REAL300019679963.mol2 28                                                        
   1       O    -0.55   -14.09    16.35      -3.88      -0.06   -14.16     15
   2       C     0.57    11.30     7.77      86.79       0.67    11.97     15
   3       N    -0.70   -16.90     5.50    -469.71      -2.58   -19.49     15
   4       C     0.25     8.11     6.30      85.63       0.54     8.65     15
   5       C     0.04     1.97     7.73     138.59       1.07     3.04     15
   6       N    -0.39   -20.01    12.43     -51.29      -0.64   -20.65     15
   7       N    -0.21   -12.05    13.47      37.02       0.50   -11.55     15
   8       N    -0.21   -12.07    13.47      37.02       0.50   -11.57     15
   9       N    -0.39   -20.07    12.43     -51.29      -0.64   -20.71     15
  10       C    -0.11    -1.24     5.87     -20.09      -0.12    -1.36     15
  11       C    -0.01    -0.11     9.54      22.52       0.21     0.11     15
  12       C    -0.11    -1.17     8.60      22.23       0.19    -0.98     15
  13       C     0.38     5.86     4.83      22.33       0.11     5.97     15
  14       F    -0.07    -2.29    16.66      44.97       0.75    -1.54     15
  15       F    -0.21    -5.87    15.30      44.97       0.69    -5.18     15
  16       F    -0.26    -7.69    15.30      44.97       0.69    -7.00     15
  17       F    -0.21    -5.96    15.30      44.97       0.69    -5.27     15
  18       F    -0.12    -3.13    15.30      44.97       0.69    -2.44     15
  19       C    -0.11    -1.03     8.60      22.23       0.19    -0.84     15
  20       C     0.01     0.12     9.60      22.53       0.22     0.33     15
  21       H     0.41     8.78     6.50     -92.71      -0.60     8.18     15
  22       H     0.09     2.84     8.14      -2.39      -0.02     2.82     15
  23       H     0.09     2.85     8.14      -2.39      -0.02     2.83     15
  24       H     0.20     1.05     6.41      -2.91      -0.02     1.03     15
  25       H     0.20     1.84     7.38      -2.91      -0.02     1.82     15
  26       H     0.20     1.54     7.38      -2.91      -0.02     1.52     15
  27       H     0.21     0.94     7.65      -2.91      -0.02     0.92     15
 Total:         -1.00   -76.48   271.93                  2.94   -73.54