REAL300017362310.mol2 34                                                        
   1       O    -0.69   -23.14    18.00     -20.23      -0.36   -23.51     16
   2       C     0.52    15.14     7.50      36.00       0.27    15.41     16
   3       O    -0.69   -20.59    14.92     -20.23      -0.30   -20.90     16
   4       C    -0.19    -4.29     6.25     -91.78      -0.57    -4.86     16
   5       H     0.10     2.02     8.14     -51.92      -0.42     1.60     16
   6       C    -0.17    -3.00     9.88     -26.69      -0.26    -3.26     16
   7       C    -0.15    -2.54     5.90     -90.58      -0.53    -3.08     16
   8       H     0.10     1.33     7.98     -51.93      -0.41     0.91     16
   9       C     0.14     2.26     5.07      -4.04      -0.02     2.24     16
  10       N    -1.11   -11.67     6.00     -10.61      -0.06   -11.74     16
  11       S     2.70    26.96     5.74    -107.50      -0.62    26.34     16
  12       O    -0.95   -10.14    17.28     -57.17      -0.99   -11.13     16
  13       O    -0.94   -12.31    16.76     -57.17      -0.96   -13.27     16
  14       C    -0.67    -5.70     5.95     -39.58      -0.24    -5.94     16
  15       C     0.05     0.45     9.52     -39.59      -0.38     0.08     16
  16       C    -0.13    -1.24     8.62     -39.59      -0.34    -1.58     16
  17       C     0.42     4.73     4.82     -39.58      -0.19     4.54     16
  18       F    -0.13    -2.69    16.66       2.25       0.04    -2.66     16
  19       F    -0.17    -2.85    15.31       2.25       0.03    -2.82     16
  20       F    -0.17    -2.88    15.32       2.25       0.03    -2.85     16
  21       F    -0.18    -2.93    15.32       2.25       0.03    -2.89     16
  22       F    -0.15    -2.60    15.31       2.25       0.03    -2.57     16
  23       C    -0.13    -1.06     8.62     -39.58      -0.34    -1.40     16
  24       C     0.04     0.23     9.52     -39.59      -0.38    -0.15     16
  25       H     0.09     1.30     8.14     -51.93      -0.42     0.87     16
  26       H     0.09     1.74     8.03     -51.93      -0.42     1.32     16
  27       H     0.08     1.40     7.49     -51.93      -0.39     1.01     16
  28       H     0.10     1.81     6.42     -51.93      -0.33     1.48     16
  29       H     0.42     3.31     8.54     -34.48      -0.29     3.02     16
  30       H     0.20     1.60     7.62     -52.49      -0.40     1.20     16
  31       H     0.20     1.77     7.40     -52.48      -0.39     1.38     16
  32       H     0.19     1.17     7.40     -52.49      -0.39     0.78     16
  33       H     0.19     0.58     7.62     -52.49      -0.40     0.18     16
 Total:         -1.00   -41.85   323.03                 -5.50   -47.36