REAL300019914307.mol2 37                                                        
   1       O    -0.52    -8.68    16.59       5.36       0.09    -8.60     16
   2       C     0.57     7.10     7.82     -12.21      -0.10     7.01     16
   3       C    -0.11    -0.95     5.88    -104.89      -0.62    -1.56     16
   4       C    -0.09    -0.49     8.60     -39.24      -0.34    -0.83     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   -10.17    17.23     -57.73      -0.99   -11.17     16
   9       C    -0.12    -0.85     9.73     -39.31      -0.38    -1.24     16
  10       C    -0.02    -0.13     9.58     -39.23      -0.38    -0.51     16
  11       N    -0.61    -7.17     3.33    -176.14      -0.59    -7.75     16
  12       C     0.08     0.56     4.87      -3.07      -0.01     0.55     16
  13       C    -0.13    -1.08     6.42     -24.90      -0.16    -1.24     16
  14       C    -0.09    -1.25     3.06     -88.48      -0.27    -1.52     16
  15       C     0.01     0.19     5.36     -27.89      -0.15     0.04     16
  16       C     0.05     1.25     7.18    -156.72      -1.13     0.12     16
  17       N    -0.39   -11.25    12.43      32.44       0.40   -10.84     16
  18       N    -0.20    -6.18    13.47      60.35       0.81    -5.37     16
  19       N    -0.20    -6.13    13.47      60.35       0.81    -5.32     16
  20       N    -0.39   -11.02    12.43      32.44       0.40   -10.61     16
  21       C     0.12     1.86     5.97      -2.53      -0.02     1.85     16
  22       H     0.20     0.73     2.72     -58.44      -0.16     0.57     16
  23       H     0.18     1.02     7.75     -52.49      -0.41     0.62     16
  24       H     0.33     4.17     8.90      45.56       0.41     4.58     16
  25       H     0.33     4.12     8.90      45.56       0.41     4.53     16
  26       H     0.18     1.23     7.75     -52.48      -0.41     0.82     16
  27       H     0.18     1.18     7.66     -52.49      -0.40     0.77     16
  28       H     0.08     0.40     6.74     -51.93      -0.35     0.05     16
  29       H     0.08     0.36     6.73     -51.93      -0.35     0.01     16
  30       H     0.08     0.63     8.04     -51.93      -0.42     0.21     16
  31       H     0.09     0.57     8.14     -51.93      -0.42     0.15     16
  32       H     0.09     1.37     8.14     -51.93      -0.42     0.95     16
  33       H     0.07     1.15     8.10     -51.93      -0.42     0.73     16
  34       H     0.07     1.21     8.14     -51.93      -0.42     0.79     16
  35       H     0.08     1.72     7.99     -51.93      -0.41     1.30     16
  36       H     0.08     1.31     8.00     -51.93      -0.42     0.90     16
 Total:         -1.00   -41.15   313.88                 -3.83   -44.98