   323.82                 -5.31   -47.23