REAL300009850666.mol2 41                                                        
   1       O    -0.67   -17.88    13.94     -20.23      -0.28   -18.16     16
   2       C     0.51    12.69     5.00      36.01       0.18    12.87     16
   3       O    -0.66   -18.79    17.76     -20.22      -0.36   -19.15     16
   4       C    -0.18    -3.27     0.42    -157.24      -0.07    -3.34     16
   5       C     0.56     9.53     3.85     -10.99      -0.04     9.49     16
   6       O    -0.53    -9.54    12.61       5.56       0.07    -9.47     16
   7       N    -0.61    -8.23     2.62    -172.77      -0.45    -8.68     16
   8       C     0.13     1.24     6.44      -3.71      -0.02     1.21     16
   9       C    -0.18    -2.03     5.29     -26.61      -0.14    -2.17     16
  10       C     0.39     4.84     5.89     -26.69      -0.16     4.68     16
  11       O    -0.72   -15.64    16.88     -57.73      -0.97   -16.62     16
  12       O    -0.75   -15.73    16.88     -57.73      -0.97   -16.70     16
  13       C    -0.18    -2.52     5.13     -26.61      -0.14    -2.66     16
  14       C     0.13     1.64     3.77      -3.71      -0.01     1.62     16
  15       C    -0.10    -1.43     4.09     -26.93      -0.11    -1.54     16
  16       C    -0.61    -7.05     6.07      37.17       0.23    -6.82     16
  17       S     2.41    33.56     5.31    -107.50      -0.57    32.99     16
  18       O    -0.94   -15.69    17.94     -57.82      -1.04   -16.73     16
  19       O    -0.95   -15.35    18.11     -57.82      -1.05   -16.39     16
  20       C    -0.62    -8.88     5.98      37.18       0.22    -8.66     16
  21       C    -0.06    -1.14     4.25     -26.92      -0.11    -1.25     16
  22       H     0.13     1.31     7.00     -51.93      -0.36     0.94     16
  23       H     0.09     0.49     8.14     -51.93      -0.42     0.07     16
  24       H     0.11     1.62     8.14     -51.93      -0.42     1.19     16
  25       H     0.12     1.23     7.87     -51.93      -0.41     0.82     16
  26       H     0.14     1.02     8.14     -51.93      -0.42     0.60     16
  27       H     0.32     6.23     8.90      45.56       0.41     6.63     16
  28       H     0.32     6.10     8.90      45.56       0.41     6.50     16
  29       H     0.12     1.62     7.88     -51.92      -0.41     1.21     16
  30       H     0.13     2.51     6.90     -51.92      -0.36     2.15     16
  31       H     0.14     2.29     2.98     -51.93      -0.15     2.13     16
  32       H     0.08     0.60     8.11     -51.93      -0.42     0.18     16
  33       H     0.09     1.21     4.79     -51.93      -0.25     0.96     16
  34       H     0.10     1.61     8.01     -51.93      -0.42     1.19     16
  35       H     0.14     1.16     8.14     -51.93      -0.42     0.74     16
  36       H     0.12     1.26     6.65     -51.93      -0.35     0.91     16
  37       H     0.13     1.58     8.14     -51.92      -0.42     1.16     16
  38       H     0.17     2.48     4.83     -52.24      -0.25     2.22     16
  39       H     0.09     1.64     8.01     -51.93      -0.42     1.23     16
  40       H     0.09     1.68     8.09     -51.93      -0.42     1.26     16
 Total:         -1.00   -42.06   317.88                 -6.53   -48.59