REAL300018706546.mol2 40                                                        
   1       O    -0.69   -24.19    16.33     -20.23      -0.33   -24.52     16
   2       C     0.53    17.30     7.08      36.01       0.25    17.55     16
   3       O    -0.69   -24.77    17.19     -20.23      -0.35   -25.12     16
   4       C    -0.15    -3.82     2.50    -156.81      -0.39    -4.21     16
   5       C    -0.05    -1.21     5.28    -104.59      -0.55    -1.76     16
   6       C    -0.04    -0.81     8.73     -39.61      -0.35    -1.15     16
   7       C    -0.19    -3.26     9.90     -39.38      -0.39    -3.65     16
   8       C     0.19     2.75     6.65     -83.78      -0.56     2.20     16
   9       N    -0.75    -7.45     5.73     -59.80      -0.34    -7.80     16
  10       C     0.17     1.15     5.03      -5.19      -0.03     1.13     16
  11       C    -0.06    -0.29     5.24    -104.67      -0.55    -0.84     16
  12       C    -0.09    -0.27     9.70     -39.49      -0.38    -0.66     16
  13       C    -0.07    -0.18    10.03     -39.63      -0.40    -0.58     16
  14       C    -0.10    -0.56     9.75     -39.25      -0.38    -0.94     16
  15       C     0.32     2.82     9.80     -38.72      -0.38     2.44     16
  16       O    -0.66   -10.58    17.25     -57.73      -1.00   -11.58     16
  17       O    -0.68   -10.44    17.25     -57.73      -1.00   -11.43     16
  18       C    -0.09    -0.67     9.40     -39.25      -0.37    -1.04     16
  19       C    -0.20    -2.97     9.31     -39.38      -0.37    -3.34     16
  20       C    -0.09    -1.59     9.38     -39.61      -0.37    -1.96     16
  21       C    -0.15    -3.41     9.75     -26.69      -0.26    -3.67     16
  22       C    -0.17    -3.57     9.57     -26.69      -0.26    -3.83     16
  23       H     0.13     3.08     7.08     -52.49      -0.37     2.71     16
  24       H     0.11     1.70     8.06     -52.49      -0.42     1.28     16
  25       H     0.40     3.47     8.48     -40.82      -0.35     3.13     16
  26       H     0.08     0.48     7.88     -51.93      -0.41     0.07     16
  27       H     0.08     0.52     7.90     -51.92      -0.41     0.11     16
  28       H     0.16     0.21     8.06     -52.49      -0.42    -0.21     16
  29       H     0.17    -0.12     8.06     -52.48      -0.42    -0.54     16
  30       H     0.17     0.89     7.77     -52.49      -0.41     0.49     16
  31       H     0.33     4.37     8.90      45.56       0.41     4.78     16
  32       H     0.33     4.23     8.90      45.56       0.41     4.63     16
  33       H     0.17     1.43     7.77     -52.48      -0.41     1.02     16
  34       H     0.11     1.31     6.73     -52.49      -0.35     0.96     16
  35       H     0.12     1.92     5.91     -52.49      -0.31     1.61     16
  36       H     0.08     1.53     8.14     -51.93      -0.42     1.11     16
  37       H     0.10     2.34     7.69     -51.93      -0.40     1.94     16
  38       H     0.09     2.01     8.14     -51.93      -0.42     1.59     16
  39       H     0.09     1.53     6.07     -51.93      -0.32     1.21     16
 Total:         -1.00   -45.11   342.41                 -8.61   -53.72