REAL300000674688.mol2 41                                                        
   1       O    -0.66   -20.85    14.03     -26.66      -0.37   -21.23     16
   2       C     0.48    14.02     5.19      36.01       0.19    14.21     16
   3       O    -0.70   -22.96    17.99     -20.23      -0.36   -23.32     16
   4       C    -0.15    -3.16     2.59     -91.54      -0.24    -3.40     16
   5       C    -0.04    -0.82     3.05     -90.56      -0.28    -1.10     16
   6       C    -0.10    -1.90     7.67     -35.38      -0.27    -2.17     16
   7       C    -0.17    -3.03     7.66     -35.38      -0.27    -3.30     16
   8       C    -0.04    -0.58     3.01     -90.57      -0.27    -0.86     16
   9       C    -0.11    -1.36     5.67     -26.46      -0.15    -1.51     16
  10       C    -0.11    -1.62     5.68     -26.44      -0.15    -1.77     16
  11       C    -0.07    -1.22     2.53     -91.52      -0.23    -1.45     16
  12       C     0.53     9.91     4.64     -10.98      -0.05     9.86     16
  13       O    -0.47    -9.76    10.46     -14.44      -0.15    -9.91     16
  14       N    -0.67   -10.50     5.35      -9.86      -0.05   -10.56     16
  15       C     0.23     3.52     6.36     -83.69      -0.53     2.98     16
  16       C    -0.11    -1.47     8.72     -39.39      -0.34    -1.81     16
  17       C    -0.05    -0.46    10.04     -39.61      -0.40    -0.86     16
  18       C    -0.14    -1.68     8.62     -39.55      -0.34    -2.02     16
  19       C     0.40     6.17     4.82     -39.61      -0.19     5.98     16
  20       F    -0.04    -0.74    16.65       2.25       0.04    -0.70     16
  21       F    -0.25    -4.68    15.31       2.25       0.03    -4.65     16
  22       F    -0.20    -4.49    15.29       2.25       0.03    -4.46     16
  23       F    -0.18    -3.71    15.29       2.25       0.03    -3.68     16
  24       F    -0.14    -2.58    15.33       2.25       0.03    -2.54     16
  25       C    -0.15    -2.34     8.53     -39.39      -0.34    -2.67     16
  26       H     0.07     1.47     8.14     -51.93      -0.42     1.05     16
  27       H     0.07     1.47     8.14     -51.93      -0.42     1.05     16
  28       H     0.11     2.22     8.06     -52.49      -0.42     1.80     16
  29       H     0.11     1.88     8.06     -52.49      -0.42     1.46     16
  30       H     0.07     0.96     8.14     -51.93      -0.42     0.54     16
  31       H     0.06     0.73     8.14     -51.93      -0.42     0.31     16
  32       H     0.06     0.65     8.14     -51.93      -0.42     0.23     16
  33       H     0.06     0.80     8.14     -51.93      -0.42     0.37     16
  34       H     0.06     0.78     8.14     -51.93      -0.42     0.36     16
  35       H     0.08     1.09     8.08     -51.93      -0.42     0.67     16
  36       H     0.42     5.30     8.76     -40.82      -0.36     4.95     16
  37       H     0.18     2.35     5.96     -52.48      -0.31     2.04     16
  38       H     0.18     1.00     8.06     -52.49      -0.42     0.58     16
  39       H     0.17     1.83     7.39     -52.49      -0.39     1.44     16
  40       H     0.18     2.73     7.39     -52.48      -0.39     2.35     16
 Total:         -1.00   -41.04   339.24                 -5.61   -46.65