REAL300018536104.mol2 37                                                        
   1       C    -0.08     0.58     9.77      36.00       0.35     0.93     16
   2       C    -0.25     0.50     6.28     -35.81      -0.22     0.28     16
   3       C    -0.18     0.49     5.25    -106.47      -0.56    -0.07     16
   4       C     0.08    -0.80     4.96      -4.98      -0.02    -0.83     16
   5       N    -0.50     7.02     1.59    -116.34      -0.18     6.84     16
   6       H     0.44    -5.09     7.08     -39.29      -0.28    -5.37     16
   7       H     0.41    -6.93     7.16     -39.29      -0.28    -7.21     16
   8       C     0.04    -0.66     4.65      -4.97      -0.02    -0.68     16
   9       C    -0.14     1.90     5.38    -104.29      -0.56     1.34     16
  10       C    -0.06     0.94     9.66     -39.63      -0.38     0.56     16
  11       C    -0.11     1.53    10.04     -39.48      -0.40     1.13     16
  12       C    -0.05     0.59    10.03     -39.63      -0.40     0.19     16
  13       C    -0.11     1.12     9.75     -39.25      -0.38     0.74     16
  14       C     0.31    -2.93     9.76     -38.72      -0.38    -3.31     16
  15       O    -0.58     0.32    17.25     -57.73      -1.00    -0.68     16
  16       O    -0.72     3.52    12.39     -57.73      -0.72     2.81     16
  17       C    -0.11    -0.55     9.70     -40.39      -0.39    -0.94     16
  18       C    -0.20    -2.25     6.27     -38.70      -0.24    -2.49     16
  19       C     0.53    10.84     7.85      32.08       0.25    11.09     16
  20       O    -0.67   -15.78    17.63     -20.71      -0.37   -16.14     16
  21       O    -0.68   -16.25    17.73     -20.71      -0.37   -16.62     16
  22       S     0.28     1.45    22.75    -107.50      -2.45    -1.00     16
  23       H     0.08    -0.59     8.14     -51.93      -0.42    -1.01     16
  24       H     0.08    -0.52     8.14     -51.93      -0.42    -0.95     16
  25       H     0.05    -0.63     6.02     -51.93      -0.31    -0.94     16
  26       H     0.13    -1.73     7.74     -51.93      -0.40    -2.14     16
  27       H     0.14    -1.36     8.08     -51.93      -0.42    -1.78     16
  28       H     0.14    -2.62     8.00     -51.93      -0.42    -3.03     16
  29       H     0.17    -2.09     5.74     -51.93      -0.30    -2.39     16
  30       H     0.17    -3.23     8.03     -52.49      -0.42    -3.65     16
  31       H     0.17    -2.67     8.06     -52.48      -0.42    -3.09     16
  32       H     0.17    -2.54     8.06     -52.49      -0.42    -2.96     16
  33       H     0.18    -1.65     7.77     -52.49      -0.41    -2.06     16
  34       H     0.36    -0.77     8.90      45.56       0.41    -0.37     16
  35       H     0.35    -1.34     8.90      45.56       0.41    -0.94     16
  36       H     0.15     0.79     8.02     -52.49      -0.42     0.37     16
 Total:          0.00   -41.41   322.56                 -8.11   -49.52