REAL300019996799.mol2 38                                                        
   1       O    -0.51   -10.24    16.00       5.35       0.09   -10.16     16
   2       C     0.56     8.85     7.74     -12.22      -0.09     8.76     16
   3       N    -0.70   -10.85     4.96     -56.94      -0.28   -11.13     16
   4       C     0.30     5.84     2.71     -70.23      -0.19     5.65     16
   5       C     0.04     1.10     7.16    -155.98      -1.12    -0.02     16
   6       N    -0.37   -10.35    12.45      32.58       0.41    -9.94     16
   7       N    -0.20    -5.99    13.46      60.35       0.81    -5.18     16
   8       N    -0.19    -6.04    13.46      60.35       0.81    -5.23     16
   9       N    -0.37   -10.91    12.45      32.58       0.41   -10.51     16
  10       C    -0.07    -1.23     4.94    -104.62      -0.52    -1.74     16
  11       C    -0.10    -1.53     9.67     -39.58      -0.38    -1.92     16
  12       C    -0.12    -1.55    10.05     -39.58      -0.40    -1.95     16
  13       C    -0.12    -1.50    10.05     -39.59      -0.40    -1.90     16
  14       C    -0.12    -1.53    10.05     -39.58      -0.40    -1.93     16
  15       C    -0.10    -1.48     9.05     -39.58      -0.36    -1.84     16
  16       C    -0.10    -1.16     5.88    -104.89      -0.62    -1.78     16
  17       C    -0.05    -0.41     9.53     -39.20      -0.37    -0.79     16
  18       C    -0.12    -1.03    10.08     -39.37      -0.40    -1.43     16
  19       C     0.27     3.09    10.27     -38.82      -0.40     2.69     16
  20       O    -0.57    -9.00    18.54     -56.57      -1.05   -10.05     16
  21       O    -0.44    -7.09    15.05     -56.57      -0.85    -7.94     16
  22       C     0.09     1.03     7.74      35.93       0.28     1.31     16
  23       C    -0.08    -0.87     6.30    -104.38      -0.66    -1.53     16
  24       C    -0.04    -0.42     9.58     -39.23      -0.38    -0.80     16
  25       H     0.40     4.79     4.89     -40.82      -0.20     4.60     16
  26       H     0.11     2.13     7.44     -51.93      -0.39     1.74     16
  27       H     0.13     1.80     8.04     -52.49      -0.42     1.38     16
  28       H     0.12     1.24     8.06     -52.48      -0.42     0.82     16
  29       H     0.12     1.10     8.06     -52.49      -0.42     0.68     16
  30       H     0.12     1.21     8.06     -52.49      -0.42     0.79     16
  31       H     0.12     1.68     6.92     -52.49      -0.36     1.32     16
  32       H     0.17     0.95     6.39     -52.49      -0.34     0.62     16
  33       H     0.17     1.04     8.06     -52.49      -0.42     0.61     16
  34       H     0.35     4.43     9.30      45.56       0.42     4.86     16
  35       H     0.08     0.73     8.14     -51.92      -0.42     0.31     16
  36       H     0.08     0.79     8.14     -51.93      -0.42     0.37     16
  37       H     0.18     1.79     7.64     -52.48      -0.40     1.39     16
 Total:         -1.00   -39.60   336.28                 -5.21   -44.80