REAL300020183346.mol2 38                                                        
   1       O    -0.55   -11.70    16.36      -3.86      -0.06   -11.76     16
   2       C     0.57     7.54     7.31      86.79       0.63     8.17     16
   3       C    -0.11    -0.67     5.09     -20.09      -0.10    -0.77     16
   4       C    -0.01    -0.01     7.40      22.53       0.17     0.16     16
   5       C    -0.10    -0.47     8.60      22.23       0.19    -0.28     16
   6       C     0.35     4.17     4.83      22.33       0.11     4.27     16
   7       F    -0.21    -7.70    16.66      44.97       0.75    -6.95     16
   8       F    -0.16    -4.34    15.29      44.97       0.69    -3.65     16
   9       F    -0.16    -4.16    15.30      44.97       0.69    -3.48     16
  10       F    -0.17    -4.63    15.30      44.97       0.69    -3.94     16
  11       F    -0.16    -3.95    15.30      44.97       0.69    -3.26     16
  12       C    -0.11    -0.79     8.60      22.23       0.19    -0.60     16
  13       C     0.00     0.00     9.65      22.53       0.22     0.22     16
  14       N    -0.59    -7.91     2.98    -823.23      -2.45   -10.36     16
  15       C     0.10     0.99     4.92      86.36       0.42     1.41     16
  16       C    -0.12    -2.76     5.34      30.67       0.16    -2.60     16
  17       C     0.03     0.83     2.62     -11.51      -0.03     0.80     16
  18       C     0.07     3.51     6.87     138.59       0.95     4.46     16
  19       N    -0.40   -22.46    12.43     -51.29      -0.64   -23.10     16
  20       N    -0.23   -13.95    13.47      37.02       0.50   -13.46     16
  21       N    -0.23   -13.90    13.47      37.02       0.50   -13.40     16
  22       N    -0.41   -23.22    12.43     -51.29      -0.64   -23.86     16
  23       C    -0.11    -3.11     5.33      30.52       0.16    -2.95     16
  24       C     0.13     2.16     6.41      86.21       0.55     2.72     16
  25       H     0.22    -1.38     6.69      -2.91      -0.02    -1.40     16
  26       H     0.21     0.41     7.38      -2.91      -0.02     0.38     16
  27       H     0.20     1.23     7.38      -2.91      -0.02     1.21     16
  28       H     0.20     0.56     8.06      -2.91      -0.02     0.54     16
  29       H     0.12     0.39     8.13      -2.38      -0.02     0.37     16
  30       H     0.12     0.45     4.80      -2.38      -0.01     0.43     16
  31       H     0.07     1.80     8.14      -2.38      -0.02     1.78     16
  32       H     0.05     1.47     8.14      -2.39      -0.02     1.45     16
  33       H     0.10     2.69     8.14      -2.39      -0.02     2.67     16
  34       H     0.06     1.86     8.14      -2.39      -0.02     1.84     16
  35       H     0.05     1.56     8.14      -2.39      -0.02     1.54     16
  36       H     0.09     1.74     7.00      -2.39      -0.02     1.72     16
  37       H     0.11     1.26     8.14      -2.39      -0.02     1.24     16
 Total:         -1.00   -92.51   330.22                  4.09   -88.42