REAL300018050738.mol2 33                                                        
   1       O    -0.68   -23.53    17.24     -20.53      -0.35   -23.89     16
   2       C     0.52    16.56     8.01      34.53       0.28    16.84     16
   3       O    -0.68   -23.36    17.24     -20.54      -0.35   -23.71     16
   4       C    -0.09    -2.11     5.87    -105.02      -0.62    -2.72     16
   5       C    -0.10    -2.07     9.30     -39.11      -0.36    -2.43     16
   6       C    -0.07    -1.18     6.19     -39.64      -0.25    -1.42     16
   7       I    -0.07    -0.93    40.25     -73.02      -2.94    -3.87     16
   8       C    -0.17    -2.48     9.01     -39.27      -0.35    -2.83     16
   9       C     0.19     2.91     6.65     -83.84      -0.56     2.35     16
  10       N    -0.75    -7.58     5.73     -59.84      -0.34    -7.93     16
  11       C     0.17     1.06     5.03      -5.19      -0.03     1.03     16
  12       C    -0.09    -0.43     5.26    -104.52      -0.55    -0.98     16
  13       C    -0.06    -0.24     9.68     -39.63      -0.38    -0.62     16
  14       C    -0.11    -0.69     9.75     -39.25      -0.38    -1.07     16
  15       C     0.33     2.93     9.80     -38.72      -0.38     2.56     16
  16       O    -0.68   -10.57    17.25     -57.73      -1.00   -11.57     16
  17       O    -0.68   -10.57    17.25     -57.73      -1.00   -11.56     16
  18       C    -0.11    -0.69     9.75     -39.25      -0.38    -1.07     16
  19       C    -0.06    -0.24     9.68     -39.63      -0.38    -0.63     16
  20       C    -0.13    -2.62     9.44     -38.92      -0.37    -2.98     16
  21       H     0.13     3.02     7.64     -52.49      -0.40     2.62     16
  22       H     0.12     1.38     6.71     -52.49      -0.35     1.02     16
  23       H     0.40     3.78     8.47     -40.82      -0.35     3.43     16
  24       H     0.08     0.44     7.88     -51.92      -0.41     0.03     16
  25       H     0.08     0.44     7.89     -51.93      -0.41     0.03     16
  26       H     0.17     0.42     8.06     -52.49      -0.42    -0.01     16
  27       H     0.17     1.10     7.77     -52.48      -0.41     0.69     16
  28       H     0.33     4.29     8.90      45.56       0.41     4.70     16
  29       H     0.33     4.29     8.90      45.56       0.41     4.70     16
  30       H     0.17     1.10     7.77     -52.49      -0.41     0.70     16
  31       H     0.17     0.42     8.06     -52.48      -0.42     0.00     16
  32       H     0.13     2.69     7.65     -52.49      -0.40     2.29     16
 Total:         -1.00   -42.45   324.08                 -8.98   -51.43