REAL300024351415.mol2 34                                                        
   1       O    -0.55   -14.58    15.86      -3.04      -0.05   -14.62     16
   2       C     0.55    10.11     7.85      87.66       0.69    10.80     16
   3       C    -0.15    -3.43     5.67      71.24       0.40    -3.02     16
   4       S     0.06     2.13    21.45     -56.49      -1.21     0.91     16
   5       C     0.19     9.58     8.33     179.50       1.49    11.08     16
   6       N    -0.38   -17.99    11.98     -56.73      -0.68   -18.67     16
   7       N    -0.58   -30.22     7.39    -184.36      -1.36   -31.58     16
   8       C     0.55    35.09     9.41     179.01       1.68    36.77     16
   9       O    -0.69   -47.73    18.06      -4.76      -0.09   -47.82     16
  10       N    -0.69   -42.59    11.63    -323.75      -3.77   -46.36     16
  11       N    -0.71    -5.09     5.55    -466.79      -2.59    -7.68     16
  12       C     0.16     0.41     5.80      85.64       0.50     0.91     16
  13       C    -0.04     0.07     5.25     -19.86      -0.10    -0.04     16
  14       C    -0.06     0.49     9.70      22.27       0.22     0.70     16
  15       C    -0.03     0.27    10.05      22.27       0.22     0.49     16
  16       C    -0.10    -0.04     8.62      22.27       0.19     0.16     16
  17       C     0.32     3.10     4.82      22.27       0.11     3.21     16
  18       F    -0.22    -8.31    16.67      44.97       0.75    -7.56     16
  19       F    -0.16    -3.92    15.32      44.97       0.69    -3.23     16
  20       F    -0.17    -4.71    15.30      44.97       0.69    -4.02     16
  21       F    -0.16    -4.10    15.31      44.97       0.69    -3.41     16
  22       F    -0.16    -4.54    15.32      44.97       0.69    -3.85     16
  23       C    -0.10    -0.58     8.28      22.27       0.18    -0.40     16
  24       H     0.13     2.86     8.14      -2.39      -0.02     2.84     16
  25       H     0.14     2.79     8.14      -2.40      -0.02     2.77     16
  26       H     0.42    18.91     8.96    -213.28      -1.91    17.00     16
  27       H     0.42     0.91     8.46     -92.71      -0.78     0.13     16
  28       H     0.08     0.48     8.09      -2.39      -0.02     0.46     16
  29       H     0.12    -0.01     8.09      -2.39      -0.02    -0.03     16
  30       H     0.21    -3.18     8.06      -2.91      -0.02    -3.20     16
  31       H     0.23    -4.03     8.06      -2.91      -0.02    -4.05     16
  32       H     0.19    -0.01     7.40      -2.91      -0.02    -0.03     16
  33       H     0.17     1.44     7.40      -2.91      -0.02     1.42     16
 Total:         -1.00  -106.40   334.41                 -3.52  -109.92