REAL300005947782.mol2 39                                                        
   1       C    -0.07    -1.30     9.91      36.00       0.36    -0.94     16
   2       C     0.10     2.26     7.24     -82.14      -0.59     1.67     16
   3       N    -0.30    -5.86    12.63      33.81       0.43    -5.43     16
   4       N    -0.46    -7.97     7.34      33.54       0.25    -7.72     16
   5       C     0.05     1.04     5.13     -82.12      -0.42     0.62     16
   6       C     0.62    11.44     6.32     -12.45      -0.08    11.36     16
   7       O    -0.53   -10.16    16.40       5.30       0.09   -10.07     16
   8       N    -0.59    -8.62     2.86    -184.18      -0.53    -9.15     16
   9       C     0.08     1.15    10.27      59.85       0.61     1.77     16
  10       C     0.16     1.56     5.59      -5.19      -0.03     1.53     16
  11       C    -0.05    -0.35     5.46    -104.62      -0.57    -0.92     16
  12       C    -0.08    -0.46     9.70     -39.59      -0.38    -0.84     16
  13       C    -0.06    -0.23    10.05     -39.58      -0.40    -0.63     16
  14       C    -0.11    -0.67     8.62     -39.58      -0.34    -1.01     16
  15       C     0.37     3.49     4.82     -39.58      -0.19     3.29     16
  16       F    -0.14    -2.64    16.69       2.25       0.04    -2.61     16
  17       F    -0.18    -2.72    15.32       2.25       0.03    -2.68     16
  18       F    -0.16    -2.57    15.31       2.25       0.03    -2.54     16
  19       F    -0.17    -2.69    15.30       2.25       0.03    -2.66     16
  20       F    -0.17    -2.60    15.33       2.25       0.03    -2.57     16
  21       C    -0.10    -0.82     8.28     -39.58      -0.33    -1.15     16
  22       C    -0.23    -5.51     5.85    -104.75      -0.61    -6.12     16
  23       C     0.55    16.38     8.06      34.48       0.28    16.65     16
  24       O    -0.68   -21.34    16.53     -20.54      -0.34   -21.68     16
  25       O    -0.68   -21.91    15.77     -20.55      -0.32   -22.23     16
  26       H     0.07     1.27     8.14     -51.93      -0.42     0.85     16
  27       H     0.06     0.94     8.14     -51.93      -0.42     0.52     16
  28       H     0.10     2.20     6.51     -51.93      -0.34     1.86     16
  29       H     0.43     5.64     8.96    -182.73      -1.64     4.01     16
  30       H     0.08     1.38     7.98     -51.93      -0.41     0.96     16
  31       H     0.06     0.67     8.11     -51.93      -0.42     0.25     16
  32       H     0.07     1.16     6.50     -51.93      -0.34     0.82     16
  33       H     0.11     0.84     8.02     -51.93      -0.42     0.43     16
  34       H     0.12     1.24     7.30     -51.93      -0.38     0.87     16
  35       H     0.17     0.95     7.80     -52.48      -0.41     0.54     16
  36       H     0.18     0.02     8.06     -52.49      -0.42    -0.40     16
  37       H     0.18     0.92     7.40     -52.49      -0.39     0.53     16
  38       H     0.18     1.41     7.40     -52.49      -0.39     1.02     16
 Total:         -1.00   -42.45   355.09                 -4.00   -46.45