REAL300013458610.mol2 37                                                        
   1       O    -0.69   -23.29    15.20     -20.22      -0.31   -23.60     16
   2       C     0.49    15.45     7.61      36.01       0.27    15.73     16
   3       O    -0.70   -25.21    18.00     -20.24      -0.36   -25.57     16
   4       C    -0.17    -4.07     5.20     -27.88      -0.15    -4.22     16
   5       C    -0.05    -0.86     1.64     -90.62      -0.15    -1.01     16
   6       C     0.14     2.72     4.87      -4.04      -0.02     2.70     16
   7       N    -0.72   -10.73     5.36     -65.22      -0.35   -11.08     16
   8       C     0.70    10.53     8.33     -86.92      -0.72     9.80     16
   9       O    -0.56   -10.00    13.51       5.29       0.07    -9.93     16
  10       N    -0.67    -7.92     5.36     -12.63      -0.07    -7.99     16
  11       C     0.24     2.80     6.63     -81.29      -0.54     2.26     16
  12       C    -0.16    -1.57     8.57     -39.97      -0.34    -1.91     16
  13       C     0.00    -0.01     9.83     -40.14      -0.39    -0.41     16
  14       C    -0.13    -0.88    10.27     -37.01      -0.38    -1.26     16
  15       C     0.19     2.12     7.36     -79.59      -0.59     1.54     16
  16       C     0.15     1.80     7.33     -79.31      -0.58     1.22     16
  17       N    -0.38    -5.55    18.96      35.14       0.67    -4.88     16
  18       N    -0.30    -3.83    19.04      34.97       0.67    -3.17     16
  19       C    -0.15    -2.08     4.65     -90.62      -0.42    -2.50     16
  20       C    -0.19    -2.24     9.71     -26.73      -0.26    -2.50     16
  21       C    -0.18    -2.33     9.73     -26.73      -0.26    -2.59     16
  22       H     0.06     1.44     7.49     -51.93      -0.39     1.05     16
  23       H     0.06     1.36     8.14     -51.93      -0.42     0.93     16
  24       H     0.08     1.65     7.63     -51.93      -0.40     1.25     16
  25       H     0.06     1.08     8.14     -51.93      -0.42     0.66     16
  26       H     0.10     2.44     6.18     -51.92      -0.32     2.11     16
  27       H     0.40     4.86     7.81     -40.82      -0.32     4.55     16
  28       H     0.41     4.10     8.78     -40.82      -0.36     3.74     16
  29       H     0.17     1.92     5.62     -52.49      -0.30     1.63     16
  30       H     0.15     0.44     8.06     -52.49      -0.42     0.02     16
  31       H     0.16     0.61     8.06     -52.48      -0.42     0.19     16
  32       H     0.10     1.35     8.14     -51.93      -0.42     0.93     16
  33       H     0.09     1.07     8.08     -51.93      -0.42     0.65     16
  34       H     0.09     0.88     8.14     -51.93      -0.42     0.45     16
  35       H     0.09     1.03     8.14     -51.93      -0.42     0.61     16
  36       H     0.09     1.36     7.93     -51.93      -0.41     0.94     16
 Total:         -1.00   -39.60   313.52                 -5.36   -44.95