REAL300005947785.mol2 39                                                        
   1       C     0.09     1.36     7.63      59.84       0.46     1.82     16
   2       N    -0.59    -9.69     2.48    -182.96      -0.45   -10.14     16
   3       C     0.16     1.98     5.52      -5.19      -0.03     1.95     16
   4       C    -0.04    -0.53     5.46    -104.62      -0.57    -1.11     16
   5       C    -0.08    -0.81     9.70     -39.58      -0.38    -1.20     16
   6       C    -0.06    -0.64    10.05     -39.58      -0.40    -1.04     16
   7       C    -0.11    -1.50     8.62     -39.59      -0.34    -1.85     16
   8       C     0.37     6.77     4.82     -39.58      -0.19     6.58     16
   9       F    -0.16    -4.29    16.66       2.25       0.04    -4.25     16
  10       F    -0.20    -4.33    15.31       2.25       0.03    -4.29     16
  11       F    -0.11    -2.88    15.31       2.25       0.03    -2.84     16
  12       F    -0.16    -3.77    15.32       2.25       0.03    -3.74     16
  13       F    -0.18    -4.20    15.31       2.25       0.03    -4.17     16
  14       C    -0.09    -1.49     8.16     -39.58      -0.32    -1.81     16
  15       C     0.57    11.72     5.74     -10.98      -0.06    11.66     16
  16       O    -0.55   -12.68    15.62       5.56       0.09   -12.60     16
  17       C    -0.16    -3.11     1.37    -155.66      -0.21    -3.32     16
  18       C    -0.10    -1.46     9.50      37.16       0.35    -1.10     16
  19       C    -0.13    -2.86     9.42     -26.73      -0.25    -3.11     16
  20       C    -0.18    -4.17     4.92     -91.77      -0.45    -4.62     16
  21       H     0.10     2.08     8.14     -51.93      -0.42     1.65     16
  22       C     0.51    15.21     6.84      36.01       0.25    15.46     16
  23       O    -0.68   -23.74    17.96     -20.22      -0.36   -24.10     16
  24       O    -0.68   -19.52    14.08     -20.23      -0.28   -19.80     16
  25       H     0.04     0.38     7.69     -51.93      -0.40    -0.01     16
  26       H     0.10     1.82     4.36     -51.93      -0.23     1.60     16
  27       H     0.06     0.82     8.11     -51.93      -0.42     0.39     16
  28       H     0.10     1.24     7.43     -51.93      -0.39     0.85     16
  29       H     0.10     0.78     8.02     -51.93      -0.42     0.36     16
  30       H     0.16     1.06     8.06     -52.48      -0.42     0.64     16
  31       H     0.17     0.96     8.06     -52.49      -0.42     0.54     16
  32       H     0.17     2.15     7.40     -52.48      -0.39     1.77     16
  33       H     0.18     3.47     6.76     -52.49      -0.35     3.12     16
  34       H     0.06     0.74     8.14     -51.93      -0.42     0.32     16
  35       H     0.06     0.80     8.09     -51.93      -0.42     0.38     16
  36       H     0.06     0.77     6.46     -51.93      -0.34     0.44     16
  37       H     0.09     1.60     8.14     -51.93      -0.42     1.18     16
  38       H     0.10     2.44     8.03     -51.93      -0.42     2.02     16
 Total:         -1.00   -43.52   338.71                 -3.78   -47.30