REAL300017475224.mol2 34                                                        
   1       O    -0.64   -19.35    14.51     -27.85      -0.40   -19.75     16
   2       C     0.49    13.28     6.98      36.00       0.25    13.53     16
   3       O    -0.68   -20.86    17.15     -20.22      -0.35   -21.20     16
   4       C     0.08     1.43     1.24    -132.16      -0.16     1.27     16
   5       N    -1.07   -15.75     5.35       0.26       0.00   -15.75     16
   6       S     2.69    39.11     5.67    -107.50      -0.61    38.50     16
   7       O    -0.96   -14.08    17.52     -57.17      -1.00   -15.08     16
   8       O    -0.87   -17.44    13.52     -66.97      -0.91   -18.34     16
   9       C    -0.67    -6.95     4.11     -39.58      -0.16    -7.11     16
  10       C     0.04     0.44     7.46     -39.58      -0.30     0.15     16
  11       C    -0.13    -1.25     8.62     -39.58      -0.34    -1.59     16
  12       C     0.41     4.49     4.82     -39.58      -0.19     4.30     16
  13       F    -0.14    -2.70    16.66       2.25       0.04    -2.67     16
  14       F    -0.17    -2.71    15.31       2.25       0.03    -2.68     16
  15       F    -0.16    -2.66    15.32       2.25       0.03    -2.63     16
  16       F    -0.17    -2.72    15.32       2.25       0.03    -2.69     16
  17       F    -0.16    -2.60    15.31       2.25       0.03    -2.56     16
  18       C    -0.13    -1.06     8.62     -39.58      -0.34    -1.40     16
  19       C     0.03     0.24     9.53     -39.58      -0.38    -0.14     16
  20       C    -0.13    -2.09     7.21     -25.91      -0.19    -2.28     16
  21       C     0.06     0.89     5.58     -25.91      -0.14     0.74     16
  22       H     0.10     1.04     8.14     -51.93      -0.42     0.61     16
  23       F    -0.21    -3.30    17.41       2.25       0.04    -3.26     16
  24       C    -0.17    -2.65     7.01     -25.92      -0.18    -2.83     16
  25       H     0.41     4.69     8.80     -34.47      -0.30     4.38     16
  26       H     0.20     2.00     7.46     -52.49      -0.39     1.61     16
  27       H     0.19     1.57     7.40     -52.49      -0.39     1.18     16
  28       H     0.19     1.17     7.40     -52.48      -0.39     0.79     16
  29       H     0.19     0.76     7.82     -52.48      -0.41     0.35     16
  30       H     0.11     2.11     7.74     -51.93      -0.40     1.71     16
  31       H     0.08     1.01     8.10     -51.93      -0.42     0.59     16
  32       H     0.06     0.80     3.29     -51.93      -0.17     0.63     16
  33       H     0.12     2.11     7.86     -51.93      -0.41     1.70     16
 Total:         -1.00   -41.02   314.23                 -4.16   -45.17