REAL300005947745.mol2 39                                                        
   1       C     0.05     0.14     8.84     127.77       1.13     1.27     16
   2       N    -0.60    -5.93     2.86    -854.31      -2.44    -8.37     16
   3       C     0.15     0.46     5.51      85.63       0.47     0.93     16
   4       C    -0.05    -0.19     5.46     -19.87      -0.11    -0.30     16
   5       C    -0.06     0.39     9.70      22.27       0.22     0.60     16
   6       C    -0.03     0.18    10.05      22.27       0.22     0.40     16
   7       C    -0.11    -0.70     8.62      22.27       0.19    -0.51     16
   8       C     0.31     5.60     4.82      22.27       0.11     5.71     16
   9       F    -0.22    -9.83    16.66      44.97       0.75    -9.08     16
  10       F    -0.15    -4.73    15.31      44.97       0.69    -4.04     16
  11       F    -0.17    -6.51    15.31      44.97       0.69    -5.82     16
  12       F    -0.16    -5.37    15.32      44.97       0.69    -4.68     16
  13       F    -0.17    -5.92    15.31      44.97       0.69    -5.24     16
  14       C    -0.11    -1.77     8.11      22.27       0.18    -1.59     16
  15       C     0.57    13.26     7.36      86.86       0.64    13.90     16
  16       O    -0.57   -17.67    15.60      -3.79      -0.06   -17.72     16
  17       C    -0.13    -3.89     5.17     -20.03      -0.10    -4.00     16
  18       C    -0.07    -1.88     7.59      22.48       0.17    -1.71     16
  19       C    -0.09    -3.58     9.58      22.52       0.22    -3.36     16
  20       C    -0.15    -7.58     5.88     -20.06      -0.12    -7.70     16
  21       C     0.50    33.43     8.01      70.35       0.56    33.99     16
  22       O    -0.72   -51.08    17.23      17.91       0.31   -50.77     16
  23       O    -0.73   -53.64    17.23      17.91       0.31   -53.33     16
  24       C    -0.10    -4.66     9.58      22.52       0.22    -4.45     16
  25       C    -0.08    -2.95     9.59      22.49       0.22    -2.73     16
  26       H     0.09    -0.10     7.04      -2.39      -0.02    -0.12     16
  27       H     0.06     0.62     5.76      -2.39      -0.01     0.60     16
  28       H     0.12    -0.83     8.11      -2.39      -0.02    -0.85     16
  29       H     0.09     0.73     7.45      -2.39      -0.02     0.71     16
  30       H     0.17    -1.52     8.02      -2.39      -0.02    -1.54     16
  31       H     0.23    -3.99     8.06      -2.91      -0.02    -4.01     16
  32       H     0.23    -3.61     8.06      -2.91      -0.02    -3.63     16
  33       H     0.18     1.00     7.40      -2.91      -0.02     0.98     16
  34       H     0.15     3.50     6.70      -2.91      -0.02     3.48     16
  35       H     0.19     2.70     5.51      -2.91      -0.02     2.68     16
  36       H     0.13     5.17     7.63      -2.91      -0.02     5.15     16
  37       H     0.11     5.47     7.63      -2.91      -0.02     5.44     16
  38       H     0.13     4.60     7.99      -2.91      -0.02     4.58     16
 Total:         -1.00  -120.69   350.07                  5.57  -115.11