REAL300019697353.mol2 36                                                        
   1       O    -0.52    -6.49    16.36       5.32       0.09    -6.40     16
   2       C     0.57     5.86     7.36     -12.33      -0.09     5.77     16
   3       C    -0.11    -0.91     5.18    -104.97      -0.54    -1.45     16
   4       C    -0.04    -0.29     7.41     -39.18      -0.29    -0.58     16
   5       C    -0.11    -0.96     8.60     -39.64      -0.34    -1.30     16
   6       C     0.38     4.01     4.83     -39.49      -0.19     3.82     16
   7       F    -0.01    -0.14    16.66       2.25       0.04    -0.10     16
   8       F    -0.19    -2.85    15.29       2.25       0.03    -2.82     16
   9       F    -0.11    -1.76    15.30       2.25       0.03    -1.72     16
  10       F    -0.23    -3.61    15.30       2.25       0.03    -3.58     16
  11       F    -0.24    -3.87    15.30       2.25       0.03    -3.83     16
  12       C    -0.11    -0.86     8.60     -39.64      -0.34    -1.20     16
  13       C    -0.02    -0.10     9.63     -39.19      -0.38    -0.48     16
  14       N    -0.60    -6.60     3.01    -173.13      -0.52    -7.13     16
  15       C     0.08     0.78     6.65      -3.54      -0.02     0.75     16
  16       C     0.05     0.53     6.98      37.31       0.26     0.79     16
  17       O    -0.36    -6.23    10.37     -35.23      -0.37    -6.59     16
  18       C     0.20     3.67     3.35     -27.51      -0.09     3.57     16
  19       C     0.05     1.17     7.25    -156.72      -1.14     0.04     16
  20       N    -0.36    -9.84    12.43      32.44       0.40    -9.44     16
  21       N    -0.19    -5.66    13.47      60.35       0.81    -4.85     16
  22       N    -0.19    -5.55    13.47      60.35       0.81    -4.74     16
  23       N    -0.37   -10.29    12.43      32.44       0.40    -9.88     16
  24       C     0.07     0.96     4.29      -3.32      -0.01     0.94     16
  25       H     0.18     1.19     6.35     -52.49      -0.33     0.86     16
  26       H     0.19     1.51     7.38     -52.48      -0.39     1.12     16
  27       H     0.19     1.18     7.38     -52.49      -0.39     0.79     16
  28       H     0.18     0.79     8.04     -52.49      -0.42     0.37     16
  29       H     0.10     0.95     7.06     -51.93      -0.37     0.58     16
  30       H     0.08     0.80     8.14     -51.93      -0.42     0.38     16
  31       H     0.06     0.60     8.14     -51.93      -0.42     0.17     16
  32       H     0.11     0.98     8.14     -51.93      -0.42     0.56     16
  33       H     0.07     1.25     8.14     -51.93      -0.42     0.82     16
  34       H     0.10     1.32     8.01     -51.93      -0.42     0.91     16
  35       H     0.10     1.17     4.89     -51.93      -0.25     0.91     16
 Total:         -1.00   -37.30   321.19                 -0.79   -38.09