REAL300000674696.mol2 39                                                        
   1       O    -0.69   -23.62    17.07     -20.23      -0.35   -23.97     16
   2       C     0.51    15.32     5.85      36.01       0.21    15.53     16
   3       O    -0.71   -22.90    16.85     -20.25      -0.34   -23.25     16
   4       C    -0.14    -3.08     2.40     -91.77      -0.22    -3.31     16
   5       H     0.07     1.49     8.14     -51.93      -0.42     1.07     16
   6       C    -0.11    -2.17     4.53     -26.73      -0.12    -2.29     16
   7       C    -0.12    -1.83     5.92     -26.74      -0.16    -1.99     16
   8       C    -0.12    -1.55     5.70     -26.74      -0.15    -1.71     16
   9       C    -0.11    -1.40     5.36     -26.74      -0.14    -1.54     16
  10       C    -0.08    -1.31     2.20     -91.78      -0.20    -1.51     16
  11       H     0.11     1.85     7.85     -51.93      -0.41     1.44     16
  12       C     0.53     8.94     5.00     -10.99      -0.05     8.89     16
  13       O    -0.47    -9.76     9.94       5.55       0.06    -9.70     16
  14       N    -0.67    -7.82     5.19      -9.87      -0.05    -7.87     16
  15       C     0.22     2.39     6.29     -83.70      -0.53     1.87     16
  16       C    -0.11    -1.13     8.70     -39.39      -0.34    -1.47     16
  17       C    -0.04    -0.29    10.04     -39.61      -0.40    -0.68     16
  18       C    -0.13    -1.12     8.62     -39.55      -0.34    -1.46     16
  19       C     0.39     4.34     4.82     -39.61      -0.19     4.14     16
  20       F    -0.15    -2.94    16.65       2.25       0.04    -2.90     16
  21       F    -0.16    -2.68    15.29       2.25       0.03    -2.65     16
  22       F    -0.17    -2.87    15.30       2.25       0.03    -2.83     16
  23       F    -0.17    -2.71    15.31       2.25       0.03    -2.68     16
  24       F    -0.17    -2.80    15.32       2.25       0.03    -2.76     16
  25       C    -0.16    -1.57     8.54     -39.39      -0.34    -1.91     16
  26       H     0.06     1.44     7.85     -51.93      -0.41     1.04     16
  27       H     0.08     1.75     5.51     -51.93      -0.29     1.47     16
  28       H     0.06     0.80     8.14     -51.93      -0.42     0.37     16
  29       H     0.05     0.77     8.14     -51.93      -0.42     0.34     16
  30       H     0.06     0.65     8.14     -51.93      -0.42     0.23     16
  31       H     0.05     0.75     7.22     -51.93      -0.37     0.38     16
  32       H     0.08     0.89     8.14     -51.93      -0.42     0.46     16
  33       H     0.06     0.55     7.68     -51.93      -0.40     0.15     16
  34       H     0.42     3.40     8.39     -40.82      -0.34     3.06     16
  35       H     0.19     2.54     6.24     -52.48      -0.33     2.21     16
  36       H     0.18     0.73     8.06     -52.49      -0.42     0.31     16
  37       H     0.18     1.25     7.39     -52.49      -0.39     0.86     16
  38       H     0.18     1.58     7.39     -52.48      -0.39     1.19     16
 Total:         -1.00   -42.13   325.20                 -4.44   -46.57