REAL300000674721.mol2 42                                                        
   1       O    -0.69   -25.18    16.39     -20.27      -0.33   -25.51     16
   2       C     0.51    16.41     5.27      36.00       0.19    16.60     16
   3       O    -0.71   -24.16    15.50     -27.49      -0.43   -24.59     16
   4       C    -0.14    -3.30     1.86     -92.48      -0.17    -3.48     16
   5       H     0.07     1.53     6.63     -51.93      -0.34     1.18     16
   6       C    -0.10    -2.09     4.78     -27.34      -0.13    -2.23     16
   7       C    -0.12    -2.01     5.26     -29.59      -0.16    -2.17     16
   8       C    -0.11    -1.48     5.26     -29.60      -0.16    -1.63     16
   9       C    -0.11    -1.36     5.61     -27.35      -0.15    -1.51     16
  10       C    -0.11    -1.41     4.53     -27.47      -0.12    -1.54     16
  11       C    -0.07    -1.26     2.01     -90.69      -0.18    -1.44     16
  12       H     0.09     1.59     8.14     -51.93      -0.42     1.17     16
  13       C     0.52    10.00     5.45     -10.98      -0.06     9.94     16
  14       O    -0.45   -11.49    10.51     -17.39      -0.18   -11.68     16
  15       N    -0.68    -8.67     5.21      -9.86      -0.05    -8.72     16
  16       C     0.23     2.81     6.28     -83.69      -0.53     2.29     16
  17       C    -0.14    -1.01     9.96     -39.39      -0.39    -1.40     16
  18       C    -0.05    -0.28    10.04     -39.61      -0.40    -0.68     16
  19       C    -0.14    -1.41     8.62     -39.55      -0.34    -1.75     16
  20       C     0.40     6.04     4.82     -39.61      -0.19     5.85     16
  21       F    -0.03    -0.67    16.66       2.25       0.04    -0.64     16
  22       F    -0.20    -4.00    15.31       2.25       0.03    -3.96     16
  23       F    -0.13    -2.65    15.29       2.25       0.03    -2.62     16
  24       F    -0.26    -4.91    15.31       2.25       0.03    -4.88     16
  25       F    -0.17    -4.07    15.32       2.25       0.03    -4.04     16
  26       C    -0.14    -2.17     7.23     -39.39      -0.28    -2.46     16
  27       H     0.09     2.23     6.59     -51.93      -0.34     1.89     16
  28       H     0.05     1.00     6.62     -51.93      -0.34     0.66     16
  29       H     0.06     0.93     7.47     -51.93      -0.39     0.54     16
  30       H     0.05     0.81     8.14     -51.93      -0.42     0.38     16
  31       H     0.05     0.59     8.14     -51.93      -0.42     0.17     16
  32       H     0.06     0.73     7.47     -51.93      -0.39     0.34     16
  33       H     0.07     0.90     6.98     -51.93      -0.36     0.54     16
  34       H     0.06     0.58     8.14     -51.93      -0.42     0.16     16
  35       H     0.06     0.53     8.14     -51.93      -0.42     0.11     16
  36       H     0.06     0.85     6.46     -51.93      -0.34     0.51     16
  37       H     0.42     3.32     8.78     -40.82      -0.36     2.97     16
  38       H     0.16     0.59     8.06     -52.49      -0.42     0.17     16
  39       H     0.18     0.30     8.06     -52.49      -0.42    -0.13     16
  40       H     0.18     1.60     7.39     -52.49      -0.39     1.21     16
  41       H     0.19     3.56     5.74     -52.49      -0.30     3.26     16
 Total:         -1.00   -46.71   339.42                 -5.29   -52.00