REAL300018346599.mol2 41                                                        
   1       C     0.03    -0.06     9.81     101.05       0.99     0.93     16
   2       O    -0.31    -0.25    10.50     -19.42      -0.20    -0.45     16
   3       C     0.14     0.05     6.69     -39.21      -0.26    -0.21     16
   4       C    -0.20     0.24     9.04     -39.43      -0.36    -0.12     16
   5       C    -0.07     0.15    10.04     -39.61      -0.40    -0.24     16
   6       C    -0.16     0.51     9.30     -39.56      -0.37     0.14     16
   7       C    -0.06     0.13     4.74    -104.65      -0.50    -0.36     16
   8       C    -0.01     0.03     2.53     -70.02      -0.18    -0.15     16
   9       N    -0.48     5.23     1.25    -110.46      -0.14     5.09     16
  10       H     0.41    -6.31     8.59     -39.29      -0.34    -6.64     16
  11       H     0.43    -4.67     6.72     -39.29      -0.26    -4.93     16
  12       C     0.03    -0.37     5.11      -4.98      -0.03    -0.40     16
  13       C    -0.14     1.47     5.36    -104.53      -0.56     0.91     16
  14       C    -0.06     0.60     9.68     -39.63      -0.38     0.22     16
  15       C    -0.11     0.71     9.75     -39.25      -0.38     0.33     16
  16       C     0.33    -0.94     9.80     -38.72      -0.38    -1.32     16
  17       O    -0.66    -3.49    17.25     -57.73      -1.00    -4.48     16
  18       O    -0.65    -3.59    17.25     -57.73      -1.00    -4.59     16
  19       C    -0.11     0.58     9.75     -39.25      -0.38     0.20     16
  20       C    -0.04     0.37     9.68     -39.63      -0.38    -0.01     16
  21       C     0.50     2.68     7.00      36.00       0.25     2.93     16
  22       O    -0.67    -4.38    14.79     -20.23      -0.30    -4.68     16
  23       O    -0.62    -7.70    17.87     -20.22      -0.36    -8.06     16
  24       C    -0.12     0.02     9.61     -39.43      -0.38    -0.36     16
  25       H     0.10    -0.41     8.14     -51.93      -0.42    -0.83     16
  26       H     0.06    -0.23     7.66     -51.93      -0.40    -0.63     16
  27       H     0.06    -0.18     7.66     -51.93      -0.40    -0.57     16
  28       H     0.13    -0.39     6.30     -52.48      -0.33    -0.72     16
  29       H     0.13    -0.56     8.06     -52.49      -0.42    -0.99     16
  30       H     0.12    -0.73     6.73     -52.49      -0.35    -1.08     16
  31       H     0.14    -0.90     7.95     -51.93      -0.41    -1.31     16
  32       H     0.18    -1.16     5.59     -51.93      -0.29    -1.45     16
  33       H     0.14    -1.79     8.05     -51.93      -0.42    -2.21     16
  34       H     0.17    -2.38     8.06     -52.49      -0.42    -2.80     16
  35       H     0.18    -1.04     7.77     -52.49      -0.41    -1.44     16
  36       H     0.34     1.05     8.90      45.56       0.41     1.45     16
  37       H     0.34     1.09     8.90      45.56       0.41     1.49     16
  38       H     0.18    -0.82     7.77     -52.49      -0.41    -1.23     16
  39       H     0.18    -1.67     8.06     -52.48      -0.42    -2.10     16
  40       H     0.14    -0.08     8.04     -52.49      -0.42    -0.51     16
 Total:          0.00   -29.19   345.75                 -6.79   -35.98