REAL300009850694.mol2 44                                                        
   1       O    -0.71   -26.11    18.00     -20.23      -0.36   -26.47     16
   2       C     0.50    16.54     6.99      36.01       0.25    16.80     16
   3       O    -0.70   -25.24    17.29     -20.23      -0.35   -25.59     16
   4       C    -0.15    -3.75     2.58     -91.77      -0.24    -3.99     16
   5       C    -0.11    -2.37     4.89     -26.73      -0.13    -2.50     16
   6       C    -0.10    -1.47     5.09     -26.73      -0.14    -1.60     16
   7       C    -0.10    -1.22     3.01     -91.78      -0.28    -1.49     16
   8       C     0.52     6.97     5.47     -10.99      -0.06     6.91     16
   9       O    -0.50    -8.50    11.06       5.55       0.06    -8.44     16
  10       N    -0.68    -6.47     5.17      -9.89      -0.05    -6.52     16
  11       C     0.19     1.94     6.28     -83.75      -0.53     1.41     16
  12       C    -0.15    -1.16     9.69     -38.96      -0.38    -1.54     16
  13       C    -0.03    -0.24     5.74    -106.77      -0.61    -0.85     16
  14       C    -0.06    -0.35     9.73     -39.53      -0.38    -0.74     16
  15       C    -0.11    -0.95     9.65     -39.64      -0.38    -1.33     16
  16       C     0.32     3.64     9.78     -38.67      -0.38     3.26     16
  17       O    -0.68   -11.76    17.20     -57.73      -0.99   -12.76     16
  18       O    -0.68   -11.96    17.19     -57.73      -0.99   -12.95     16
  19       C    -0.08    -0.76     9.49     -38.79      -0.37    -1.13     16
  20       C    -0.04    -0.35     5.74    -106.82      -0.61    -0.96     16
  21       C    -0.08    -0.68     9.74     -39.48      -0.38    -1.07     16
  22       C    -0.10    -1.03     8.59     -39.76      -0.34    -1.37     16
  23       C    -0.11    -1.43     5.36     -26.73      -0.14    -1.57     16
  24       C    -0.10    -1.96     4.70     -26.73      -0.13    -2.09     16
  25       H     0.06     1.35     8.14     -51.93      -0.42     0.93     16
  26       H     0.05     1.23     8.14     -51.93      -0.42     0.81     16
  27       H     0.09     2.09     5.51     -51.93      -0.29     1.80     16
  28       H     0.07     0.93     8.14     -51.93      -0.42     0.51     16
  29       H     0.06     0.88     8.10     -51.93      -0.42     0.46     16
  30       H     0.10     0.77     8.14     -51.93      -0.42     0.34     16
  31       H     0.41     2.39     8.38     -40.82      -0.34     2.05     16
  32       H     0.14     0.76     8.06     -52.48      -0.42     0.34     16
  33       H     0.17     0.49     8.06     -52.49      -0.42     0.07     16
  34       H     0.17     1.34     7.73     -52.48      -0.41     0.93     16
  35       H     0.33     4.77     8.90      45.56       0.41     5.17     16
  36       H     0.33     4.84     8.90      45.56       0.41     5.24     16
  37       H     0.18     1.63     7.73     -52.48      -0.41     1.23     16
  38       H     0.15     1.00     8.06     -52.49      -0.42     0.58     16
  39       H     0.15     1.79     6.19     -52.48      -0.32     1.46     16
  40       H     0.06     0.55     7.67     -51.93      -0.40     0.15     16
  41       H     0.07     0.90     8.14     -51.93      -0.42     0.48     16
  42       H     0.06     1.42     6.95     -51.93      -0.36     1.06     16
  43       H     0.06     1.15     8.14     -51.93      -0.42     0.73     16
 Total:         -1.00   -48.39   357.53                 -8.47   -56.86