REAL300019772825.mol2 35                                                        
   1       O    -0.49    -6.90    12.76       5.29       0.07    -6.83     16
   2       C     0.56     5.89     7.61     -12.40      -0.09     5.80     16
   3       N    -0.65    -6.74     5.28     -10.73      -0.06    -6.80     16
   4       C     0.08     1.23     6.30     -83.65      -0.53     0.70     16
   5       C    -0.11    -1.66     9.96     -39.41      -0.39    -2.06     16
   6       C    -0.14    -2.82     9.39     -39.43      -0.37    -3.19     16
   7       C     0.20     4.55     6.69     -83.54      -0.56     3.99     16
   8       N    -0.46   -12.17     3.80     -13.97      -0.05   -12.22     16
   9       N    -0.10    -2.69    12.85      60.35       0.78    -1.92     16
  10       N    -0.04    -1.24    13.66      60.35       0.82    -0.41     16
  11       N    -0.51   -15.59    12.93      27.78       0.36   -15.23     16
  12       C     0.56    16.69     9.05     -86.42      -0.78    15.91     16
  13       O    -0.61   -18.79    15.32       5.09       0.08   -18.72     16
  14       C    -0.13    -2.53     9.66     -39.43      -0.38    -2.91     16
  15       C    -0.09    -1.46     8.69     -39.41      -0.34    -1.80     16
  16       C    -0.13    -0.89     5.87    -104.96      -0.62    -1.50     16
  17       C    -0.05    -0.31     9.24     -38.85      -0.36    -0.67     16
  18       C     0.29     1.94     9.79     -38.73      -0.38     1.56     16
  19       O    -0.64    -8.22    17.23     -57.73      -0.99    -9.22     16
  20       O    -0.66    -8.11    17.23     -57.73      -0.99    -9.10     16
  21       C    -0.05    -0.19     9.74     -39.19      -0.38    -0.57     16
  22       C    -0.12    -0.28    10.00     -39.61      -0.40    -0.68     16
  23       C     0.18     1.02     7.29     -38.81      -0.28     0.73     16
  24       F    -0.09    -0.72    15.54       2.25       0.03    -0.68     16
  25       H     0.41     2.86     6.86     -40.82      -0.28     2.58     16
  26       H     0.13     1.55     8.06     -52.48      -0.42     1.13     16
  27       H     0.16     3.63     5.52     -52.49      -0.29     3.35     16
  28       H     0.14     2.58     7.70     -52.49      -0.40     2.17     16
  29       H     0.14     2.13     6.22     -52.48      -0.33     1.81     16
  30       H     0.18     0.94     6.11     -52.49      -0.32     0.61     16
  31       H     0.34     3.42     8.90      45.56       0.41     3.83     16
  32       H     0.34     3.30     8.90      45.56       0.41     3.71     16
  33       H     0.19     0.45     7.76     -52.49      -0.41     0.04     16
  34       H     0.19    -0.17     8.06     -52.49      -0.42    -0.59     16
 Total:         -1.00   -39.31   319.98                 -3.06   -42.37