REAL300009850746.mol2 34                                                        
   1       O    -0.67   -24.33    18.00     -22.63      -0.41   -24.74     16
   2       C     0.54    18.10     4.97      34.61       0.17    18.27     16
   3       O    -0.67   -24.32    17.79     -24.85      -0.44   -24.77     16
   4       C    -0.09    -2.27     5.76    -104.53      -0.60    -2.87     16
   5       C    -0.04    -0.87     9.70     -38.83      -0.38    -1.24     16
   6       C    -0.12    -2.04     6.25     -39.29      -0.25    -2.28     16
   7       Br   -0.04    -0.56    33.73     -68.01      -2.29    -2.85     16
   8       C     0.10     1.51    10.93     -17.46      -0.19     1.32     16
   9       N    -0.45    -7.66     6.90      -9.45      -0.07    -7.72     16
  10       C     0.10     2.13     6.75     -82.60      -0.56     1.58     16
  11       C     0.58    13.24     7.82     -12.11      -0.09    13.14     16
  12       O    -0.47   -13.36    14.48     -11.40      -0.16   -13.52     16
  13       N    -0.62    -9.76     3.33    -171.59      -0.57   -10.34     16
  14       C     0.12     1.23     5.40      -3.07      -0.02     1.22     16
  15       C    -0.11    -0.45     6.42     -24.90      -0.16    -0.61     16
  16       C    -0.17    -1.24     2.94     -88.59      -0.26    -1.50     16
  17       C     0.39     2.10     8.98      37.16       0.33     2.44     16
  18       O    -0.73   -12.96    17.78     -57.73      -1.03   -13.99     16
  19       O    -0.70   -12.37    16.74     -57.73      -0.97   -13.34     16
  20       C     0.11     1.49     6.37      -2.65      -0.02     1.47     16
  21       H     0.15     2.96     8.06     -52.49      -0.42     2.53     16
  22       H     0.16     1.72     8.06     -52.49      -0.42     1.30     16
  23       H     0.09     0.88     7.41     -51.92      -0.38     0.50     16
  24       H     0.08     0.86     7.58     -51.93      -0.39     0.47     16
  25       H     0.09     0.13     8.04     -51.93      -0.42    -0.29     16
  26       H     0.10     0.17     8.14     -51.93      -0.42    -0.25     16
  27       H     0.14     1.30     7.65     -51.93      -0.40     0.91     16
  28       H     0.14     0.34     7.97     -51.93      -0.41    -0.07     16
  29       H     0.14     0.05     8.14     -51.93      -0.42    -0.37     16
  30       H     0.33     5.28     8.90      45.56       0.41     5.68     16
  31       H     0.33     5.36     8.90      45.56       0.41     5.77     16
  32       H     0.10     1.70     8.04     -51.93      -0.42     1.28     16
  33       H     0.08     0.85     7.90     -51.93      -0.41     0.44     16
 Total:         -1.00   -50.77   315.82                 -6.91   -57.68