REAL300009850883.mol2 29                                                        
   1       O    -0.68   -22.02    17.23     -20.52      -0.35   -22.37     15
   2       C     0.52    15.68     8.01      34.63       0.28    15.96     15
   3       O    -0.67   -22.31    17.23     -20.50      -0.35   -22.67     15
   4       C    -0.09    -2.11     5.88    -104.94      -0.62    -2.72     15
   5       C    -0.08    -1.47     9.58     -39.20      -0.38    -1.85     15
   6       C    -0.10    -1.28     9.52     -39.25      -0.37    -1.65     15
   7       C    -0.14    -2.01     5.88    -104.86      -0.62    -2.63     15
   8       C     0.57     7.07     7.77     -12.24      -0.10     6.98     15
   9       O    -0.48    -7.35    13.01       5.34       0.07    -7.28     15
  10       N    -0.70    -5.08     5.52     -54.65      -0.30    -5.38     15
  11       C     0.10     0.66     6.43     -67.89      -0.44     0.23     15
  12       H     0.19     1.63     7.40     -51.92      -0.38     1.25     15
  13       C    -0.17    -0.50    10.45     -26.73      -0.28    -0.78     15
  14       C     0.29     1.76     9.71     -26.69      -0.26     1.50     15
  15       H     0.19     0.28     8.14     -51.93      -0.42    -0.15     15
  16       O    -0.72   -11.49    17.78     -57.73      -1.03   -12.52     15
  17       O    -0.69   -11.75    17.78     -57.73      -1.03   -12.77     15
  18       C    -0.05    -0.86     6.25     -39.16      -0.24    -1.11     15
  19       Br   -0.02    -0.41    30.36     -68.01      -2.06    -2.47     15
  20       C    -0.06    -1.33     9.32     -39.16      -0.37    -1.70     15
  21       H     0.14     2.57     7.63     -52.49      -0.40     2.17     15
  22       H     0.13     0.98     6.39     -52.49      -0.34     0.64     15
  23       H     0.41     1.57     6.85     -40.82      -0.28     1.29     15
  24       H     0.15    -0.07     8.14     -51.93      -0.42    -0.49     15
  25       H     0.17     0.58     8.14     -51.93      -0.42     0.15     15
  26       H     0.33     4.60     8.90      45.56       0.41     5.00     15
  27       H     0.33     4.82     8.90      45.56       0.41     5.22     15
  28       H     0.15     3.17     7.63     -52.49      -0.40     2.77     15
 Total:         -1.00   -44.68   285.86                 -6.39   -51.07