REAL300019664113.mol2 34                                                        
   1       O    -0.50    -6.36    14.03       5.33       0.07    -6.29     16
   2       C     0.56     4.87     7.51     -12.24      -0.09     4.78     16
   3       N    -0.66    -5.44     5.28     -10.64      -0.06    -5.50     16
   4       C     0.11     1.43     6.27     -83.69      -0.53     0.91     16
   5       C    -0.11    -1.77     8.64     -39.44      -0.34    -2.11     16
   6       C    -0.09    -1.65     9.69     -39.30      -0.38    -2.03     16
   7       C     0.04     0.95     5.88    -104.86      -0.62     0.33     16
   8       C     0.08     2.14     7.93    -156.42      -1.24     0.90     16
   9       N    -0.37   -10.89    12.15      32.14       0.39   -10.50     16
  10       N    -0.19    -5.91    13.45      60.35       0.81    -5.10     16
  11       N    -0.19    -5.92    13.45      60.35       0.81    -5.11     16
  12       N    -0.37   -10.95    12.15      32.14       0.39   -10.56     16
  13       C    -0.09    -1.56     9.69     -39.30      -0.38    -1.94     16
  14       C    -0.14    -1.84     9.95     -39.43      -0.39    -2.23     16
  15       C    -0.12    -0.61     5.88    -104.89      -0.62    -1.23     16
  16       C    -0.05    -0.12     9.53     -39.23      -0.37    -0.50     16
  17       C    -0.11    -0.49     9.74     -39.30      -0.38    -0.88     16
  18       C     0.34     2.45     9.79     -38.76      -0.38     2.07     16
  19       O    -0.66    -9.17    17.23     -57.73      -0.99   -10.16     16
  20       O    -0.67    -9.10    17.23     -57.73      -0.99   -10.09     16
  21       C    -0.11    -0.59     9.73     -39.31      -0.38    -0.97     16
  22       C    -0.02    -0.07     9.58     -39.23      -0.38    -0.45     16
  23       H     0.41     1.65     6.86     -40.82      -0.28     1.37     16
  24       H     0.13     1.92     6.42     -52.49      -0.34     1.58     16
  25       H     0.13     2.63     7.88     -52.48      -0.41     2.22     16
  26       H     0.13     2.45     7.88     -52.49      -0.41     2.03     16
  27       H     0.12     1.19     8.06     -52.49      -0.42     0.77     16
  28       H     0.17    -0.08     6.41     -52.49      -0.34    -0.42     16
  29       H     0.18     0.70     7.75     -52.49      -0.41     0.29     16
  30       H     0.34     3.70     8.90      45.56       0.41     4.11     16
  31       H     0.34     3.67     8.90      45.56       0.41     4.08     16
  32       H     0.18     0.88     7.76     -52.48      -0.41     0.48     16
  33       H     0.18     0.71     7.64     -52.49      -0.40     0.31     16
 Total:         -1.00   -41.20   309.22                 -3.99   -45.19