REAL300017816155.mol2 33                                                        
   1       O    -0.17     4.31    17.51      19.05       0.33     4.64     16
   2       C     0.52   -17.94     7.48      71.23       0.53   -17.40     16
   3       O    -0.15     4.85    17.76      19.04       0.34     5.19     16
   4       C     0.27   -10.84     3.83      29.84       0.11   -10.73     16
   5       F    -0.05     1.31    16.37      44.97       0.74     2.05     16
   6       C    -0.19     6.68     5.08      30.59       0.16     6.83     16
   7       C     0.09    -1.98     6.14      86.38       0.53    -1.45     16
   8       N    -1.09    12.54     6.00    -187.48      -1.12    11.42     16
   9       S     2.76    18.41     5.74     -56.49      -0.32    18.08     16
  10       O    -0.96   -13.87    17.28    -128.00      -2.21   -16.09     16
  11       O    -0.94    -7.74    16.76    -128.00      -2.15    -9.88     16
  12       C    -0.71   -16.87     5.95      22.27       0.13   -16.73     16
  13       C     0.04     1.21     9.52      22.27       0.21     1.43     16
  14       C    -0.18   -10.43     8.62      22.27       0.19   -10.24     16
  15       C     0.47    36.22     4.82      22.27       0.11    36.32     16
  16       F    -0.28   -34.18    16.66      44.97       0.75   -33.43     16
  17       F    -0.59   -65.91    15.31      44.97       0.69   -65.22     16
  18       F    -0.59   -66.82    15.32      44.97       0.69   -66.13     16
  19       F    -0.60   -68.19    15.32      44.97       0.69   -67.50     16
  20       F    -0.59   -63.87    15.31      44.97       0.69   -63.18     16
  21       C    -0.19   -11.62     8.62      22.27       0.19   -11.43     16
  22       C     0.04     1.27     9.52      22.27       0.21     1.48     16
  23       H     0.36   -19.12     8.14      -2.39      -0.02   -19.14     16
  24       H     0.16    -5.82     8.14      -2.39      -0.02    -5.84     16
  25       H     0.20    -8.48     7.98      -2.39      -0.02    -8.50     16
  26       H     0.15    -4.26     7.75      -2.39      -0.02    -4.28     16
  27       H     0.10    -1.75     7.94      -2.39      -0.02    -1.77     16
  28       H     0.44    -7.77     8.65     -96.74      -0.84    -8.61     16
  29       H     0.23     2.93     7.62      -2.91      -0.02     2.91     16
  30       H     0.13     8.55     7.40      -2.91      -0.02     8.53     16
  31       H     0.12     8.43     7.40      -2.91      -0.02     8.41     16
  32       H     0.21     4.83     7.62      -2.91      -0.02     4.81     16
 Total:         -1.00  -325.90   323.54                  0.47  -325.43