REAL300018534632.mol2 44                                                        
   1       C    -0.06     1.24     8.41      60.07       0.51     1.74     16
   2       N    -0.39     8.11     0.47    -244.37      -0.12     8.00     16
   3       H     0.43    -9.51     7.53     -39.29      -0.30    -9.80     16
   4       C     0.04    -0.94     4.81      -4.98      -0.02    -0.96     16
   5       C    -0.11     2.11     4.72    -104.62      -0.49     1.62     16
   6       C    -0.07     1.35     9.70     -39.59      -0.38     0.97     16
   7       C    -0.06     0.98    10.05     -39.59      -0.40     0.58     16
   8       C    -0.07     0.92     8.62     -39.58      -0.34     0.58     16
   9       C     0.32    -3.16     4.82     -39.59      -0.19    -3.35     16
  10       F    -0.05    -0.19    16.66       2.25       0.04    -0.16     16
  11       F    -0.12     0.05    15.32       2.25       0.03     0.09     16
  12       F    -0.12     0.30    15.30       2.25       0.03     0.33     16
  13       F    -0.18     0.13    15.31       2.25       0.03     0.17     16
  14       F    -0.22     0.13    15.32       2.25       0.03     0.17     16
  15       C    -0.09     1.26     6.41     -39.58      -0.25     1.01     16
  16       C     0.00     0.05     4.03      -3.82      -0.02     0.04     16
  17       C    -0.12     1.15     2.75     -88.96      -0.24     0.91     16
  18       H     0.09    -1.04     6.22     -51.93      -0.32    -1.36     16
  19       C    -0.13     0.90     5.55     -25.61      -0.14     0.75     16
  20       C    -0.11    -0.37     6.17     -25.61      -0.16    -0.53     16
  21       C    -0.16    -1.26     3.32     -90.06      -0.30    -1.56     16
  22       H     0.07     0.55     8.14     -51.92      -0.42     0.13     16
  23       C     0.49     9.26     7.38      36.00       0.27     9.53     16
  24       O    -0.69   -15.42    16.33     -20.22      -0.33   -15.75     16
  25       O    -0.69   -16.20    17.96     -20.23      -0.36   -16.56     16
  26       C    -0.08    -0.03     5.74     -24.68      -0.14    -0.17     16
  27       H     0.13    -2.61     8.08     -51.93      -0.42    -3.03     16
  28       H     0.12    -2.30     5.94     -51.93      -0.31    -2.61     16
  29       H     0.13    -2.51     6.19     -51.93      -0.32    -2.83     16
  30       H     0.15    -3.38     8.03     -51.93      -0.42    -3.79     16
  31       H     0.16    -3.70     7.97     -51.93      -0.41    -4.11     16
  32       H     0.17    -3.73     8.06     -52.48      -0.42    -4.15     16
  33       H     0.19    -3.36     8.06     -52.49      -0.42    -3.78     16
  34       H     0.19    -2.16     7.40     -52.49      -0.39    -2.55     16
  35       H     0.18    -2.78     7.30     -52.49      -0.38    -3.16     16
  36       H     0.14    -2.33     7.89     -51.93      -0.41    -2.74     16
  37       H     0.13    -2.36     8.09     -51.93      -0.42    -2.78     16
  38       H     0.06    -0.58     8.14     -51.93      -0.42    -1.01     16
  39       H     0.06    -0.60     7.74     -51.93      -0.40    -1.00     16
  40       H     0.06     0.22     8.14     -51.93      -0.42    -0.20     16
  41       H     0.09     0.65     6.87     -51.93      -0.36     0.30     16
  42       H     0.07     0.11     7.97     -51.93      -0.41    -0.31     16
  43       H     0.07     0.06     8.14     -51.93      -0.42    -0.36     16
 Total:          0.00   -50.94   357.06                 -5.38   -56.32