REAL300009850681.mol2 40                                                        
   1       O    -0.70   -24.82    16.88     -20.23      -0.34   -25.16     16
   2       C     0.49    16.30     8.05      36.00       0.29    16.59     16
   3       O    -0.71   -26.27    18.00     -20.23      -0.36   -26.63     16
   4       C    -0.18    -4.63     5.78     -27.89      -0.16    -4.79     16
   5       C    -0.09    -1.86     4.50     -26.73      -0.12    -1.98     16
   6       C    -0.11    -1.59     4.50     -26.73      -0.12    -1.71     16
   7       C    -0.14    -1.38     5.70     -27.88      -0.16    -1.53     16
   8       C     0.52     5.01     7.55     -10.98      -0.08     4.93     16
   9       O    -0.51    -6.81    13.65       5.56       0.08    -6.73     16
  10       N    -0.68    -4.16     5.32      -9.89      -0.05    -4.22     16
  11       C     0.19     1.24     6.26     -83.76      -0.52     0.72     16
  12       C    -0.15    -0.65     9.69     -38.96      -0.38    -1.03     16
  13       C    -0.03    -0.14     5.74    -106.77      -0.61    -0.76     16
  14       C    -0.06    -0.19     9.73     -39.52      -0.38    -0.57     16
  15       C    -0.11    -0.62     9.65     -39.64      -0.38    -1.00     16
  16       C     0.32     2.77     9.78     -38.67      -0.38     2.39     16
  17       O    -0.68   -10.40    17.19     -57.73      -0.99   -11.39     16
  18       O    -0.68   -10.21    17.20     -57.73      -0.99   -11.21     16
  19       C    -0.08    -0.54     9.49     -38.78      -0.37    -0.91     16
  20       C    -0.04    -0.24     5.74    -106.82      -0.61    -0.85     16
  21       C    -0.07    -0.44     9.74     -39.48      -0.38    -0.82     16
  22       C    -0.10    -0.74     8.54     -39.76      -0.34    -1.08     16
  23       H     0.06     1.34     8.14     -51.93      -0.42     0.92     16
  24       H     0.06     1.35     8.14     -51.93      -0.42     0.93     16
  25       H     0.06     1.24     8.10     -51.93      -0.42     0.82     16
  26       H     0.06     1.24     8.10     -51.93      -0.42     0.81     16
  27       H     0.06     0.99     8.10     -51.93      -0.42     0.57     16
  28       H     0.07     1.01     8.10     -51.93      -0.42     0.59     16
  29       H     0.10     0.83     8.14     -51.93      -0.42     0.41     16
  30       H     0.10     0.84     8.14     -51.93      -0.42     0.42     16
  31       H     0.42     1.14     8.81     -40.82      -0.36     0.78     16
  32       H     0.14     0.23     8.06     -52.49      -0.42    -0.19     16
  33       H     0.17    -0.03     8.06     -52.48      -0.42    -0.45     16
  34       H     0.17     0.90     7.73     -52.48      -0.41     0.50     16
  35       H     0.33     4.17     8.90      45.56       0.41     4.58     16
  36       H     0.33     4.10     8.90      45.56       0.41     4.51     16
  37       H     0.18     1.18     7.73     -52.49      -0.41     0.77     16
  38       H     0.15     0.60     8.06     -52.49      -0.42     0.17     16
  39       H     0.15     1.32     6.39     -52.48      -0.34     0.98     16
 Total:         -1.00   -47.89   346.30                 -7.51   -55.40