REAL300013458593.mol2 37                                                        
   1       C    -0.14    -1.69     9.20      37.16       0.34    -1.35     16
   2       C    -0.11    -1.65     2.87     -90.50      -0.26    -1.91     16
   3       C    -0.09    -1.76     4.37     -26.69      -0.12    -1.88     16
   4       C    -0.17    -3.92     2.75     -91.65      -0.25    -4.18     16
   5       C     0.50    15.58     7.39      36.00       0.27    15.84     16
   6       O    -0.70   -23.34    16.82     -20.23      -0.34   -23.68     16
   7       O    -0.69   -24.09    17.82     -20.23      -0.36   -24.45     16
   8       C     0.13     2.58     5.02      -3.71      -0.02     2.56     16
   9       N    -0.61   -10.00     2.97    -178.50      -0.53   -10.53     16
  10       C     0.71    11.17     8.11     -86.92      -0.70    10.47     16
  11       O    -0.57    -9.16    12.74       5.29       0.07    -9.09     16
  12       N    -0.67    -9.84     5.27     -12.63      -0.07    -9.90     16
  13       C     0.24     3.18     6.68     -81.29      -0.54     2.63     16
  14       C    -0.17    -1.71     8.62     -39.97      -0.34    -2.06     16
  15       C    -0.01    -0.06     9.83     -40.14      -0.39    -0.45     16
  16       C    -0.13    -0.95    10.27     -37.01      -0.38    -1.33     16
  17       C     0.19     2.34     7.36     -79.58      -0.59     1.75     16
  18       C     0.15     2.08     7.33     -79.31      -0.58     1.50     16
  19       N    -0.36    -6.20    18.92      35.14       0.66    -5.54     16
  20       N    -0.31    -4.47    19.05      34.97       0.67    -3.80     16
  21       C     0.13     1.92     5.73      -3.71      -0.02     1.90     16
  22       H     0.05     0.55     8.14     -51.93      -0.42     0.13     16
  23       H     0.06     0.71     8.14     -51.93      -0.42     0.29     16
  24       H     0.06     0.64     8.14     -51.93      -0.42     0.21     16
  25       H     0.07     1.14     8.14     -51.93      -0.42     0.72     16
  26       H     0.06     1.14     8.14     -51.93      -0.42     0.72     16
  27       H     0.07     1.50     8.06     -51.93      -0.42     1.08     16
  28       H     0.07     1.57     8.14     -51.93      -0.42     1.14     16
  29       H     0.07     1.39     5.65     -51.93      -0.29     1.09     16
  30       H     0.08     1.67     7.95     -51.93      -0.41     1.26     16
  31       H     0.42     6.49     6.20     -40.82      -0.25     6.24     16
  32       H     0.18     1.96     5.38     -52.48      -0.28     1.68     16
  33       H     0.15     0.44     8.06     -52.49      -0.42     0.02     16
  34       H     0.16     0.71     8.06     -52.49      -0.42     0.29     16
  35       H     0.07     0.90     8.14     -51.93      -0.42     0.48     16
  36       H     0.09     1.25     7.00     -51.93      -0.36     0.89     16
 Total:         -1.00   -37.92   302.46                 -4.77   -42.69