REAL300009356168.mol2 35                                                        
   1       O    -0.68   -21.45    17.33     -20.23      -0.35   -21.80     16
   2       C     0.49    14.50     8.12      36.00       0.29    14.79     16
   3       O    -0.68   -22.46    18.00     -20.23      -0.36   -22.82     16
   4       C     0.01     0.14     5.88      -5.19      -0.03     0.11     16
   5       N    -0.44    -8.51     2.07    -120.61      -0.25    -8.76     16
   6       C     0.24     3.52     9.97     -16.81      -0.17     3.35     16
   7       C    -0.24    -3.00     6.18     -39.96      -0.25    -3.24     16
   8       Br   -0.03    -0.28    33.69     -68.01      -2.29    -2.57     16
   9       C     0.05     0.66     9.65     -38.69      -0.37     0.29     16
  10       C    -0.27    -4.34     4.85    -104.51      -0.51    -4.84     16
  11       C     0.63     9.80     6.84     -12.67      -0.09     9.71     16
  12       O    -0.51    -9.42    17.34       5.24       0.09    -9.33     16
  13       N    -0.62    -7.13     3.33    -171.91      -0.57    -7.70     16
  14       C     0.10     0.88     6.47      -3.07      -0.02     0.86     16
  15       C    -0.17    -1.18     6.17     -24.90      -0.15    -1.34     16
  16       C     0.38     2.99     6.78     -24.59      -0.17     2.82     16
  17       O    -0.71   -12.03    17.76     -57.73      -1.03   -13.05     16
  18       O    -0.71   -11.74    16.58     -57.73      -0.96   -12.70     16
  19       C     0.07     0.66     6.91      -2.53      -0.02     0.65     16
  20       C     0.54    11.16     7.43     -14.92      -0.11    11.05     16
  21       O    -0.52   -12.91    16.10       5.01       0.08   -12.83     16
  22       H     0.10     1.74     8.00     -51.93      -0.42     1.33     16
  23       H     0.11     2.43     7.38     -51.93      -0.38     2.04     16
  24       H     0.17     2.11     8.02     -52.49      -0.42     1.68     16
  25       H     0.14     1.22     8.06     -52.48      -0.42     0.79     16
  26       H     0.10     0.54     8.14     -51.93      -0.42     0.12     16
  27       H     0.11     1.23     8.14     -51.92      -0.42     0.81     16
  28       H     0.13     0.52     8.14     -51.93      -0.42     0.10     16
  29       H     0.14     1.32     7.57     -51.93      -0.39     0.93     16
  30       H     0.18     0.58     8.14     -51.93      -0.42     0.15     16
  31       H     0.33     4.87     8.90      45.56       0.41     5.27     16
  32       H     0.33     4.83     8.90      45.56       0.41     5.24     16
  33       H     0.12     1.35     8.14     -51.93      -0.42     0.93     16
  34       H     0.13     1.21     7.99     -51.93      -0.41     0.79     16
 Total:         -1.00   -46.19   332.96                 -5.96   -52.15