REAL300020067230.mol2 27                                                        
   1       O    -0.50   -11.44    16.14      19.92       0.32   -11.12     15
   2       C     0.52    10.35     7.90      70.33       0.56    10.91     15
   3       O    -0.35    -9.91     9.46     -56.19      -0.53   -10.44     15
   4       C     0.20     6.88     6.10      71.24       0.43     7.32     15
   5       C     0.05     2.35     8.00     138.59       1.11     3.46     15
   6       N    -0.38   -20.78    12.43     -51.29      -0.64   -21.42     15
   7       N    -0.21   -12.25    13.47      37.02       0.50   -11.76     15
   8       N    -0.21   -12.25    13.47      37.02       0.50   -11.76     15
   9       N    -0.38   -20.79    12.43     -51.29      -0.64   -21.42     15
  10       C    -0.10    -1.13     5.87     -20.10      -0.12    -1.25     15
  11       C     0.01     0.12     9.62      22.54       0.22     0.33     15
  12       C    -0.11    -1.21     8.60      22.23       0.19    -1.01     15
  13       C     0.37     5.16     4.83      22.33       0.11     5.26     15
  14       F    -0.21    -7.90    16.66      44.97       0.75    -7.15     15
  15       F    -0.16    -4.19    15.29      44.97       0.69    -3.50     15
  16       F    -0.16    -4.56    15.30      44.97       0.69    -3.87     15
  17       F    -0.15    -4.13    15.30      44.97       0.69    -3.45     15
  18       F    -0.16    -4.61    15.30      44.97       0.69    -3.93     15
  19       C    -0.10    -0.74     8.60      22.23       0.19    -0.55     15
  20       C     0.03     0.15     9.60      22.54       0.22     0.37     15
  21       H     0.10     3.15     8.14      -2.39      -0.02     3.14     15
  22       H     0.10     3.16     8.14      -2.38      -0.02     3.14     15
  23       H     0.20     1.96     7.61      -2.91      -0.02     1.94     15
  24       H     0.20     1.89     7.38      -2.91      -0.02     1.86     15
  25       H     0.21     0.82     7.38      -2.91      -0.02     0.80     15
  26       H     0.22     0.11     7.65      -2.91      -0.02     0.09     15
 Total:         -1.00   -79.80   270.64                  5.79   -74.01