REAL300009850811.mol2 49                                                        
   1       O    -0.67   -19.94    13.64     -20.23      -0.28   -20.22     16
   2       C     0.51    14.38     4.99      36.01       0.18    14.56     16
   3       O    -0.68   -21.41    17.76     -20.23      -0.36   -21.77     16
   4       C    -0.16    -3.54     0.42    -157.25      -0.07    -3.61     16
   5       C     0.56    11.73     3.86     -10.98      -0.04    11.69     16
   6       O    -0.56   -12.41    12.52       5.56       0.07   -12.34     16
   7       N    -0.60   -10.17     2.57    -172.67      -0.44   -10.61     16
   8       C     0.11     1.48     6.30      -3.66      -0.02     1.45     16
   9       C    -0.11    -1.26     5.25     -26.69      -0.14    -1.40     16
  10       C    -0.07    -0.68     0.75    -154.34      -0.12    -0.80     16
  11       C    -0.10    -0.56     6.41     -26.07      -0.17    -0.72     16
  12       C    -0.17    -1.18     2.96     -89.73      -0.27    -1.45     16
  13       C     0.39     2.23     9.53      37.16       0.35     2.58     16
  14       O    -0.70   -11.94    16.53     -57.73      -0.95   -12.89     16
  15       O    -0.75   -13.23    17.78     -57.73      -1.03   -14.26     16
  16       C    -0.12    -1.10     6.78     -26.08      -0.18    -1.28     16
  17       C    -0.11    -1.62     5.02     -26.69      -0.13    -1.76     16
  18       C     0.11     1.82     3.68      -3.66      -0.01     1.80     16
  19       C    -0.11    -1.98     4.11     -26.94      -0.11    -2.09     16
  20       C    -0.08    -1.22     6.15      37.17       0.23    -0.99     16
  21       S    -0.30    -5.12    22.33    -107.50      -2.40    -7.53     16
  22       C    -0.10    -1.83     6.06      37.21       0.23    -1.61     16
  23       C    -0.08    -1.63     4.30     -26.90      -0.12    -1.74     16
  24       H     0.09     1.32     6.98     -51.93      -0.36     0.95     16
  25       H     0.06     0.59     8.06     -51.93      -0.42     0.18     16
  26       H     0.08     1.10     8.14     -51.93      -0.42     0.67     16
  27       H     0.07     0.53     8.12     -51.93      -0.42     0.11     16
  28       H     0.09     0.25     8.03     -51.93      -0.42    -0.17     16
  29       H     0.10     0.52     7.34     -51.93      -0.38     0.14     16
  30       H     0.15     1.35     7.19     -51.93      -0.37     0.98     16
  31       H     0.13     0.25     8.14     -51.93      -0.42    -0.18     16
  32       H     0.14     0.31     7.84     -51.93      -0.41    -0.09     16
  33       H     0.33     5.07     8.90      45.56       0.41     5.48     16
  34       H     0.32     5.13     8.90      45.56       0.41     5.54     16
  35       H     0.09     1.07     8.09     -51.93      -0.42     0.65     16
  36       H     0.09     0.61     7.85     -51.93      -0.41     0.20     16
  37       H     0.07     0.91     7.30     -51.93      -0.38     0.53     16
  38       H     0.10     2.05     6.61     -51.93      -0.34     1.70     16
  39       H     0.11     2.21     2.91     -51.93      -0.15     2.06     16
  40       H     0.05     0.60     7.42     -51.93      -0.39     0.21     16
  41       H     0.08     1.43     4.85     -51.93      -0.25     1.18     16
  42       H     0.09     1.73     8.06     -51.93      -0.42     1.31     16
  43       H     0.10     1.33     8.14     -51.93      -0.42     0.90     16
  44       H     0.08     1.23     6.65     -51.93      -0.35     0.88     16
  45       H     0.09     1.52     8.14     -51.93      -0.42     1.10     16
  46       H     0.13     2.59     4.77     -52.64      -0.25     2.34     16
  47       H     0.08     1.70     8.06     -51.93      -0.42     1.29     16
  48       H     0.07     1.61     8.09     -51.93      -0.42     1.19     16
 Total:         -1.00   -42.19   364.32                 -8.14   -50.33