REAL300018128532.mol2 40                                                        
   1       O    -0.70   -25.82    18.00     -20.22      -0.36   -26.19     16
   2       C     0.52    17.38     7.82      36.00       0.28    17.67     16
   3       O    -0.70   -24.96    17.37     -20.23      -0.35   -25.31     16
   4       C    -0.19    -4.97     5.90     -91.77      -0.54    -5.51     16
   5       H     0.09     2.26     8.14     -51.93      -0.42     1.83     16
   6       C    -0.16    -3.38     9.38     -26.73      -0.25    -3.63     16
   7       C    -0.11    -2.25     5.61     -91.77      -0.52    -2.77     16
   8       H     0.11     2.50     8.14     -51.93      -0.42     2.08     16
   9       C    -0.08    -1.36     5.61    -104.59      -0.59    -1.94     16
  10       C    -0.07    -1.06     9.73     -39.62      -0.39    -1.45     16
  11       C    -0.18    -2.23     9.90     -39.38      -0.39    -2.62     16
  12       C     0.19     2.03     6.65     -83.79      -0.56     1.48     16
  13       N    -0.75    -4.84     5.73     -59.80      -0.34    -5.18     16
  14       C     0.17     0.64     5.03      -5.19      -0.03     0.62     16
  15       C    -0.09    -0.24     5.26    -104.53      -0.55    -0.79     16
  16       C    -0.06    -0.14     9.68     -39.62      -0.38    -0.52     16
  17       C    -0.11    -0.51     9.75     -39.25      -0.38    -0.89     16
  18       C     0.33     2.38     9.80     -38.72      -0.38     2.00     16
  19       O    -0.67    -9.60    17.25     -57.73      -1.00   -10.59     16
  20       O    -0.67    -9.62    17.25     -57.73      -1.00   -10.61     16
  21       C    -0.11    -0.50     9.75     -39.25      -0.38    -0.88     16
  22       C    -0.06    -0.13     9.68     -39.63      -0.38    -0.51     16
  23       C    -0.19    -2.20     9.31     -39.38      -0.37    -2.57     16
  24       C    -0.08    -1.15     9.29     -39.61      -0.37    -1.52     16
  25       H     0.08     1.44     6.17     -51.93      -0.32     1.12     16
  26       H     0.10     2.21     7.95     -51.93      -0.41     1.80     16
  27       H     0.12     1.80     8.06     -52.48      -0.42     1.38     16
  28       H     0.12     1.14     8.06     -52.48      -0.42     0.72     16
  29       H     0.40     2.10     8.48     -40.82      -0.35     1.76     16
  30       H     0.08     0.26     7.90     -51.93      -0.41    -0.15     16
  31       H     0.08     0.29     7.88     -51.93      -0.41    -0.12     16
  32       H     0.17     0.13     8.06     -52.49      -0.42    -0.30     16
  33       H     0.17     0.84     7.77     -52.49      -0.41     0.44     16
  34       H     0.33     3.86     8.90      45.56       0.41     4.27     16
  35       H     0.33     3.88     8.90      45.56       0.41     4.28     16
  36       H     0.17     0.80     7.77     -52.48      -0.41     0.39     16
  37       H     0.17     0.05     8.06     -52.49      -0.42    -0.37     16
  38       H     0.12     1.03     6.73     -52.48      -0.35     0.67     16
  39       H     0.12     1.73     6.01     -52.49      -0.32     1.41     16
 Total:         -1.00   -46.21   346.73                 -9.10   -55.31