REAL300009850835.mol2 38                                                        
   1       O    -0.66   -21.52    17.33     -20.22      -0.35   -21.87     16
   2       C     0.49    14.84     8.12      36.01       0.29    15.13     16
   3       O    -0.68   -23.33    18.00     -20.23      -0.36   -23.70     16
   4       C     0.00     0.09     5.87      -5.19      -0.03     0.06     16
   5       N    -0.44    -8.61     2.07    -120.61      -0.25    -8.86     16
   6       C     0.24     3.81     9.97     -16.81      -0.17     3.64     16
   7       C    -0.24    -3.37     6.18     -39.97      -0.25    -3.62     16
   8       Br   -0.03    -0.30    33.69     -68.01      -2.29    -2.59     16
   9       C     0.08     1.16     9.58     -38.69      -0.37     0.78     16
  10       C    -0.30    -5.00     5.19    -104.51      -0.54    -5.54     16
  11       C     0.61     9.63     7.05     -12.68      -0.09     9.54     16
  12       O    -0.53    -8.76    16.45       5.23       0.09    -8.67     16
  13       N    -0.59    -8.11     2.97    -173.93      -0.52    -8.62     16
  14       C     0.09     0.84     6.41      -3.71      -0.02     0.82     16
  15       C    -0.11    -0.78     6.08     -26.61      -0.16    -0.94     16
  16       C    -0.17    -1.74     5.10     -26.69      -0.14    -1.88     16
  17       C     0.36     5.42     6.08     -26.61      -0.16     5.26     16
  18       O    -0.59   -15.76    17.05     -57.73      -0.98   -16.75     16
  19       O    -0.80   -18.77    16.89     -57.73      -0.97   -19.74     16
  20       C     0.07     1.13     3.57      -3.56      -0.01     1.12     16
  21       C     0.53    10.69     5.90     -14.92      -0.09    10.60     16
  22       O    -0.52   -11.71    12.51       5.02       0.06   -11.65     16
  23       H     0.11     2.41     7.39     -51.93      -0.38     2.03     16
  24       H     0.10     1.76     8.00     -51.93      -0.42     1.35     16
  25       H     0.17     2.29     8.02     -52.49      -0.42     1.87     16
  26       H     0.15     1.71     8.06     -52.49      -0.42     1.29     16
  27       H     0.08     0.69     8.14     -51.93      -0.42     0.27     16
  28       H     0.11     1.00     7.03     -51.93      -0.37     0.64     16
  29       H     0.08     0.50     8.14     -51.93      -0.42     0.08     16
  30       H     0.11     0.45     8.14     -51.93      -0.42     0.02     16
  31       H     0.11     1.23     7.88     -51.93      -0.41     0.82     16
  32       H     0.10     1.12     8.14     -51.93      -0.42     0.70     16
  33       H     0.14     1.70     8.14     -51.93      -0.42     1.28     16
  34       H     0.34     8.46     8.90      45.56       0.41     8.87     16
  35       H     0.31     6.99     8.90      45.56       0.41     7.40     16
  36       H     0.15     3.06     3.93     -51.93      -0.20     2.86     16
  37       H     0.11     2.01     7.85     -51.93      -0.41     1.60     16
 Total:         -1.00   -44.78   338.71                 -6.55   -51.32