REAL300032626174.mol2 33                                                        
   1       O    -0.42    -6.84    11.10       5.56       0.06    -6.78     16
   2       C     0.48     4.51     7.27     -10.98      -0.08     4.43     16
   3       C     0.36     2.21     5.30      36.01       0.19     2.40     16
   4       F     0.01     0.15    16.66       2.25       0.04     0.18     16
   5       F    -0.17    -3.28    13.71       2.25       0.03    -3.25     16
   6       F    -0.31    -4.70    15.87       2.25       0.04    -4.66     16
   7       F    -0.21    -3.24    15.88       2.25       0.04    -3.20     16
   8       F    -0.07    -1.15    13.71       2.25       0.03    -1.12     16
   9       N    -0.64    -3.51     3.57    -177.63      -0.63    -4.15     16
  10       C     0.09     0.00     8.42      -8.51      -0.07    -0.07     16
  11       C    -0.14    -0.20     8.02     -26.35      -0.21    -0.41     16
  12       C     0.14     0.82     4.05     -72.54      -0.29     0.53     16
  13       C     0.12     1.44     5.32      -4.04      -0.02     1.41     16
  14       N    -0.72   -13.16     4.24     -61.36      -0.26   -13.42     16
  15       C     0.61    15.69     7.81     -12.48      -0.10    15.59     16
  16       O    -0.51   -14.85    15.72     -13.01      -0.20   -15.05     16
  17       C    -0.05    -1.38     6.69     -83.92      -0.56    -1.95     16
  18       N    -0.49   -12.37    10.83      24.02       0.26   -12.11     16
  19       S     0.38     9.38    24.20    -107.50      -2.60     6.78     16
  20       N    -0.60   -18.50    12.18      28.49       0.35   -18.16     16
  21       C     0.38    12.81     8.19     -17.49      -0.14    12.67     16
  22       O    -0.66   -25.27    17.64     -37.37      -0.66   -25.92     16
  23       H     0.17     0.25     7.65     -51.93      -0.40    -0.15     16
  24       H     0.18     0.15     7.65     -51.93      -0.40    -0.25     16
  25       H     0.10    -0.18     8.14     -51.93      -0.42    -0.61     16
  26       H     0.09    -0.22     8.14     -51.93      -0.42    -0.64     16
  27       H     0.11    -0.05     8.14     -51.93      -0.42    -0.48     16
  28       H     0.11     0.20     8.11     -51.93      -0.42    -0.22     16
  29       H     0.11     0.54     8.14     -51.93      -0.42     0.11     16
  30       H     0.08     0.95     8.14     -51.93      -0.42     0.53     16
  31       H     0.07     1.04     8.14     -51.93      -0.42     0.62     16
  32       H     0.40     7.06     7.47     -40.82      -0.30     6.75     16
 Total:         -1.00   -51.74   316.10                 -4.10   -55.84