REAL300018348559.mol2 40                                                        
   1       C     0.03     0.33    11.01     101.05       1.11     1.45     16
   2       O    -0.38    -6.00    10.69     -35.23      -0.38    -6.38     16
   3       C     0.11     1.63     6.05      36.01       0.22     1.85     16
   4       C    -0.07    -1.37     5.50    -104.72      -0.58    -1.94     16
   5       C    -0.17    -2.79     9.53     -39.29      -0.37    -3.17     16
   6       C     0.18     3.01     6.65     -83.83      -0.56     2.45     16
   7       N    -0.75    -8.43     5.73     -59.85      -0.34    -8.78     16
   8       C     0.17     1.52     5.03      -5.20      -0.03     1.50     16
   9       C    -0.09    -0.54     5.25    -104.53      -0.55    -1.09     16
  10       C    -0.06    -0.31     9.68     -39.63      -0.38    -0.69     16
  11       C    -0.11    -0.78     9.75     -39.25      -0.38    -1.16     16
  12       C     0.33     3.16     9.80     -38.72      -0.38     2.78     16
  13       O    -0.68   -10.94    17.25     -57.73      -1.00   -11.94     16
  14       O    -0.68   -10.95    17.25     -57.73      -1.00   -11.94     16
  15       C    -0.11    -0.78     9.75     -39.25      -0.38    -1.17     16
  16       C    -0.06    -0.31     9.68     -39.63      -0.38    -0.70     16
  17       C    -0.15    -3.07     8.86     -38.93      -0.34    -3.41     16
  18       C    -0.09    -2.43     5.87    -105.02      -0.62    -3.05     16
  19       C     0.52    16.98     8.01      34.53       0.28    17.26     16
  20       O    -0.68   -24.25    17.24     -20.53      -0.35   -24.60     16
  21       O    -0.69   -23.88    17.24     -20.54      -0.35   -24.23     16
  22       C    -0.11    -2.46     9.24     -39.12      -0.36    -2.82     16
  23       H     0.08     0.78     8.14     -51.93      -0.42     0.36     16
  24       H     0.04     0.40     8.14     -51.93      -0.42    -0.02     16
  25       H     0.04     0.34     8.14     -51.93      -0.42    -0.09     16
  26       H     0.06     0.81     8.08     -51.93      -0.42     0.39     16
  27       H     0.05     0.63     8.08     -51.93      -0.42     0.21     16
  28       H     0.11     1.47     8.06     -52.48      -0.42     1.04     16
  29       H     0.40     3.54     8.48     -40.82      -0.35     3.19     16
  30       H     0.08     0.79     7.88     -51.93      -0.41     0.38     16
  31       H     0.08     0.78     7.90     -51.93      -0.41     0.37     16
  32       H     0.17     0.63     8.06     -52.48      -0.42     0.21     16
  33       H     0.17     1.21     7.77     -52.49      -0.41     0.80     16
  34       H     0.33     4.43     8.90      45.56       0.41     4.83     16
  35       H     0.33     4.43     8.90      45.56       0.41     4.84     16
  36       H     0.17     1.23     7.77     -52.49      -0.41     0.82     16
  37       H     0.17     0.67     8.06     -52.48      -0.42     0.25     16
  38       H     0.13     2.67     6.31     -52.49      -0.33     2.34     16
  39       H     0.12     2.95     7.64     -52.49      -0.40     2.55     16
 Total:         -1.00   -44.92   351.38                 -7.11   -52.03