REAL300007615955.mol2 34                                                        
   1       O    -0.68   -18.84    16.52     -20.23      -0.33   -19.17     16
   2       C     0.48    12.34     6.16      36.00       0.22    12.56     16
   3       O    -0.68   -19.46    15.01     -20.23      -0.30   -19.77     16
   4       C     0.10     1.93     3.17     -69.09      -0.22     1.71     16
   5       N    -1.07   -18.56     4.96      -5.89      -0.03   -18.59     16
   6       S     2.70    43.41     5.72    -107.50      -0.61    42.79     16
   7       O    -0.95   -16.50    17.28     -57.17      -0.99   -17.48     16
   8       O    -0.95   -15.54    16.63     -57.17      -0.95   -16.49     16
   9       C    -0.61    -9.63     5.14     -39.58      -0.20    -9.84     16
  10       C     0.00     0.01     9.52     -39.58      -0.38    -0.37     16
  11       C    -0.08    -0.90    10.05     -39.58      -0.40    -1.30     16
  12       C    -0.06    -0.79     8.62     -39.58      -0.34    -1.13     16
  13       C     0.35     5.91     4.82     -39.58      -0.19     5.72     16
  14       F    -0.03    -0.73    16.67       2.25       0.04    -0.69     16
  15       F    -0.14    -2.60    15.31       2.25       0.03    -2.56     16
  16       F    -0.14    -3.24    15.30       2.25       0.03    -3.21     16
  17       F    -0.22    -4.75    15.32       2.25       0.03    -4.72     16
  18       F    -0.24    -4.86    15.31       2.25       0.03    -4.83     16
  19       C     0.01     0.15     8.10     -39.58      -0.32    -0.17     16
  20       C    -0.15    -2.66     5.93     -90.62      -0.54    -3.19     16
  21       C    -0.18    -3.36     9.50     -26.73      -0.25    -3.62     16
  22       C    -0.16    -2.82     9.81     -26.73      -0.26    -3.09     16
  23       H     0.09     1.61     7.50     -51.93      -0.39     1.22     16
  24       H     0.42     6.56     8.84     -34.46      -0.30     6.26     16
  25       H     0.17     1.86     7.62     -52.48      -0.40     1.46     16
  26       H     0.18     1.12     8.06     -52.49      -0.42     0.70     16
  27       H     0.18     1.92     7.40     -52.49      -0.39     1.53     16
  28       H     0.19     3.13     6.96     -52.49      -0.37     2.77     16
  29       H     0.10     1.52     8.14     -51.93      -0.42     1.10     16
  30       H     0.08     1.26     8.14     -51.93      -0.42     0.83     16
  31       H     0.12     2.77     5.61     -51.93      -0.29     2.48     16
  32       H     0.11     2.03     7.38     -51.93      -0.38     1.64     16
  33       H     0.08     1.16     8.14     -51.93      -0.42     0.74     16
 Total:         -1.00   -36.56   318.66                 -5.34   -41.90