REAL300018534623.mol2 40                                                        
   1       C    -0.07    -1.52     9.83      36.01       0.35    -1.17     16
   2       C    -0.17    -3.87     6.24    -104.04      -0.65    -4.52     16
   3       C    -0.04    -1.03     7.18     -36.57      -0.26    -1.29     16
   4       C     0.56    18.42     8.02      33.90       0.27    18.70     16
   5       O    -0.66   -22.38    15.70     -20.71      -0.33   -22.70     16
   6       O    -0.67   -24.21    18.01     -23.77      -0.43   -24.64     16
   7       O    -0.15    -3.62    10.04      -0.28       0.00    -3.62     16
   8       C    -0.05    -0.92     5.87     -35.38      -0.21    -1.13     16
   9       C     0.15     1.65     5.49      -4.98      -0.03     1.62     16
  10       N    -0.53    -5.14     4.74    -245.82      -1.17    -6.31     16
  11       C     0.01     0.13     9.03      60.07       0.54     0.68     16
  12       C     0.09     0.44     5.12      -4.98      -0.03     0.42     16
  13       C    -0.02    -0.09     4.89    -104.62      -0.51    -0.60     16
  14       C    -0.08    -0.17     9.70     -39.58      -0.38    -0.55     16
  15       C    -0.06    -0.10    10.05     -39.58      -0.40    -0.49     16
  16       C    -0.11    -0.55     8.62     -39.58      -0.34    -0.89     16
  17       C     0.38     3.22     4.82     -39.59      -0.19     3.03     16
  18       F    -0.13    -2.56    16.65       2.25       0.04    -2.52     16
  19       F    -0.18    -2.60    15.31       2.25       0.03    -2.57     16
  20       F    -0.16    -2.58    15.31       2.25       0.03    -2.55     16
  21       F    -0.17    -2.62    15.32       2.25       0.03    -2.59     16
  22       F    -0.17    -2.66    15.30       2.25       0.03    -2.63     16
  23       C    -0.11    -0.77     6.47     -39.59      -0.26    -1.02     16
  24       C    -0.19    -3.35    10.71     -39.92      -0.43    -3.77     16
  25       H     0.06     1.09     8.14     -51.93      -0.42     0.67     16
  26       H     0.09     2.01     6.50     -51.93      -0.34     1.68     16
  27       H     0.05     0.78     8.14     -51.93      -0.42     0.36     16
  28       H     0.05     0.60     8.12     -51.93      -0.42     0.18     16
  29       H     0.10     0.80     7.93     -51.93      -0.41     0.39     16
  30       H     0.04     0.42     8.14     -51.93      -0.42     0.00     16
  31       H     0.07     0.72     5.89     -51.93      -0.31     0.41     16
  32       H     0.08     1.40     6.80     -51.93      -0.35     1.05     16
  33       H     0.06     0.28     8.06     -51.93      -0.42    -0.14     16
  34       H     0.11     0.25     7.88     -51.93      -0.41    -0.16     16
  35       H     0.17    -0.04     8.06     -52.49      -0.42    -0.46     16
  36       H     0.18    -0.35     8.06     -52.49      -0.42    -0.77     16
  37       H     0.18     0.76     7.40     -52.49      -0.39     0.37     16
  38       H     0.18     1.34     7.33     -52.48      -0.38     0.96     16
  39       H     0.14     1.95     8.06     -52.49      -0.42     1.52     16
 Total:         -1.00   -44.83   352.93                 -4.91   -49.74