REAL300010613828.mol2 38                                                        
   1       C    -0.06     1.03     8.45      60.07       0.51     1.54     16
   2       N    -0.38     7.43     0.47    -244.37      -0.12     7.32     16
   3       H     0.43    -8.86     8.27     -39.29      -0.32    -9.19     16
   4       C     0.04    -0.92     4.81      -4.98      -0.02    -0.94     16
   5       C    -0.10     1.90     4.72    -104.62      -0.49     1.41     16
   6       C    -0.07     1.35     9.70     -39.59      -0.38     0.96     16
   7       C    -0.05     0.86    10.05     -39.59      -0.40     0.46     16
   8       C    -0.08     0.99     8.62     -39.58      -0.34     0.65     16
   9       C     0.38    -3.49     4.82     -39.59      -0.19    -3.68     16
  10       F    -0.09    -0.52    16.66       2.25       0.04    -0.49     16
  11       F    -0.16    -0.14    15.32       2.25       0.03    -0.11     16
  12       F    -0.19     0.08    15.30       2.25       0.03     0.12     16
  13       F    -0.16    -0.11    15.31       2.25       0.03    -0.07     16
  14       F    -0.18    -0.03    15.32       2.25       0.03     0.00     16
  15       C    -0.10     1.34     6.41     -39.58      -0.25     1.08     16
  16       C     0.03    -0.45     4.93      -3.82      -0.02    -0.47     16
  17       C    -0.21     1.05     4.24     -90.62      -0.38     0.66     16
  18       H     0.12    -0.53     8.09     -51.93      -0.42    -0.95     16
  19       C    -0.15     0.11     9.86     -26.69      -0.26    -0.15     16
  20       C    -0.16    -0.75     5.93     -91.73      -0.54    -1.29     16
  21       H     0.11     0.29     8.14     -51.93      -0.42    -0.13     16
  22       C     0.51     8.21     7.59      36.00       0.27     8.49     16
  23       O    -0.67   -14.41    17.96     -20.23      -0.36   -14.77     16
  24       O    -0.69   -13.40    18.00     -20.23      -0.36   -13.77     16
  25       H     0.13    -2.35     8.08     -51.93      -0.42    -2.77     16
  26       H     0.11    -2.06     5.94     -51.93      -0.31    -2.37     16
  27       H     0.14    -2.13     7.13     -51.93      -0.37    -2.50     16
  28       H     0.15    -3.28     8.03     -51.93      -0.42    -3.70     16
  29       H     0.16    -3.62     7.97     -51.93      -0.41    -4.03     16
  30       H     0.18    -3.71     8.06     -52.48      -0.42    -4.14     16
  31       H     0.19    -3.40     8.06     -52.49      -0.42    -3.82     16
  32       H     0.19    -2.15     7.40     -52.49      -0.39    -2.54     16
  33       H     0.19    -2.76     7.30     -52.49      -0.38    -3.14     16
  34       H     0.13    -2.04     8.02     -51.93      -0.42    -2.46     16
  35       H     0.13    -2.04     7.82     -51.93      -0.41    -2.45     16
  36       H     0.09    -0.40     8.03     -51.93      -0.42    -0.82     16
  37       H     0.10     0.26     8.14     -51.93      -0.42    -0.16     16
 Total:          0.00   -48.66   328.95                 -4.60   -53.26