REAL300009850839.mol2 35                                                        
   1       O    -0.68   -21.69    17.23     -20.51      -0.35   -22.04     16
   2       C     0.52    15.41     8.01      34.64       0.28    15.69     16
   3       O    -0.67   -22.03    17.23     -20.51      -0.35   -22.39     16
   4       C    -0.10    -2.23     5.88    -104.94      -0.62    -2.84     16
   5       C    -0.07    -1.31     9.58     -39.20      -0.38    -1.69     16
   6       C    -0.10    -1.40     7.42     -39.25      -0.29    -1.69     16
   7       C    -0.12    -1.77     4.87    -104.86      -0.51    -2.29     16
   8       C     0.57     7.33     6.51     -12.24      -0.08     7.25     16
   9       O    -0.49    -7.85    15.34       5.34       0.08    -7.77     16
  10       N    -0.60    -5.03     2.97    -173.81      -0.52    -5.55     16
  11       C     0.08     0.41     5.55      -3.71      -0.02     0.39     16
  12       C    -0.12    -0.38     6.08     -26.61      -0.16    -0.54     16
  13       C    -0.17    -0.65     4.84     -26.69      -0.13    -0.78     16
  14       C     0.31     2.29     5.69     -26.62      -0.15     2.14     16
  15       O    -0.62   -10.46    17.78     -57.73      -1.03   -11.49     16
  16       O    -0.71   -11.57    17.65     -57.73      -1.02   -12.59     16
  17       C     0.07     0.56     6.42      -3.71      -0.02     0.54     16
  18       C    -0.06    -1.02     6.24     -39.16      -0.24    -1.26     16
  19       Br   -0.05    -0.71    31.79     -68.01      -2.16    -2.87     16
  20       C    -0.06    -1.14     9.32     -39.17      -0.37    -1.51     16
  21       H     0.14     2.53     7.63     -52.49      -0.40     2.13     16
  22       H     0.13     1.26     7.41     -52.49      -0.39     0.87     16
  23       H     0.12     0.81     4.76     -51.93      -0.25     0.56     16
  24       H     0.09     0.28     8.14     -51.93      -0.42    -0.15     16
  25       H     0.09     0.32     8.14     -51.93      -0.42    -0.10     16
  26       H     0.12     0.14     8.14     -51.93      -0.42    -0.28     16
  27       H     0.11     0.38     8.14     -51.93      -0.42    -0.04     16
  28       H     0.11     0.30     6.83     -51.93      -0.35    -0.05     16
  29       H     0.15     0.94     8.14     -51.93      -0.42     0.51     16
  30       H     0.34     5.29     9.20      45.56       0.42     5.71     16
  31       H     0.30     3.47     7.00      45.56       0.32     3.79     16
  32       H     0.11     0.71     8.14     -51.93      -0.42     0.28     16
  33       H     0.13     1.32     7.03     -51.93      -0.37     0.95     16
  34       H     0.15     3.06     7.63     -52.49      -0.40     2.66     16
 Total:         -1.00   -42.45   312.78                 -7.28   -49.73