REAL300007891329.mol2 34                                                        
   1       O    -0.71   -40.18    14.98      19.05       0.29   -39.90     16
   2       C     0.48    24.04     5.23      71.24       0.37    24.41     16
   3       O    -0.73   -42.49    18.00      19.02       0.34   -42.14     16
   4       C    -0.17    -5.96     5.23      29.85       0.16    -5.80     16
   5       C     0.09     2.67     1.95       3.61       0.01     2.68     16
   6       N    -1.04   -34.05     3.92    -152.20      -0.60   -34.64     16
   7       S     2.72    85.30     5.73     -56.49      -0.32    84.97     16
   8       O    -0.98   -36.88    17.46    -128.00      -2.23   -39.12     16
   9       O    -0.93   -25.77    16.40    -128.00      -2.10   -27.87     16
  10       C    -0.64   -20.25     3.58      22.27       0.08   -20.17     16
  11       C    -0.01    -0.11     7.15      22.27       0.16     0.05     16
  12       C    -0.05    -0.85    10.05      22.27       0.22    -0.62     16
  13       C    -0.06    -1.59     8.62      22.27       0.19    -1.40     16
  14       C     0.33    13.05     4.82      22.27       0.11    13.15     16
  15       F    -0.22   -12.17    16.66      44.97       0.75   -11.42     16
  16       F    -0.16    -7.00    15.31      44.97       0.69    -6.31     16
  17       F    -0.15    -8.47    15.31      44.97       0.69    -7.78     16
  18       F    -0.15    -7.63    15.32      44.97       0.69    -6.94     16
  19       F    -0.18    -9.12    15.31      44.97       0.69    -8.44     16
  20       C    -0.01    -0.49     7.04      22.27       0.16    -0.34     16
  21       C    -0.16    -3.85    10.10      30.60       0.31    -3.54     16
  22       C    -0.15    -3.07     9.69      30.60       0.30    -2.77     16
  23       H     0.09     2.91     7.92      -2.39      -0.02     2.89     16
  24       H     0.09     2.58     5.71      -2.38      -0.01     2.56     16
  25       H     0.42    14.05     8.77     -96.75      -0.85    13.20     16
  26       H     0.22     2.69     7.31      -2.91      -0.02     2.67     16
  27       H     0.25     1.02     8.06      -2.91      -0.02     1.00     16
  28       H     0.21     4.69     7.40      -2.91      -0.02     4.67     16
  29       H     0.16     7.10     7.11      -2.91      -0.02     7.08     16
  30       H     0.10     2.34     8.14      -2.39      -0.02     2.32     16
  31       H     0.11     2.40     8.06      -2.39      -0.02     2.38     16
  32       H     0.13     1.99     8.14      -2.39      -0.02     1.97     16
  33       H     0.11     2.14     8.14      -2.39      -0.02     2.12     16
 Total:         -1.00   -90.97   312.59                 -0.11   -91.08