REAL300000674680.mol2 29                                                        
   1       O    -0.70   -22.88    16.88     -20.23      -0.34   -23.22     15
   2       C     0.49    15.16     8.05      36.01       0.29    15.45     15
   3       O    -0.70   -24.50    18.00     -20.23      -0.36   -24.87     15
   4       C    -0.17    -3.86     5.07     -27.88      -0.14    -4.00     15
   5       C    -0.11    -1.84     4.99     -27.88      -0.14    -1.97     15
   6       C     0.52     6.72     7.67     -10.98      -0.08     6.64     15
   7       O    -0.51    -7.76    13.44       5.55       0.07    -7.69     15
   8       N    -0.67    -5.74     5.34      -9.86      -0.05    -5.79     15
   9       C     0.22     1.67     6.29     -83.70      -0.53     1.14     15
  10       C    -0.11    -0.72     8.70     -39.39      -0.34    -1.06     15
  11       C    -0.04    -0.16    10.04     -39.61      -0.40    -0.56     15
  12       C    -0.13    -0.80     8.62     -39.55      -0.34    -1.14     15
  13       C     0.40     3.70     4.82     -39.61      -0.19     3.51     15
  14       F    -0.14    -2.67    16.66       2.25       0.04    -2.64     15
  15       F    -0.17    -2.54    15.31       2.25       0.03    -2.51     15
  16       F    -0.17    -2.68    15.29       2.25       0.03    -2.64     15
  17       F    -0.17    -2.58    15.31       2.25       0.03    -2.55     15
  18       F    -0.16    -2.61    15.32       2.25       0.03    -2.57     15
  19       C    -0.16    -1.24     8.54     -39.39      -0.34    -1.58     15
  20       H     0.07     1.50     8.10     -51.93      -0.42     1.08     15
  21       H     0.07     1.47     8.10     -51.92      -0.42     1.05     15
  22       H     0.10     1.64     8.10     -51.93      -0.42     1.22     15
  23       H     0.10     1.70     8.10     -51.93      -0.42     1.28     15
  24       H     0.42     2.42     8.82     -40.82      -0.36     2.06     15
  25       H     0.18     1.35     6.24     -52.49      -0.33     1.03     15
  26       H     0.18     0.08     8.06     -52.48      -0.42    -0.34     15
  27       H     0.18     0.89     7.39     -52.49      -0.39     0.50     15
  28       H     0.19     1.36     7.39     -52.49      -0.39     0.97     15
 Total:         -1.00   -42.92   274.64                 -2.15   -45.07