REAL300013458642.mol2 37                                                        
   1       O    -0.70   -24.65    17.83     -20.23      -0.36   -25.01     16
   2       C     0.49    15.61     7.39      36.00       0.27    15.88     16
   3       O    -0.70   -24.06    16.88     -20.23      -0.34   -24.40     16
   4       C    -0.15    -3.46     2.43     -91.77      -0.22    -3.68     16
   5       C    -0.10    -1.93     5.11     -26.73      -0.14    -2.06     16
   6       C    -0.11    -1.71     5.77     -26.73      -0.15    -1.86     16
   7       C    -0.13    -1.78     5.60     -26.73      -0.15    -1.93     16
   8       C     0.16     2.43     2.78     -67.91      -0.19     2.24     16
   9       N    -0.72    -9.79     4.24     -58.65      -0.25   -10.04     16
  10       C     0.70     9.15     8.34     -86.92      -0.73     8.42     16
  11       O    -0.57    -8.30    13.39       5.30       0.07    -8.23     16
  12       N    -0.67    -7.24     5.34     -12.63      -0.07    -7.31     16
  13       C     0.23     2.34     6.51     -81.29      -0.53     1.82     16
  14       C    -0.13    -1.04     8.55     -39.97      -0.34    -1.38     16
  15       C    -0.02    -0.11     9.83     -40.14      -0.39    -0.51     16
  16       C    -0.11    -0.63    10.27     -37.00      -0.38    -1.01     16
  17       C     0.18     1.90     7.36     -79.59      -0.59     1.31     16
  18       C     0.15     1.76     7.34     -79.31      -0.58     1.18     16
  19       N    -0.36    -5.14    19.00      35.14       0.67    -4.48     16
  20       N    -0.31    -3.97    19.04      34.97       0.67    -3.30     16
  21       C    -0.10    -1.93     4.18     -26.71      -0.11    -2.04     16
  22       H     0.06     1.17     6.50     -51.93      -0.34     0.83     16
  23       H     0.06     1.14     8.14     -51.93      -0.42     0.72     16
  24       H     0.06     1.36     8.09     -51.93      -0.42     0.94     16
  25       H     0.06     0.75     8.14     -51.93      -0.42     0.33     16
  26       H     0.05     0.77     7.60     -51.93      -0.39     0.38     16
  27       H     0.07     0.99     8.14     -51.93      -0.42     0.57     16
  28       H     0.06     0.82     8.14     -51.93      -0.42     0.40     16
  29       H     0.09     1.32     7.57     -51.93      -0.39     0.93     16
  30       H     0.40     5.33     6.88     -40.82      -0.28     5.05     16
  31       H     0.41     3.94     8.84     -40.82      -0.36     3.58     16
  32       H     0.17     1.48     6.01     -52.48      -0.32     1.17     16
  33       H     0.15     0.22     8.06     -52.48      -0.42    -0.20     16
  34       H     0.16     0.47     8.06     -52.49      -0.42     0.04     16
  35       H     0.07     1.40     8.10     -51.93      -0.42     0.98     16
  36       H     0.08     1.67     8.10     -51.93      -0.42     1.25     16
 Total:         -1.00   -39.71   303.60                 -5.16   -44.87