REAL300008043830.mol2 34                                                        
   1       O    -0.22     3.78    17.46      19.05       0.33     4.11     16
   2       C     0.54   -13.40     7.39      71.23       0.53   -12.87     16
   3       O    -0.23     4.00    17.01      19.04       0.32     4.33     16
   4       C     0.07    -2.49     3.46     -10.35      -0.04    -2.52     16
   5       C    -0.16     4.96     6.13      31.99       0.20     5.15     16
   6       C     0.08    -2.00     6.98      86.86       0.61    -1.39     16
   7       N    -0.94    16.17     3.70    -506.41      -1.87    14.30     16
   8       S     2.76     3.31     5.94     -56.49      -0.34     2.98     16
   9       O    -0.93    -3.69    16.86    -128.00      -2.16    -5.85     16
  10       O    -0.93    -6.00    16.88    -128.00      -2.16    -8.16     16
  11       C    -0.72   -14.43     5.97      22.27       0.13   -14.30     16
  12       C     0.04     1.19     9.52      22.27       0.21     1.40     16
  13       C    -0.19   -10.84     8.62      22.27       0.19   -10.65     16
  14       C     0.47    35.53     4.82      22.27       0.11    35.64     16
  15       F    -0.28   -33.55    16.66      44.97       0.75   -32.80     16
  16       F    -0.58   -63.53    15.31      44.97       0.69   -62.84     16
  17       F    -0.60   -67.65    15.32      44.97       0.69   -66.96     16
  18       F    -0.59   -66.70    15.32      44.97       0.69   -66.01     16
  19       F    -0.59   -64.90    15.31      44.97       0.69   -64.21     16
  20       C    -0.19   -10.63     8.62      22.27       0.19   -10.44     16
  21       C     0.04     1.12     9.52      22.27       0.21     1.33     16
  22       C     0.05    -1.50     6.27      86.73       0.54    -0.96     16
  23       H     0.35   -18.10     8.14      -2.39      -0.02   -18.12     16
  24       H     0.19    -7.18     8.14      -2.39      -0.02    -7.20     16
  25       H     0.12    -2.79     8.04      -2.39      -0.02    -2.81     16
  26       H     0.16    -5.15     8.14      -2.39      -0.02    -5.17     16
  27       H     0.13    -2.39     8.14      -2.39      -0.02    -2.41     16
  28       H     0.22     3.51     7.62      -2.91      -0.02     3.49     16
  29       H     0.13     8.39     7.40      -2.91      -0.02     8.37     16
  30       H     0.13     8.27     7.40      -2.91      -0.02     8.25     16
  31       H     0.23     3.03     7.62      -2.91      -0.02     3.01     16
  32       H     0.18    -4.57     7.41      -2.39      -0.02    -4.59     16
  33       H     0.26    -9.65     8.14      -2.39      -0.02    -9.67     16
 Total:         -1.00  -317.88   319.26                  0.30  -317.58