REAL300019886734.mol2 40                                                        
   1       O    -0.51    -9.49    16.24       5.35       0.09    -9.41     16
   2       C     0.55     7.36     7.39     -12.22      -0.09     7.27     16
   3       C    -0.11    -0.97     5.29    -104.89      -0.56    -1.52     16
   4       C    -0.05    -0.30     7.34     -39.23      -0.29    -0.59     16
   5       C    -0.11    -0.75     9.74     -39.30      -0.38    -1.13     16
   6       C     0.34     3.14     9.79     -38.76      -0.38     2.76     16
   7       O    -0.67   -10.33    17.23     -57.73      -0.99   -11.32     16
   8       O    -0.67   -10.16    17.23     -57.73      -0.99   -11.15     16
   9       C    -0.11    -0.86     9.74     -39.30      -0.38    -1.24     16
  10       C    -0.02    -0.17     9.60     -39.23      -0.38    -0.55     16
  11       N    -0.60    -7.31     2.97    -173.79      -0.52    -7.83     16
  12       C     0.09     0.65     4.78      -3.71      -0.02     0.63     16
  13       C    -0.13    -1.08     6.08     -26.61      -0.16    -1.24     16
  14       C    -0.12    -1.21     5.17     -26.69      -0.14    -1.35     16
  15       C    -0.09    -1.41     2.33     -90.50      -0.21    -1.62     16
  16       C     0.01     0.11     5.32     -27.88      -0.15    -0.04     16
  17       C     0.05     1.35     6.83    -156.72      -1.07     0.28     16
  18       N    -0.39   -11.31    11.95      32.44       0.39   -10.92     16
  19       N    -0.20    -6.27    13.47      60.35       0.81    -5.45     16
  20       N    -0.20    -6.37    13.47      60.35       0.81    -5.55     16
  21       N    -0.39   -11.64    12.43      32.44       0.40   -11.24     16
  22       C     0.12     1.95     5.43      -3.71      -0.02     1.93     16
  23       H     0.18     0.61     6.05     -52.49      -0.32     0.29     16
  24       H     0.18     1.01     7.75     -52.49      -0.41     0.61     16
  25       H     0.33     4.19     8.90      45.56       0.41     4.60     16
  26       H     0.33     4.12     8.90      45.56       0.41     4.52     16
  27       H     0.18     1.29     7.75     -52.49      -0.41     0.89     16
  28       H     0.18     1.30     8.00     -52.49      -0.42     0.88     16
  29       H     0.09     0.46     4.46     -51.93      -0.23     0.23     16
  30       H     0.08     0.42     8.05     -51.93      -0.42     0.00     16
  31       H     0.07     0.63     8.14     -51.93      -0.42     0.21     16
  32       H     0.08     0.44     8.14     -51.93      -0.42     0.02     16
  33       H     0.07     0.61     8.14     -51.93      -0.42     0.19     16
  34       H     0.07     0.70     8.14     -51.93      -0.42     0.28     16
  35       H     0.07     1.36     8.14     -51.93      -0.42     0.94     16
  36       H     0.07     1.18     8.14     -51.93      -0.42     0.76     16
  37       H     0.07     1.27     8.14     -51.93      -0.42     0.84     16
  38       H     0.11     2.35     6.05     -51.93      -0.31     2.03     16
  39       H     0.07     1.09     8.14     -51.93      -0.42     0.67     16
 Total:         -1.00   -42.03   330.86                 -4.32   -46.35