REAL300005728156.mol2 36                                                        
   1       O    -0.74   -72.71    17.01      19.05       0.32   -72.38     16
   2       C     0.48    44.55     7.55      71.25       0.54    45.08     16
   3       O    -0.73   -69.63    17.02      19.04       0.32   -69.30     16
   4       C    -0.14   -11.19     2.57     -11.71      -0.03   -11.22     16
   5       C    -0.07    -5.54     4.59      30.31       0.14    -5.40     16
   6       C     0.00    -0.21     4.77      71.81       0.34     0.13     16
   7       H     0.16    13.46     7.52      99.48       0.75    14.21     16
   8       O    -0.84   -78.87    18.81    -148.98      -2.80   -81.67     16
   9       N    -0.38   -31.94    10.68    -174.62      -1.87   -33.81     16
  10       C     0.31    24.24     8.01      87.22       0.70    24.94     16
  11       O    -0.60   -45.19    11.82      -3.30      -0.04   -45.23     16
  12       C     0.40    28.56     7.17      27.59       0.20    28.76     16
  13       O    -0.46   -34.99    15.93      -3.36      -0.05   -35.04     16
  14       C    -0.22   -12.64     5.89     -20.01      -0.12   -12.76     16
  15       C    -0.03    -1.44     9.30      22.57       0.21    -1.23     16
  16       C    -0.12    -5.00     9.80      22.25       0.22    -4.78     16
  17       C     0.03     1.20     6.33      22.44       0.14     1.34     16
  18       Cl   -0.02    -0.71    28.94      -2.72      -0.08    -0.79     16
  19       C    -0.15    -6.19     9.79      22.30       0.22    -5.97     16
  20       C     0.15     7.81     7.29      22.74       0.17     7.97     16
  21       F    -0.13    -7.22    15.58      44.97       0.70    -6.52     16
  22       C     0.07     4.51     7.28      71.87       0.52     5.03     16
  23       C    -0.10    -7.30     5.03      30.41       0.15    -7.14     16
  24       H     0.08     6.20     8.15      -2.34      -0.02     6.18     16
  25       H     0.06     4.87     7.78      -2.32      -0.02     4.85     16
  26       H     0.04     3.85     6.44      -2.31      -0.01     3.84     16
  27       H     0.03     2.25     7.86      -2.31      -0.02     2.23     16
  28       H     0.01     1.20     8.15      -2.32      -0.02     1.18     16
  29       H     0.18    10.07     4.84      -3.61      -0.02    10.06     16
  30       H     0.18     5.91     8.06      -2.91      -0.02     5.88     16
  31       H     0.18     6.04     8.06      -2.91      -0.02     6.02     16
  32       H     0.09     5.91     7.84      -2.35      -0.02     5.89     16
  33       H     0.11     6.44     8.06      -2.35      -0.02     6.42     16
  34       H     0.04     3.48     8.15      -2.37      -0.02     3.46     16
  35       H     0.11     7.68     7.76      -2.36      -0.02     7.66     16
 Total:         -2.00  -202.53   329.83                  0.43  -202.10