REAL300000674695.mol2 35                                                        
   1       C    -0.15    -3.02     8.67      37.16       0.32    -2.70     16
   2       C    -0.05    -0.99     1.68     -90.62      -0.15    -1.14     16
   3       C    -0.18    -4.19     5.25     -27.89      -0.15    -4.33     16
   4       C     0.49    15.60     7.77      36.00       0.28    15.88     16
   5       O    -0.69   -23.38    14.86     -20.23      -0.30   -23.68     16
   6       O    -0.71   -25.31    18.00     -20.23      -0.36   -25.67     16
   7       C    -0.14    -1.61     5.18     -27.88      -0.14    -1.76     16
   8       C     0.52     5.59     7.39     -10.98      -0.08     5.51     16
   9       O    -0.49    -6.92    11.42       5.55       0.06    -6.85     16
  10       N    -0.68    -4.51     5.34      -9.86      -0.05    -4.56     16
  11       C     0.21     1.44     6.29     -83.69      -0.53     0.91     16
  12       C    -0.11    -0.67     8.70     -39.40      -0.34    -1.02     16
  13       C    -0.04    -0.18    10.04     -39.61      -0.40    -0.58     16
  14       C    -0.13    -0.80     8.62     -39.55      -0.34    -1.14     16
  15       C     0.39     3.48     4.82     -39.61      -0.19     3.29     16
  16       F    -0.02    -0.29    16.66       2.25       0.04    -0.25     16
  17       F    -0.18    -2.63    15.31       2.25       0.03    -2.60     16
  18       F    -0.13    -1.74    15.29       2.25       0.03    -1.71     16
  19       F    -0.23    -3.28    15.30       2.25       0.03    -3.24     16
  20       F    -0.23    -3.51    15.33       2.25       0.03    -3.47     16
  21       C    -0.15    -1.10     8.54     -39.39      -0.34    -1.44     16
  22       H     0.03     0.56     8.14     -51.93      -0.42     0.13     16
  23       H     0.09     2.16     5.95     -51.93      -0.31     1.85     16
  24       H     0.05     0.98     5.95     -51.93      -0.31     0.67     16
  25       H     0.08     1.71     7.77     -51.93      -0.40     1.30     16
  26       H     0.06     1.24     8.14     -51.93      -0.42     0.82     16
  27       H     0.06     1.19     8.14     -51.93      -0.42     0.77     16
  28       H     0.10     0.92     8.14     -51.93      -0.42     0.50     16
  29       H     0.10     0.98     8.14     -51.93      -0.42     0.56     16
  30       H     0.42     1.43     8.82     -40.82      -0.36     1.07     16
  31       H     0.18     1.30     6.24     -52.48      -0.33     0.98     16
  32       H     0.18     0.15     8.06     -52.49      -0.42    -0.27     16
  33       H     0.18     0.94     7.39     -52.49      -0.39     0.55     16
  34       H     0.18     1.13     7.39     -52.48      -0.39     0.74     16
 Total:         -1.00   -43.32   308.74                 -2.91   -46.23