REAL300019841813.mol2 37                                                        
   1       O    -0.51    -8.01    14.00       5.34       0.07    -7.93     16
   2       C     0.58     7.88     7.55     -12.23      -0.09     7.78     16
   3       N    -0.65    -6.54     5.32     -10.63      -0.06    -6.60     16
   4       C     0.20     1.80     6.28     -83.68      -0.53     1.28     16
   5       C    -0.14    -0.76     9.94     -39.30      -0.39    -1.15     16
   6       C    -0.06    -0.27     9.72     -39.63      -0.39    -0.65     16
   7       C    -0.11    -0.82     5.79    -104.31      -0.60    -1.42     16
   8       C    -0.10    -0.63     5.95     -28.21      -0.17    -0.79     16
   9       C     0.05     0.42     7.08      36.95       0.26     0.68     16
  10       O    -0.43    -6.59    14.34     -57.22      -0.82    -7.41     16
  11       O    -0.60   -10.89    17.84     -57.22      -1.02   -11.91     16
  12       C     0.26     3.05     9.44     -38.92      -0.37     2.68     16
  13       C    -0.12    -1.45     8.47     -39.16      -0.33    -1.78     16
  14       C     0.03     0.50     6.75     -82.97      -0.56    -0.06     16
  15       C    -0.10    -1.45     9.61     -39.11      -0.38    -1.83     16
  16       C    -0.08    -1.32     9.83     -38.95      -0.38    -1.71     16
  17       C     0.04     0.83     5.90    -104.71      -0.62     0.21     16
  18       C     0.06     1.66     7.96    -155.67      -1.24     0.42     16
  19       N    -0.36    -9.80    12.20      32.21       0.39    -9.41     16
  20       N    -0.18    -5.32    13.44      60.35       0.81    -4.50     16
  21       N    -0.18    -5.36    13.44      60.35       0.81    -4.55     16
  22       N    -0.36    -9.94    12.25      32.21       0.39    -9.55     16
  23       C     0.11     1.95    10.87     -17.18      -0.19     1.76     16
  24       N    -0.46    -6.84     9.52      -9.51      -0.09    -6.93     16
  25       H     0.43     3.45     8.14     -40.82      -0.33     3.12     16
  26       H     0.16     0.41     8.06     -52.49      -0.42    -0.02     16
  27       H     0.16     0.14     8.06     -52.49      -0.42    -0.29     16
  28       H     0.09     0.53     8.14     -51.92      -0.42     0.11     16
  29       H     0.09     0.25     8.12     -51.93      -0.42    -0.17     16
  30       H     0.11     0.73     8.14     -51.93      -0.42     0.31     16
  31       H     0.06     0.50     8.14     -51.93      -0.42     0.08     16
  32       H     0.34     5.18     9.26      45.56       0.42     5.60     16
  33       H     0.18     2.61     6.39     -52.49      -0.34     2.27     16
  34       H     0.15     2.00     7.63     -52.49      -0.40     1.60     16
  35       H     0.15     2.60     7.96     -52.49      -0.42     2.18     16
  36       H     0.17     2.89     7.89     -52.49      -0.41     2.48     16
 Total:         -1.00   -36.61   329.43                 -4.52   -41.13