REAL300032247265.mol2 34                                                        
   1       O    -0.45    -5.54    12.83       5.55       0.07    -5.47     16
   2       C     0.48     3.59     7.22     -10.98      -0.08     3.51     16
   3       C     0.38     1.84     4.75      36.01       0.17     2.01     16
   4       F    -0.13    -2.44    16.66       2.25       0.04    -2.40     16
   5       F    -0.20    -2.77    15.87       2.25       0.04    -2.73     16
   6       F    -0.12    -1.82    13.72       2.25       0.03    -1.79     16
   7       F    -0.22    -2.85    15.88       2.25       0.04    -2.81     16
   8       F    -0.11    -1.75    13.70       2.25       0.03    -1.72     16
   9       N    -0.61    -3.76     2.96    -156.57      -0.46    -4.23     16
  10       C     0.06     0.30     6.00      -1.68      -0.01     0.29     16
  11       C     0.13     1.09     5.23     -62.56      -0.33     0.76     16
  12       H     0.14     1.14     8.09     -51.93      -0.42     0.72     16
  13       C    -0.15    -0.82     6.84     -22.10      -0.15    -0.97     16
  14       C     0.13     0.93     5.23     -62.35      -0.33     0.60     16
  15       H     0.15     0.94     8.08     -51.93      -0.42     0.52     16
  16       C     0.11     1.25     4.91      -0.80       0.00     1.24     16
  17       N    -0.63    -8.65     3.00    -156.74      -0.47    -9.12     16
  18       C     0.63    13.16     7.90     -12.48      -0.10    13.07     16
  19       O    -0.50   -12.22    16.13     -13.00      -0.21   -12.43     16
  20       C    -0.05    -1.32     6.64     -83.92      -0.56    -1.87     16
  21       N    -0.49   -10.14     8.61      24.03       0.21    -9.94     16
  22       S     0.40     8.24    24.20    -107.50      -2.60     5.64     16
  23       N    -0.60   -16.33    12.18      28.50       0.35   -15.98     16
  24       C     0.38    11.31     8.19     -17.49      -0.14    11.17     16
  25       O    -0.66   -22.80    17.64     -37.39      -0.66   -23.46     16
  26       H     0.18     0.18     7.65     -51.92      -0.40    -0.22     16
  27       H     0.18    -0.11     7.65     -51.93      -0.40    -0.51     16
  28       H     0.09     0.05     8.14     -51.93      -0.42    -0.37     16
  29       H     0.09     0.50     8.14     -51.93      -0.42     0.07     16
  30       H     0.10     0.33     8.14     -51.93      -0.42    -0.10     16
  31       H     0.10     0.64     8.14     -51.93      -0.42     0.22     16
  32       H     0.08     1.07     7.82     -51.93      -0.41     0.67     16
  33       H     0.09     1.14     7.60     -51.93      -0.39     0.74     16
 Total:         -1.00   -45.64   315.73                 -4.50   -50.14