REAL300009850759.mol2 39                                                        
   1       O    -0.69   -24.52    17.00     -20.79      -0.35   -24.87     16
   2       C     0.50    16.52     7.79      31.74       0.25    16.77     16
   3       O    -0.69   -25.27    17.99     -20.79      -0.37   -25.65     16
   4       C    -0.13    -3.45     9.49     -39.40      -0.37    -3.83     16
   5       C    -0.11    -2.49     9.37     -39.16      -0.37    -2.86     16
   6       C     0.06     1.12     6.77     -38.92      -0.26     0.85     16
   7       C    -0.17    -2.80    10.82     -38.89      -0.42    -3.22     16
   8       C    -0.22    -3.08     5.39    -104.96      -0.57    -3.64     16
   9       C     0.59     8.21     7.61     -12.48      -0.09     8.11     16
  10       O    -0.52    -9.43    16.53       5.29       0.09    -9.34     16
  11       N    -0.61    -5.40     2.97    -174.01      -0.52    -5.91     16
  12       C     0.09     0.42     5.70      -3.71      -0.02     0.40     16
  13       C    -0.13    -0.35     6.08     -26.61      -0.16    -0.51     16
  14       C    -0.10    -0.03     5.17     -26.69      -0.14    -0.17     16
  15       C    -0.17    -0.63     2.14     -90.50      -0.19    -0.83     16
  16       C     0.38     1.01     8.83      37.16       0.33     1.34     16
  17       O    -0.73   -11.14    17.78     -57.73      -1.03   -12.17     16
  18       O    -0.69   -10.56    16.40     -57.73      -0.95   -11.51     16
  19       C     0.12     0.87     5.71      -3.71      -0.02     0.85     16
  20       C    -0.02    -0.22     9.72      30.62       0.30     0.08     16
  21       O    -0.16    -2.53    10.10       5.91       0.06    -2.47     16
  22       H     0.10     2.50     7.70     -52.49      -0.40     2.09     16
  23       H     0.16     3.56     7.45     -52.48      -0.39     3.17     16
  24       H     0.16     2.54     8.06     -52.49      -0.42     2.12     16
  25       H     0.10     0.62     4.16     -51.93      -0.22     0.41     16
  26       H     0.08     0.19     8.14     -51.93      -0.42    -0.24     16
  27       H     0.08     0.37     8.14     -51.93      -0.42    -0.06     16
  28       H     0.09     0.09     8.14     -51.93      -0.42    -0.34     16
  29       H     0.09    -0.14     8.14     -51.93      -0.42    -0.56     16
  30       H     0.08    -0.14     8.14     -51.93      -0.42    -0.57     16
  31       H     0.13     0.88     7.74     -51.93      -0.40     0.47     16
  32       H     0.14    -0.12     8.14     -51.93      -0.42    -0.54     16
  33       H     0.14    -0.22     8.14     -51.93      -0.42    -0.64     16
  34       H     0.33     4.54     8.90      45.56       0.41     4.95     16
  35       H     0.33     4.72     8.90      45.56       0.41     5.13     16
  36       H     0.07     0.35     8.14     -51.93      -0.42    -0.07     16
  37       H     0.12     1.42     6.62     -51.93      -0.34     1.08     16
  38       H     0.21     1.42     7.04     -52.49      -0.37     1.05     16
 Total:         -1.00   -51.20   331.07                 -4.95   -56.15