REAL300009850670.mol2 34                                                        
   1       O    -0.72   -49.75    17.33      17.91       0.31   -49.44     16
   2       C     0.50    31.69     7.98      70.33       0.56    32.25     16
   3       O    -0.68   -45.74    14.64      24.13       0.35   -45.39     16
   4       C    -0.18    -8.64     5.91     -19.81      -0.12    -8.75     16
   5       C    -0.02    -0.60     9.47      22.76       0.22    -0.39     16
   6       C    -0.14    -3.84     6.25      22.46       0.14    -3.70     16
   7       Br    0.00     0.04    33.73     -20.37      -0.69    -0.65     16
   8       C     0.15     3.57    10.93      84.81       0.93     4.50     16
   9       N    -0.45   -13.30     9.90    -183.83      -1.82   -15.11     16
  10       C     0.12     4.84     4.69      42.31       0.20     5.04     16
  11       C     0.61    24.44     5.22      86.93       0.45    24.90     16
  12       O    -0.54   -26.03    15.55      15.65       0.24   -25.78     16
  13       N    -0.62   -16.79     2.98    -822.60      -2.45   -19.24     16
  14       C     0.14     2.50     6.32      86.22       0.55     3.05     16
  15       C    -0.18    -4.05     5.27      30.53       0.16    -3.89     16
  16       C     0.40     8.32     5.89      30.62       0.18     8.50     16
  17       O    -0.77   -32.51    16.88    -127.47      -2.15   -34.66     16
  18       O    -0.77   -32.85    16.88    -127.47      -2.15   -35.00     16
  19       C    -0.18    -4.22     5.29      30.67       0.16    -4.06     16
  20       C     0.14     2.92     6.42      86.36       0.55     3.48     16
  21       H     0.14     5.86     7.74      -2.91      -0.02     5.84     16
  22       H     0.22     2.97     8.06      -2.91      -0.02     2.94     16
  23       H     0.10     2.17     6.04      -2.38      -0.01     2.15     16
  24       H     0.17     0.83     8.14      -2.39      -0.02     0.81     16
  25       H     0.14     2.72     7.88      -2.39      -0.02     2.70     16
  26       H     0.06     2.12     8.14      -2.39      -0.02     2.10     16
  27       H     0.22     1.26     8.14      -2.39      -0.02     1.24     16
  28       H     0.32    12.69     8.90     -74.06      -0.66    12.03     16
  29       H     0.32    12.78     8.90     -74.06      -0.66    12.12     16
  30       H     0.14     2.90     7.88      -2.39      -0.02     2.88     16
  31       H     0.06     2.28     8.14      -2.39      -0.02     2.26     16
  32       H     0.16     1.08     8.14      -2.39      -0.02     1.06     16
  33       H     0.11     2.84     7.03      -2.38      -0.02     2.82     16
 Total:         -1.00  -107.49   310.69                 -5.90  -113.39