REAL300020017531.mol2 34                                                        
   1       O    -0.51    -8.33    13.76      -3.85      -0.05    -8.38     16
   2       C     0.60     9.55     7.65      86.85       0.66    10.22     16
   3       N    -0.65    -7.45     5.32    -305.91      -1.63    -9.07     16
   4       C     0.21     1.84     6.29      38.18       0.24     2.08     16
   5       C    -0.10    -0.38     8.69      22.40       0.19    -0.18     16
   6       C    -0.01     0.01    10.04      22.25       0.22     0.23     16
   7       C    -0.12    -0.68     8.62      22.29       0.19    -0.49     16
   8       C     0.37     5.42     4.82      22.25       0.11     5.53     16
   9       F    -0.08    -2.69    16.66      44.97       0.75    -1.94     16
  10       F    -0.20    -5.33    15.31      44.97       0.69    -4.64     16
  11       F    -0.27    -8.28    15.29      44.97       0.69    -7.59     16
  12       F    -0.20    -5.73    15.30      44.97       0.69    -5.04     16
  13       F    -0.12    -3.48    15.32      44.97       0.69    -2.79     16
  14       C    -0.16    -1.85     8.54      22.40       0.19    -1.65     16
  15       C     0.05     1.05     6.75      41.88       0.28     1.34     16
  16       C    -0.08    -1.83     9.61      22.58       0.22    -1.62     16
  17       C    -0.06    -1.88     9.83      22.68       0.22    -1.66     16
  18       C     0.00    -0.14     5.90     -19.93      -0.12    -0.26     16
  19       C     0.08     4.00     7.96     136.94       1.09     5.09     16
  20       N    -0.38   -20.63    12.25     -51.99      -0.64   -21.27     16
  21       N    -0.21   -12.15    13.44      37.02       0.50   -11.65     16
  22       N    -0.21   -12.16    13.44      37.02       0.50   -11.66     16
  23       N    -0.38   -20.59    12.20     -51.99      -0.63   -21.23     16
  24       C     0.12     3.80    10.87      85.15       0.93     4.72     16
  25       N    -0.45   -10.97     9.52    -184.01      -1.75   -12.72     16
  26       H     0.44     4.60     8.15     -92.71      -0.76     3.84     16
  27       H     0.19     0.64     6.24      -2.91      -0.02     0.62     16
  28       H     0.24    -2.46     8.06      -2.91      -0.02    -2.49     16
  29       H     0.19     0.76     7.39      -2.91      -0.02     0.74     16
  30       H     0.18     2.32     7.39      -2.91      -0.02     2.30     16
  31       H     0.18     2.86     7.63      -2.91      -0.02     2.84     16
  32       H     0.15     4.45     7.96      -2.91      -0.02     4.43     16
  33       H     0.17     5.39     7.89      -2.91      -0.02     5.37     16
 Total:         -1.00   -80.29   324.10                  3.32   -76.97